A0A3Q0KIL0_SCHMA Loading...

Anoctamin

AlphaFold DB , UniProt , Accession A0A3Q0KIL0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 837 aa.

						>A0A3Q0KIL0_SCHMA|A0A3Q0KIL0
MDSGASEFVKMETPMSNDSEKLFSSQIHSDFGYYFNDGKRKIDYVLVWDEPVNENIINKVKKINSIYRKTFEDNLQTIGVQIEKEDVKTESLVTHYLKLHISWDLMCHHAECLNLRAPLELQNTKMKNWSEILLKTIGIPSIMSQNVPNSPPEYYTCPFKKSKLEKFIGHDNKESYFTPTQRHQVAYDILATQAYGSREKAQVGIDRLIQEEVYNAAYAIHEGPYEVDEEDLKNPEKMNPRQILYWYWARWGCWYRYQPLDHIRSYFGEKIGFYFAWLGLYTAWLLPAALVGIFVFIYGLVTINDYVPVREACERDTVMCPTCDISHGCRYWNLRELCVYLKLSYLFDHPGSVFYAIFMVIWGVTFLEYWKRKNAKLAHRWDVLDYEIEEERPRPQYSAHCTQYAKNPITDVLEPYFPPRARVARIIAGLICVMVMVMLVLVFIIAVIIYRFLIKIPLFQNKLLRSNAEIYATLSAAIVNLILIMCLGKVYETLAYKMTQWEMHRTQSEFDNQLIFKVFLFQFVNFYSSIFYVAFFKGQMVGYPGHYTSFFGLRNEACDNGGCLIELAQQLLVIMVGKQIISNCQEILLPKLRTWFHKYRKGLNKRNVASTSDLSSAHIFIEDYKLIPYEGLFDEYLEMVLQFGFITIFVAAFPLAPLFALLNNWIEIRLDAKKLVCETRRPLAERAQNIGVWFRILDFLVRLAVISNAFIIAFRSSFLPELMYKHEVRNDLVGFTNFTLAWAPPNTTSQPCRYKAFRDNNGEYSMFFWRLLALRLAFVIVFEHVAFVLANALDFFIPDVPSSLKERIQRERFLAKQALLDISLESRQPETKKNVSE
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34	Very low	31.8	Very low	240 Å²	240	151 Å²	151	100%	1.182	86%	0.855	S	S	*	*				0	85.3	0	-78.8	175.8	170.2	0	0	107.2
2	D	31.9	Very low	31.7	Very low	150 Å²	150	153.2 Å²	153.2	80%	0.802	85%	0.853	S	S	*	*			trans	49.7	98.6	144.3	-56.7	-7.4	0	0	0	120.6
3	S	32.4	Very low	31.7	Very low	117 Å²	117	149.9 Å²	149.9	82%	0.818	84%	0.839	S	S	*	*				36.8	115.4	121	56.5	0	0	0	0	119.5
4	G	36.5	Very low	32	Very low	83 Å²	83	148.1 Å²	148.1	86%	0.856	84%	0.838	S	S	*	*			trans	-151.4	81.5	157.6	0	0	0	0	0	110.1
5	A	33.1	Very low	32	Very low	110 Å²	110	145.9 Å²	145.9	91%	0.909	82%	0.819	S	S	*	*			trans	-79.5	132.5	167.1	0	0	0	0	0	109.1
6	S	34.6	Very low	32.3	Very low	116 Å²	116	141.1 Å²	141.1	81%	0.811	80%	0.798	S	S	*	*			trans	-121.5	120.7	161.5	76	0	0	0	0	109.3
7	E	32.7	Very low	32.6	Very low	183 Å²	183	140 Å²	140	86%	0.855	79%	0.79	S	S	*	*			trans	-52.5	139.5	-179.9	-77.8	165.3	123.7	0	0	114.3	V9	E7-V9 PolarHBondContact O-N 3.47Å
8	F	28.1	Very low	33	Very low	207 Å²	207	138.8 Å²	138.8	91%	0.908	78%	0.781	S	S	*	*			trans	-65.6	115.2	154.7	-93.8	-100.5	0	0	0	109.5
9	V	31.5	Very low	32.9	Very low	113 Å²	113	133.6 Å²	133.6	69%	0.685	76%	0.755	S	S	*	*			trans	-105.9	105.3	160.2	177.6	0	0	0	0	108	E7 M11	E7-V9 PolarHBondContact O-N 3.47Å; V9-M11 HydrophobicContact CG1-CG 4.39Å; V9-M11 PolarHBondContact O-N 3.48Å
10	K	26.8	Very low	32.8	Very low	183 Å²	183	132.9 Å²	132.9	80%	0.796	75%	0.745	S	S	*	*			trans	-71.5	109.2	159.7	-88.7	-178.5	171.5	-174.3	0	107.8
11	M	28.7	Very low	32.7	Very low	159 Å²	159	133.6 Å²	133.6	78%	0.783	74%	0.74	S	S	*	*			trans	-105.4	97.2	159.6	-104.3	-178.8	178.5	0	0	107.8	V9 T13	V9-M11 HydrophobicContact CG1-CG 4.39Å; V9-M11 PolarHBondContact O-N 3.48Å; M11-T13 PolarHBondContact O-N 3.22Å
12	E	30.3	Very low	32.4	Very low	177 Å²	177	127.4 Å²	127.4	83%	0.827	71%	0.711	S	S	*	*			trans	-77	91.7	159.2	-77.6	173.6	-178.2	0	0	107.2
13	T	31.7	Very low	32.2	Very low	111 Å²	111	126.3 Å²	126.3	68%	0.681	70%	0.7	S	S	*	*			trans	-86.5	131.5	164.8	43.6	0	0	0	0	109.1	M11 M15	M11-T13 PolarHBondContact O-N 3.22Å; T13-M15 PolarHBondContact O-N 3.47Å
14	P	35.8	Very low	31.9	Very low	125 Å²	125	123.4 Å²	123.4	81%	0.812	68%	0.679	S	S	*	*			trans	-62.8	127.8	177.2	26.3	-32.3	0	0	0	109.5	S16	P14-S16 PolarHBondContact O-N 3.13Å; P14-S16 VanDerWaalsContact O-N 3.09Å
15	M	31.4	Very low	31.5	Very low	114 Å²	114	122.7 Å²	122.7	56%	0.562	66%	0.661	S	S	*	*			trans	-55.3	114.6	176.9	-81.1	176.9	58.4	0	0	110	T13 S19 E20	T13-M15 PolarHBondContact O-N 3.47Å; M15-S19 WeakPolarHBondContact CA-OG 3.19Å; M15-S19 WeakPolarHBondContact CB-OG 3.47Å; M15-E20 HydrophobicContact CE-CB 4.37Å; M15-E20 HydrophobicContact CE-CG 4.15Å
16	S	37.7	Very low	31.5	Very low	69 Å²	69	121.7 Å²	121.7	48%	0.483	64%	0.637	S	S	.	*			trans	-63.5	148.6	166.8	65.4	0	0	0	0	110.4	P14 D18 S19 E20	P14-S16 PolarHBondContact O-N 3.13Å; P14-S16 VanDerWaalsContact O-N 3.09Å; S16-D18 PolarHBondContact O-N 3.03Å; S16-S19 PolarHBondContact N-OG 3.38Å; S16-S19 PolarHBondContact O-N 3.36Å; S16-S19 PolarHBondContact O-OG 3.31Å; S16-E20 PolarHBondContact O-N 3.16Å
17	N	37.9	Very low	31.3	Very low	123 Å²	123	120 Å²	120	66%	0.658	62%	0.619	S	S	*	*	H	α-helix	trans	-52.4	-22.1	177.8	-76.6	-2.5	0	0	0	114.2	K21	N17-K21 PolarHBondContact O-N 3.05Å; N17-K21 VanDerWaalsContact O-N 3.12Å
18	D	39.3	Very low	31.3	Very low	119 Å²	119	118.2 Å²	118.2	64%	0.636	61%	0.61	S	S	*	*	H	α-helix	trans	-74.9	-32.5	175.5	-66.4	-30	0	0	0	112.5	S16 K21 L22	S16-D18 PolarHBondContact O-N 3.03Å; D18-K21 PolarHBondContact O-N 3.33Å; D18-L22 PolarHBondContact O-N 2.87Å
19	S	31.6	Very low	32.1	Very low	40 Å²	40	112.1 Å²	112.1	28%	0.28	59%	0.593	S	S	.	*	H	α-helix	trans	-72.2	-29.3	171.8	53.5	0	0	0	0	112.6	M15 S16 L22 F23	M15-S19 WeakPolarHBondContact CA-OG 3.19Å; M15-S19 WeakPolarHBondContact CB-OG 3.47Å; S16-S19 PolarHBondContact N-OG 3.38Å; S16-S19 PolarHBondContact O-N 3.36Å; S16-S19 PolarHBondContact O-OG 3.31Å; S19-L22 PolarHBondContact O-N 3.1Å; S19-F23 VanDerWaalsContact O-CB 3.28Å; S19-F23 WeakPolarHBondContact O-CB 3.34Å; S19-F23 PolarHBondContact O-N 2.9Å
20	E	30.9	Very low	33.1	Very low	119 Å²	119	110.7 Å²	110.7	56%	0.556	58%	0.582	S	S	*	*	H	α-helix	trans	-71	-38.3	173.2	-135.4	175.7	-160.5	0	0	111.4	M15 S16 F23 S24	M15-E20 HydrophobicContact CE-CB 4.37Å; M15-E20 HydrophobicContact CE-CG 4.15Å; S16-E20 PolarHBondContact O-N 3.16Å; E20-F23 PolarHBondContact O-N 3.01Å; E20-S24 WeakPolarHBondContact O-CB 3.4Å; E20-S24 PolarHBondContact O-N 3.09Å; E20-S24 PolarHBondContact O-OG 3.36Å
21	K	30.2	Very low	34.3	Very low	147 Å²	147	106.6 Å²	106.6	64%	0.639	56%	0.564	S	S	*	*	H	α-helix	trans	-65.4	-40.9	170.6	-79.8	-179.5	177.9	176.4	0	112.4	N17 D18 S24 S25	N17-K21 PolarHBondContact O-N 3.05Å; N17-K21 VanDerWaalsContact O-N 3.12Å; D18-K21 PolarHBondContact O-N 3.33Å; K21-S24 WeakPolarHBondContact CA-OG 3.35Å; K21-S24 PolarHBondContact O-N 2.66Å; K21-S24 PolarHBondContact O-OG 3.43Å; K21-S25 PolarHBondContact O-N 2.94Å; K21-S25 PolarHBondContact O-OG 3.48Å
22	L	28	Very low	36.1	Very low	111 Å²	111	99.2 Å²	99.2	58%	0.581	53%	0.528	S	S	*	.	H	α-helix	trans	-67	-37.4	176.6	-133	101.7	0	0	0	112.6	D18 S19 S25 Q26	D18-L22 PolarHBondContact O-N 2.87Å; S19-L22 PolarHBondContact O-N 3.1Å; L22-S25 WeakPolarHBondContact CA-OG 3.41Å; L22-S25 PolarHBondContact O-N 2.88Å; L22-S25 PolarHBondContact O-OG 2.88Å; L22-Q26 PolarHBondContact O-N 3.06Å; L22-Q26 VanDerWaalsContact O-N 3.14Å
23	F	26.4	Very low	38.2	Very low	127 Å²	127	92.3 Å²	92.3	56%	0.557	50%	0.495	S	S	*	.	H	α-helix	trans	-68.8	-38.7	174.7	-147.9	-95.8	0	0	0	110.7	S19 E20 Q26 I27	S19-F23 VanDerWaalsContact O-CB 3.28Å; S19-F23 WeakPolarHBondContact O-CB 3.34Å; S19-F23 PolarHBondContact O-N 2.9Å; E20-F23 PolarHBondContact O-N 3.01Å; F23-Q26 PolarHBondContact O-N 3.09Å; F23-I27 HydrophobicContact CD1-CD1 3.66Å; F23-I27 HydrophobicContact CD1-CG1 4.37Å; F23-I27 HydrophobicContact CE1-CD1 4.03Å; F23-I27 WeakPolarHBondContact O-CD1 3.44Å; F23-I27 VanDerWaalsContact O-CG1 3.24Å; F23-I27 WeakPolarHBondContact O-CG1 3.46Å; F23-I27 PolarHBondContact O-N 3.43Å
24	S	26.1	Very low	40.7	Very low	56 Å²	56	90.1 Å²	90.1	39%	0.392	48%	0.475	S	S	.	.	H	α-helix	trans	-66.5	-34.8	174.6	76	0	0	0	0	113.2	E20 K21 I27 H28	E20-S24 WeakPolarHBondContact O-CB 3.4Å; E20-S24 PolarHBondContact O-N 3.09Å; E20-S24 PolarHBondContact O-OG 3.36Å; K21-S24 WeakPolarHBondContact CA-OG 3.35Å; K21-S24 PolarHBondContact O-N 2.66Å; K21-S24 PolarHBondContact O-OG 3.43Å; S24-I27 PolarHBondContact O-N 3.18Å; S24-H28 PolarHBondContact O-CD2 3.03Å; S24-H28 VanDerWaalsContact O-CD2 3.23Å; S24-H28 PolarHBondContact O-N 3.47Å; S24-H28 VanDerWaalsContact O-N 3.16Å
25	S	29.2	Very low	43.2	Very low	67 Å²	67	84.2 Å²	84.2	47%	0.469	44%	0.436	S	S	.	.	H	α-helix	trans	-72.8	-33.1	176.4	56.2	0	0	0	0	112.9	K21 L22 H28 S29	K21-S25 PolarHBondContact O-N 2.94Å; K21-S25 PolarHBondContact O-OG 3.48Å; L22-S25 WeakPolarHBondContact CA-OG 3.41Å; L22-S25 PolarHBondContact O-N 2.88Å; L22-S25 PolarHBondContact O-OG 2.88Å; S25-H28 PolarHBondContact O-N 3.12Å; S25-S29 PolarHBondContact O-N 3.37Å
26	Q	32.5	Very low	45.6	Very low	89 Å²	89	84 Å²	84	42%	0.416	44%	0.437	S	S	.	.	H	α-helix	trans	-70.8	-35.2	172.1	-80.5	-175.8	-65	0	0	112.6	L22 F23 H28 S29	L22-Q26 PolarHBondContact O-N 3.06Å; L22-Q26 VanDerWaalsContact O-N 3.14Å; F23-Q26 PolarHBondContact O-N 3.09Å; Q26-H28 VanDerWaalsContact C-N 3.25Å; Q26-H28 PolarHBondContact O-N 3.26Å; Q26-S29 PolarHBondContact O-N 3.48Å; Q26-S29 PolarHBondContact O-OG 3.37Å
27	I	31.6	Very low	47.8	Very low	81 Å²	81	83.9 Å²	83.9	42%	0.415	43%	0.431	S	S	.	.	H	α-helix	trans	-64.1	-34.2	173.4	-69.3	164.6	0	0	0	110.8	F23 S24 S29 D30 F31	F23-I27 HydrophobicContact CD1-CD1 3.66Å; F23-I27 HydrophobicContact CD1-CG1 4.37Å; F23-I27 HydrophobicContact CE1-CD1 4.03Å; F23-I27 WeakPolarHBondContact O-CD1 3.44Å; F23-I27 VanDerWaalsContact O-CG1 3.24Å; F23-I27 WeakPolarHBondContact O-CG1 3.46Å; F23-I27 PolarHBondContact O-N 3.43Å; S24-I27 PolarHBondContact O-N 3.18Å; I27-S29 VanDerWaalsContact C-N 3.34Å; I27-S29 PolarHBondContact O-N 2.93Å; I27-D30 PolarHBondContact O-N 3.25Å; I27-F31 HydrophobicContact CG2-CE2 3.71Å; I27-F31 HydrophobicContact CG2-CZ 4.05Å; I27-F31 WeakPolarHBondContact O-CD2 3.49Å; I27-F31 WeakPolarHBondContact O-CE2 3.48Å
28	H	31.7	Very low	49.8	Very low	145 Å²	145	79.8 Å²	79.8	67%	0.671	42%	0.418	S	S	*	.	H	α-helix	trans	-69.6	-24	177.5	-87.9	-64.9	0	0	0	114.7	S24 S25 Q26	S24-H28 PolarHBondContact O-CD2 3.03Å; S24-H28 VanDerWaalsContact O-CD2 3.23Å; S24-H28 PolarHBondContact O-N 3.47Å; S24-H28 VanDerWaalsContact O-N 3.16Å; S25-H28 PolarHBondContact O-N 3.12Å; Q26-H28 VanDerWaalsContact C-N 3.25Å; Q26-H28 PolarHBondContact O-N 3.26Å
29	S	45	Very low	52	Low	80 Å²	80	81.9 Å²	81.9	56%	0.559	42%	0.421	S	S	*	.	H	α-helix	trans	-80.6	-20.2	175.7	50.1	0	0	0	0	114.2	S25 Q26 I27	S25-S29 PolarHBondContact O-N 3.37Å; Q26-S29 PolarHBondContact O-N 3.48Å; Q26-S29 PolarHBondContact O-OG 3.37Å; I27-S29 VanDerWaalsContact C-N 3.34Å; I27-S29 PolarHBondContact O-N 2.93Å
30	D	52.3	Low	54.6	Low	83 Å²	83	83.5 Å²	83.5	44%	0.444	42%	0.421	S	S	.	.	H	α-helix	trans	-92.1	-13.8	-171.6	-85.8	-18.7	0	0	0	115.1	I27 G32 Y33 Y34	I27-D30 PolarHBondContact O-N 3.25Å; D30-G32 PolarHBondContact O-N 3.07Å; D30-Y33 PolarHBondContact O-N 3.06Å; D30-Y34 WeakPolarHBondContact O-CD2 3.48Å
31	F	52.2	Low	57.3	Low	97 Å²	97	80.5 Å²	80.5	43%	0.425	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-22.2	-175.7	-81.2	-76	0	0	0	114.6	I27 Y33	I27-F31 HydrophobicContact CG2-CE2 3.71Å; I27-F31 HydrophobicContact CG2-CZ 4.05Å; I27-F31 WeakPolarHBondContact O-CD2 3.49Å; I27-F31 WeakPolarHBondContact O-CE2 3.48Å; F31-Y33 PolarHBondContact O-N 3.27Å
32	G	65.5	Low	60.2	Low	3 Å²	3	73.5 Å²	73.5	3%	0.031	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-13.4	-176.9	0	0	0	0	0	116.4	D30 A617	D30-G32 PolarHBondContact O-N 3.07Å; G32-A617 WeakPolarHBondContact CA-O 3.34Å; G32-A617 PolarHBondContact N-O 3.47Å
33	Y	75.9	Confident	63.3	Low	33 Å²	33	68.2 Å²	68.2	13%	0.129	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-16	-177.5	-59.2	-77.6	0	0	0	114.3	D30 F31 K41 I42 I220 E222 G223 I619	D30-Y33 PolarHBondContact O-N 3.06Å; F31-Y33 PolarHBondContact O-N 3.27Å; Y33-K41 CarbonylContact O-C 3.55Å; Y33-K41 WeakPolarHBondContact O-CA 3.37Å; Y33-I42 WeakPolarHBondContact O-CG1 3.42Å; Y33-I42 PolarHBondContact O-N 2.9Å; Y33-I220 HydrophobicContact CD1-CD1 4.18Å; Y33-E222 VanDerWaalsContact OH-C 3.3Å; Y33-G223 WeakPolarHBondContact OH-CA 3.38Å; Y33-G223 PolarHBondContact OH-N 3.48Å; Y33-I619 HydrophobicContact CD1-CD1 3.79Å; Y33-I619 HydrophobicContact CD2-CD1 3.99Å; Y33-I619 HydrophobicContact CE1-CD1 3.25Å; Y33-I619 HydrophobicContact CE2-CD1 3.5Å; Y33-I619 VanDerWaalsContact CE2-CD1 3.5Å; Y33-I619 HydrophobicContact CG-CD1 4.14Å
34	Y	83.8	Confident	66.5	Low	65 Å²	65	62.9 Å²	62.9	26%	0.255	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-107.4	161.8	-174.8	-67.2	-89.3	0	0	0	109.6	D30 K39 R40 K41	D30-Y34 WeakPolarHBondContact O-CD2 3.48Å; Y34-K39 VanDerWaalsContact CD1-C 3.44Å; Y34-K39 WeakPolarHBondContact CD1-O 3.23Å; Y34-K39 WeakPolarHBondContact CE1-O 3.43Å; Y34-R40 CarbonylContact C-O 3.45Å; Y34-R40 WeakPolarHBondContact CA-O 3.44Å; Y34-K41 HydrophobicContact CD1-CB 4.34Å; Y34-K41 HydrophobicContact CE1-CB 4.21Å
35	F	87.4	Confident	69.7	Low	1 Å²	1	60.2 Å²	60.2	0%	0.004	31%	0.306	C	S	.	.			trans	-60	168.3	163.5	-82.6	31.2	0	0	0	109	D37 G38 R40 I42 E83 K98 H100	F35-D37 WeakPolarHBondContact CB-OD1 3.36Å; F35-D37 PolarHBondContact O-N 2.99Å; F35-G38 PolarHBondContact O-N 3.16Å; F35-R40 HydrophobicContact CB-CB 4.1Å; F35-R40 HydrophobicContact CD1-CB 4.42Å; F35-R40 HydrophobicContact CD2-CB 4.28Å; F35-R40 HydrophobicContact CG-CB 4.02Å; F35-R40 PolarHBondContact N-O 3.01Å; F35-I42 HydrophobicContact CD1-CG1 3.76Å; F35-I42 HydrophobicContact CE1-CG1 3.98Å; F35-E83 WeakPolarHBondContact CB-OE2 3.35Å; F35-E83 HydrophobicContact CD2-CB 3.6Å; F35-E83 HydrophobicContact CD2-CG 4.44Å; F35-E83 WeakPolarHBondContact CD2-OE2 3.44Å; F35-E83 HydrophobicContact CE1-CB 4.48Å; F35-E83 HydrophobicContact CE2-CB 3.51Å; F35-E83 HydrophobicContact CG-CB 4.17Å; F35-E83 WeakPolarHBondContact CG-OE2 3.48Å; F35-E83 HydrophobicContact CZ-CB 3.98Å; F35-K98 HydrophobicContact CD1-CB 4.16Å; F35-K98 HydrophobicContact CD1-CD 4.4Å; F35-K98 HydrophobicContact CE1-CB 3.53Å; F35-K98 HydrophobicContact CZ-CB 3.98Å; F35-K98 WeakPolarHBondContact CZ-O 3.37Å; F35-H100 HydrophobicContact CE1-CB 3.82Å; F35-H100 HydrophobicContact CE2-CB 4.21Å; F35-H100 HydrophobicContact CZ-CB 3.61Å
36	N	82.8	Confident	72.8	Confident	108 Å²	108	57 Å²	57	58%	0.578	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-11.4	-178.1	-69	-18	0	0	0	113.8	E83 K98	N36-E83 PolarHBondContact N-OE1 3.42Å; N36-E83 PolarHBondContact N-OE2 3.29Å; N36-E83 PolarHBondContact ND2-OE1 2.85Å; N36-E83 VanDerWaalsContact ND2-OE1 3.12Å; N36-E83 PolarHBondContact OD1-OE1 3.17Å; N36-K98 PolarHBondContact OD1-NZ 3.06Å
37	D	83.4	Confident	75.7	Confident	68 Å²	68	52.8 Å²	52.8	36%	0.364	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-8	173.9	63.1	17.9	0	0	0	115.4	F35 K39 R40	F35-D37 WeakPolarHBondContact CB-OD1 3.36Å; F35-D37 PolarHBondContact O-N 2.99Å; D37-K39 PolarHBondContact O-N 3.38Å; D37-K39 PolarHBondContact OD1-N 3.12Å; D37-R40 PolarHBondContact OD1-N 3.31Å; D37-R40 IonicContact OD1-NE 3.31Å; D37-R40 IonicContact OD2-CZ 2.93Å; D37-R40 IonicContact OD2-NE 3.08Å; D37-R40 PolarHBondContact OD2-NE 3.23Å; D37-R40 IonicContact OD2-NH2 3.33Å; D37-R40 PolarHBondContact OD2-NH2 3.47Å
38	G	80.9	Confident	78.6	Confident	36 Å²	36	49.7 Å²	49.7	37%	0.371	25%	0.247	S	C	.	.	S	Bend	trans	69.3	8.3	-179	0	0	0	0	0	115.2	F35	F35-G38 PolarHBondContact O-N 3.16Å
39	K	83.7	Confident	81.2	Confident	163 Å²	163	44.4 Å²	44.4	71%	0.709	22%	0.223	S	C	*	.	S	Bend	trans	-112.8	-40.7	-175.9	-66.9	-176.4	-178.3	-178.3	0	112.9	Y34 D37	Y34-K39 VanDerWaalsContact CD1-C 3.44Å; Y34-K39 WeakPolarHBondContact CD1-O 3.23Å; Y34-K39 WeakPolarHBondContact CE1-O 3.43Å; D37-K39 PolarHBondContact O-N 3.38Å; D37-K39 PolarHBondContact OD1-N 3.12Å
40	R	87.4	Confident	83.1	Confident	75 Å²	75	43.9 Å²	43.9	28%	0.283	21%	0.212	S	C	.	.	S	Bend	trans	-94.6	117	-173.5	-66.8	177	-73.5	171.7	-0	111.3	Y34 F35 D37 H100	Y34-R40 CarbonylContact C-O 3.45Å; Y34-R40 WeakPolarHBondContact CA-O 3.44Å; F35-R40 HydrophobicContact CB-CB 4.1Å; F35-R40 HydrophobicContact CD1-CB 4.42Å; F35-R40 HydrophobicContact CD2-CB 4.28Å; F35-R40 HydrophobicContact CG-CB 4.02Å; F35-R40 PolarHBondContact N-O 3.01Å; D37-R40 PolarHBondContact OD1-N 3.31Å; D37-R40 IonicContact OD1-NE 3.31Å; D37-R40 IonicContact OD2-CZ 2.93Å; D37-R40 IonicContact OD2-NE 3.08Å; D37-R40 PolarHBondContact OD2-NE 3.23Å; D37-R40 IonicContact OD2-NH2 3.33Å; D37-R40 PolarHBondContact OD2-NH2 3.47Å; R40-H100 HydrophobicContact CB-CB 4.36Å
41	K	88	Confident	84.5	Confident	55 Å²	55	42.1 Å²	42.1	24%	0.239	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-71.3	137	179.8	-170.8	172.6	-178	168.4	0	112	Y33 Y34 D43 H100	Y33-K41 CarbonylContact O-C 3.55Å; Y33-K41 WeakPolarHBondContact O-CA 3.37Å; Y34-K41 HydrophobicContact CD1-CB 4.34Å; Y34-K41 HydrophobicContact CE1-CB 4.21Å; K41-D43 PolarHBondContact O-N 3.1Å; K41-H100 PolarHBondContact O-ND1 3.21Å
42	I	91.2	Very high	85.4	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-74.6	120.2	174	-56.5	165.7	0	0	0	108.7	Y33 F35 V45 K98 I220 F620	Y33-I42 WeakPolarHBondContact O-CG1 3.42Å; Y33-I42 PolarHBondContact O-N 2.9Å; F35-I42 HydrophobicContact CD1-CG1 3.76Å; F35-I42 HydrophobicContact CE1-CG1 3.98Å; I42-V45 HydrophobicContact CG2-CG2 3.66Å; I42-K98 HydrophobicContact CD1-CD 3.85Å; I42-K98 HydrophobicContact CD1-CG 4.28Å; I42-K98 HydrophobicContact CG1-CB 4.26Å; I42-K98 HydrophobicContact CG1-CD 4.22Å; I42-K98 HydrophobicContact CG1-CG 4.48Å; I42-K98 HydrophobicContact CG2-CB 4.31Å; I42-I220 HydrophobicContact CB-CD1 3.89Å; I42-I220 HydrophobicContact CG2-CD1 4.17Å; I42-I220 HydrophobicContact CG2-CG2 4.36Å; I42-I220 WeakPolarHBondContact O-CD1 3.18Å; I42-F620 HydrophobicContact CD1-CD1 4.19Å
43	D	91.8	Very high	85.3	Confident	1 Å²	1	48 Å²	48	1%	0.005	24%	0.243	C	C	.	.			trans	-98.3	-32.2	178.3	-61.3	-45.7	0	0	0	112.3	K41 L99 H100 I101 R182 H183 A186	K41-D43 PolarHBondContact O-N 3.1Å; D43-L99 PolarHBondContact N-O 2.88Å; D43-H100 IonicContact OD2-ND1 3.82Å; D43-I101 HydrophobicContact CB-CD1 4.45Å; D43-I101 PolarHBondContact OD2-N 2.94Å; D43-R182 VanDerWaalsContact CG-NH2 3.33Å; D43-R182 IonicContact OD1-CZ 2.73Å; D43-R182 IonicContact OD1-NE 3.59Å; D43-R182 PolarHBondContact OD1-NE 3.49Å; D43-R182 IonicContact OD1-NH2 2.71Å; D43-R182 PolarHBondContact OD1-NH2 3.33Å; D43-R182 IonicContact OD2-CZ 3.67Å; D43-R182 IonicContact OD2-NE 2.65Å; D43-R182 IonicContact OD2-NH2 3.84Å; D43-R182 PolarHBondContact OD2-NH2 3.4Å; D43-H183 PolarHBondContact O-CD2 3.05Å; D43-H183 PolarHBondContact O-NE2 3.1Å; D43-A186 HydrophobicContact CB-CB 4.35Å
44	Y	93.5	Very high	84.6	Confident	15 Å²	15	50.8 Å²	50.8	6%	0.059	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	151.5	-177.2	-140.6	-100.7	0	0	0	110.4	L46 L99 A186 L190 A217 A219	Y44-L46 HydrophobicContact CD1-CD2 4.07Å; Y44-L46 HydrophobicContact CE1-CD2 4.38Å; Y44-L99 PolarHBondContact N-O 3.38Å; Y44-L99 WeakPolarHBondContact O-CB 3.33Å; Y44-L99 PolarHBondContact O-N 3.41Å; Y44-A186 HydrophobicContact CD2-CB 4.16Å; Y44-A186 HydrophobicContact CG-CB 4.33Å; Y44-L190 HydrophobicContact CD1-CD1 3.28Å; Y44-L190 HydrophobicContact CE1-CD1 3.62Å; Y44-L190 HydrophobicContact CG-CD1 3.9Å; Y44-A217 HydrophobicContact CE1-CB 3.73Å; Y44-A219 HydrophobicContact CD2-CB 4.08Å; Y44-A219 HydrophobicContact CE2-CB 3.96Å
45	V	93.9	Very high	83.3	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	126.2	-179.3	-176.9	0	0	0	0	109.9	I42 V47 Y96 L97 A217 Y218 I220 F620	I42-V45 HydrophobicContact CG2-CG2 3.66Å; V45-V47 HydrophobicContact CG1-CG2 3.89Å; V45-Y96 HydrophobicContact CG1-CD1 4.1Å; V45-L97 WeakPolarHBondContact CA-O 3.44Å; V45-A217 WeakPolarHBondContact O-CA 3.39Å; V45-Y218 HydrophobicContact CB-CE2 4.2Å; V45-Y218 PolarHBondContact N-O 3.15Å; V45-Y218 PolarHBondContact O-N 2.96Å; V45-I220 HydrophobicContact CG2-CG2 3.74Å; V45-F620 HydrophobicContact CG2-CB 4.02Å
46	L	94.6	Very high	81.9	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	140.8	168.4	-44.5	-175.4	0	0	0	109.4	Y44 F71 L97 L99 L190 I205 Y214 A217	Y44-L46 HydrophobicContact CD1-CD2 4.07Å; Y44-L46 HydrophobicContact CE1-CD2 4.38Å; L46-F71 HydrophobicContact CD1-CE1 4.06Å; L46-L97 HydrophobicContact CB-CB 3.99Å; L46-L97 HydrophobicContact CB-CD2 4.41Å; L46-L97 HydrophobicContact CD1-CD2 3.87Å; L46-L97 HydrophobicContact CG-CD2 4.29Å; L46-L97 PolarHBondContact N-O 3.26Å; L46-L97 PolarHBondContact O-N 2.94Å; L46-L99 HydrophobicContact CD1-CD1 4.29Å; L46-L99 HydrophobicContact CD2-CD1 4.3Å; L46-L99 HydrophobicContact CG-CD1 4.01Å; L46-L190 HydrophobicContact CD1-CD2 4.26Å; L46-L190 HydrophobicContact CD2-CD1 4.12Å; L46-L190 HydrophobicContact CD2-CD2 4.4Å; L46-I205 HydrophobicContact CD1-CD1 4.14Å; L46-I205 HydrophobicContact CD2-CD1 3.93Å; L46-I205 HydrophobicContact CD2-CG1 4.17Å; L46-Y214 HydrophobicContact CB-CD1 4.02Å; L46-Y214 HydrophobicContact CB-CE1 3.97Å; L46-Y214 HydrophobicContact CD1-CE1 4.2Å; L46-Y214 HydrophobicContact CD1-CE2 4.03Å; L46-A217 HydrophobicContact CD2-CB 3.47Å; L46-A217 VanDerWaalsContact CD2-CB 3.47Å
47	V	93	Very high	80.8	Confident	0 Å²	0	63 Å²	63	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	137.3	-176.9	-171.9	0	0	0	0	111	V45 T94 H95 Y96 N215 A216 Y218 Y624	V45-V47 HydrophobicContact CG1-CG2 3.89Å; V47-T94 HydrophobicContact CG1-CG2 3.41Å; V47-T94 VanDerWaalsContact CG1-CG2 3.41Å; V47-H95 WeakPolarHBondContact CA-O 3.34Å; V47-Y96 HydrophobicContact CG1-CD1 4.24Å; V47-Y96 HydrophobicContact CG1-CE1 4.1Å; V47-Y96 HydrophobicContact CG2-CD1 3.56Å; V47-Y96 HydrophobicContact CG2-CE1 3.82Å; V47-N215 PolarHBondContact O-N 3.19Å; V47-A216 PolarHBondContact N-O 3.27Å; V47-A216 PolarHBondContact O-N 3.36Å; V47-Y218 HydrophobicContact CG2-CE1 3.7Å; V47-Y624 HydrophobicContact CB-CD2 4.36Å; V47-Y624 HydrophobicContact CB-CE2 3.92Å; V47-Y624 HydrophobicContact CG1-CD1 4.35Å; V47-Y624 HydrophobicContact CG1-CD2 4.29Å; V47-Y624 HydrophobicContact CG1-CE1 3.77Å; V47-Y624 HydrophobicContact CG1-CE2 3.74Å; V47-Y624 WeakPolarHBondContact CG1-OH 3.49Å; V47-Y624 HydrophobicContact CG2-CD2 4.19Å; V47-Y624 HydrophobicContact CG2-CE2 4.27Å
48	W	92.1	Very high	80.3	Confident	16 Å²	16	63.7 Å²	63.7	6%	0.061	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	149.9	166.4	73.9	98.8	0	0	0	110.8	E50 H95 L97 Y214	W48-E50 PolarHBondContact NE1-OE1 3.41Å; W48-H95 AromaticContact CD1-CD2 3.85Å; W48-H95 HydrophobicContact CD2-CB 3.61Å; W48-H95 AromaticContact CE2-CD2 3.6Å; W48-H95 AromaticContact CE2-CG 3.52Å; W48-H95 HydrophobicContact CE3-CB 3.76Å; W48-H95 HydrophobicContact CG-CB 4.36Å; W48-H95 HydrophobicContact CH2-CB 3.45Å; W48-H95 VanDerWaalsContact CH2-CB 3.45Å; W48-H95 HydrophobicContact CZ2-CB 3.26Å; W48-H95 AromaticContact CZ2-CD2 3.95Å; W48-H95 AromaticContact CZ2-CG 3.47Å; W48-H95 VanDerWaalsContact CZ2-CG 3.47Å; W48-H95 HydrophobicContact CZ3-CB 3.69Å; W48-H95 PolarHBondContact N-O 2.9Å; W48-H95 AromaticContact NE1-CD2 3.24Å; W48-H95 PolarHBondContact NE1-CD2 3.03Å; W48-H95 AromaticContact NE1-CG 3.69Å; W48-H95 PolarHBondContact O-N 3.11Å; W48-L97 HydrophobicContact CZ3-CB 4.21Å; W48-Y214 HydrophobicContact CB-CD1 4.24Å; W48-Y214 HydrophobicContact CD2-CD1 4.45Å; W48-Y214 HydrophobicContact CD2-CE1 4.32Å; W48-Y214 AromaticContact CE3-CD1 3.85Å; W48-Y214 HydrophobicContact CE3-CD1 3.85Å; W48-Y214 AromaticContact CE3-CE1 3.56Å; W48-Y214 HydrophobicContact CE3-CE1 3.56Å; W48-Y214 AromaticContact CZ3-CE1 3.98Å; W48-Y214 HydrophobicContact CZ3-CE1 3.98Å
49	D	87.3	Confident	80.2	Confident	33 Å²	33	70 Å²	70	18%	0.176	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	134.9	-178.5	-55.6	-39.8	0	0	0	109.7	T94 N215 K601 Y624	D49-T94 WeakPolarHBondContact OD1-CB 3.07Å; D49-T94 WeakPolarHBondContact OD1-CG2 3.29Å; D49-T94 PolarHBondContact OD1-OG1 3.5Å; D49-N215 VanDerWaalsContact CB-ND2 3.34Å; D49-N215 WeakPolarHBondContact CB-ND2 3.36Å; D49-N215 PolarHBondContact N-ND2 3.46Å; D49-N215 PolarHBondContact OD2-ND2 2.87Å; D49-K601 WeakPolarHBondContact OD2-CE 3.36Å; D49-K601 IonicContact OD2-NZ 3.33Å; D49-K601 PolarHBondContact OD2-NZ 2.88Å; D49-Y624 PolarHBondContact OD1-OH 3.32Å; D49-Y624 PolarHBondContact OD2-OH 3.48Å; D49-Y624 VanDerWaalsContact OD2-OH 3.05Å
50	E	84.8	Confident	80.1	Confident	70 Å²	70	66.7 Å²	66.7	33%	0.327	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	130.7	174.4	-64.2	-169.1	179.9	0	0	110.8	W48 R68 V93 H95	W48-E50 PolarHBondContact NE1-OE1 3.41Å; E50-R68 IonicContact OE1-CZ 3.16Å; E50-R68 IonicContact OE1-NH2 3.62Å; E50-R68 PolarHBondContact OE1-NH2 3.46Å; E50-V93 PolarHBondContact N-O 3.48Å; E50-V93 PolarHBondContact O-N 2.7Å; E50-H95 IonicContact OE2-NE2 2.64Å
51	P	80.4	Confident	79.8	Confident	46 Å²	46	66.5 Å²	66.5	30%	0.299	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	137.1	176.9	29	-34.2	0	0	0	111.7	N53 E54 L92	P51-N53 PolarHBondContact O-N 2.94Å; P51-E54 HydrophobicContact CB-CG 4.46Å; P51-E54 HydrophobicContact CG-CB 4.31Å; P51-E54 HydrophobicContact CG-CG 3.9Å; P51-L92 HydrophobicContact CB-CD2 4.41Å
52	V	71.2	Confident	79.6	Confident	72 Å²	72	70.5 Å²	70.5	44%	0.436	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-34.5	-174.8	179.2	0	0	0	0	112.6	S91 V93	V52-S91 PolarHBondContact N-O 3.18Å; V52-V93 HydrophobicContact CG2-CG2 3.78Å
53	N	64.5	Low	79.4	Confident	151 Å²	151	73.4 Å²	73.4	81%	0.807	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.8	41	-168.1	-77.6	-15.2	0	0	0	115	P51	P51-N53 PolarHBondContact O-N 2.94Å
54	E	61	Low	79.3	Confident	92 Å²	92	74.7 Å²	74.7	43%	0.43	38%	0.379	S	S	.	.			trans	-104	97.1	171.2	-82.9	-170.6	-168.8	0	0	112.7	P51 I56 K61	P51-E54 HydrophobicContact CB-CG 4.46Å; P51-E54 HydrophobicContact CG-CB 4.31Å; P51-E54 HydrophobicContact CG-CG 3.9Å; E54-I56 PolarHBondContact O-N 3.5Å; E54-K61 WeakPolarHBondContact OE2-CE 2.88Å; E54-K61 IonicContact OE2-NZ 2.96Å; E54-K61 PolarHBondContact OE2-NZ 3.29Å
55	N	57.2	Low	79.1	Confident	172 Å²	172	77 Å²	77	92%	0.92	40%	0.397	S	S	*	.			trans	-71.5	-2.8	167	-76.5	-18.5	0	0	0	113.3
56	I	57	Low	79	Confident	120 Å²	120	81.1 Å²	81.1	62%	0.615	42%	0.418	S	S	*	.			trans	-101.8	98.3	179.1	-56	176	0	0	0	108.2	E54 N58	E54-I56 PolarHBondContact O-N 3.5Å; I56-N58 WeakPolarHBondContact CG2-OD1 3.32Å; I56-N58 PolarHBondContact O-N 3.16Å
57	I	60.9	Low	78.9	Confident	137 Å²	137	83.9 Å²	83.9	70%	0.703	43%	0.429	S	S	*	.			trans	-67.7	88.1	166.6	-58.6	173.1	0	0	0	107.3	K59 K62	I57-K59 PolarHBondContact O-N 2.84Å; I57-K62 HydrophobicContact CG2-CB 4.33Å
58	N	72.6	Confident	78.9	Confident	83 Å²	83	85.1 Å²	85.1	44%	0.444	43%	0.434	S	S	.	.			trans	-60.5	136.3	170.9	-81.9	-24.7	0	0	0	109	I56 V60 K61 K62	I56-N58 WeakPolarHBondContact CG2-OD1 3.32Å; I56-N58 PolarHBondContact O-N 3.16Å; N58-V60 PolarHBondContact O-N 2.68Å; N58-K61 WeakPolarHBondContact O-CB 3.29Å; N58-K61 PolarHBondContact O-N 3.31Å; N58-K62 PolarHBondContact O-N 3.5Å
59	K	77.7	Confident	78.9	Confident	170 Å²	170	90.5 Å²	90.5	74%	0.739	46%	0.457	S	S	*	.	H	α-helix	trans	-47.8	-35.2	177.5	-174.5	178.9	178.7	-179.3	0	112.1	I57 K62 I63	I57-K59 PolarHBondContact O-N 2.84Å; K59-K62 PolarHBondContact O-N 2.78Å; K59-I63 HydrophobicContact CG-CD1 4.15Å; K59-I63 VanDerWaalsContact O-CG1 3.31Å; K59-I63 WeakPolarHBondContact O-CG1 3.42Å; K59-I63 PolarHBondContact O-N 2.78Å; K59-I63 VanDerWaalsContact O-N 3.11Å
60	V	81.4	Confident	79.2	Confident	93 Å²	93	91.2 Å²	91.2	56%	0.564	46%	0.463	S	S	*	.	H	α-helix	trans	-61	-47.8	175.4	-178	0	0	0	0	112.2	N58 K62 I63 N64	N58-V60 PolarHBondContact O-N 2.68Å; V60-K62 VanDerWaalsContact C-N 3.31Å; V60-K62 PolarHBondContact O-N 2.64Å; V60-I63 WeakPolarHBondContact O-CB 3.37Å; V60-I63 PolarHBondContact O-N 3.25Å; V60-I63 VanDerWaalsContact O-N 3.13Å; V60-N64 PolarHBondContact O-N 2.96Å; V60-N64 PolarHBondContact O-OD1 3.16Å
61	K	81.6	Confident	79.7	Confident	70 Å²	70	87.9 Å²	87.9	30%	0.304	45%	0.448	S	S	.	.	H	α-helix	trans	-60.5	-40.8	178.1	-76.3	-172.3	165.2	-172.9	0	112.3	E54 N58 I63 N64 S65	E54-K61 WeakPolarHBondContact OE2-CE 2.88Å; E54-K61 IonicContact OE2-NZ 2.96Å; E54-K61 PolarHBondContact OE2-NZ 3.29Å; N58-K61 WeakPolarHBondContact O-CB 3.29Å; N58-K61 PolarHBondContact O-N 3.31Å; K61-I63 VanDerWaalsContact C-N 3.33Å; K61-I63 PolarHBondContact O-N 2.78Å; K61-N64 PolarHBondContact O-N 3.43Å; K61-S65 WeakPolarHBondContact O-CB 3.27Å; K61-S65 PolarHBondContact O-N 2.86Å
62	K	84.2	Confident	80.3	Confident	139 Å²	139	86.4 Å²	86.4	60%	0.604	44%	0.437	S	S	*	.	H	α-helix	trans	-62.4	-42.1	176.2	-169.8	175.3	-178	176.8	0	111.2	I57 N58 K59 V60 I66	I57-K62 HydrophobicContact CG2-CB 4.33Å; N58-K62 PolarHBondContact O-N 3.5Å; K59-K62 PolarHBondContact O-N 2.78Å; V60-K62 VanDerWaalsContact C-N 3.31Å; V60-K62 PolarHBondContact O-N 2.64Å; K62-I66 HydrophobicContact CG-CD1 4.32Å; K62-I66 WeakPolarHBondContact O-CD1 3.17Å; K62-I66 VanDerWaalsContact O-CG1 3.24Å; K62-I66 WeakPolarHBondContact O-CG1 3.37Å; K62-I66 PolarHBondContact O-N 3.43Å; K62-I66 VanDerWaalsContact O-N 3.11Å
63	I	87	Confident	81.5	Confident	62 Å²	62	86.2 Å²	86.2	32%	0.318	43%	0.433	S	S	.	.	H	α-helix	trans	-64.4	-48.2	175.7	-68	165.8	0	0	0	110.8	K59 V60 K61 S65 I66 Y67	K59-I63 HydrophobicContact CG-CD1 4.15Å; K59-I63 VanDerWaalsContact O-CG1 3.31Å; K59-I63 WeakPolarHBondContact O-CG1 3.42Å; K59-I63 PolarHBondContact O-N 2.78Å; K59-I63 VanDerWaalsContact O-N 3.11Å; V60-I63 WeakPolarHBondContact O-CB 3.37Å; V60-I63 PolarHBondContact O-N 3.25Å; V60-I63 VanDerWaalsContact O-N 3.13Å; K61-I63 VanDerWaalsContact C-N 3.33Å; K61-I63 PolarHBondContact O-N 2.78Å; I63-S65 VanDerWaalsContact C-N 3.31Å; I63-S65 PolarHBondContact O-N 2.89Å; I63-I66 WeakPolarHBondContact O-CB 3.21Å; I63-I66 PolarHBondContact O-N 3.13Å; I63-I66 VanDerWaalsContact O-N 3.1Å; I63-Y67 HydrophobicContact CG2-CD2 3.84Å; I63-Y67 HydrophobicContact CG2-CE1 4.2Å; I63-Y67 HydrophobicContact CG2-CE2 3.3Å; I63-Y67 HydrophobicContact CG2-CG 4.49Å; I63-Y67 PolarHBondContact O-N 3.4Å
64	N	89.4	Confident	82.8	Confident	28 Å²	28	81.7 Å²	81.7	15%	0.15	41%	0.409	C	S	.	.	H	α-helix	trans	-61.4	-40.2	179.9	-68.5	8.5	0	0	0	111.5	V60 K61 I66 Y67 R68 V213	V60-N64 PolarHBondContact O-N 2.96Å; V60-N64 PolarHBondContact O-OD1 3.16Å; K61-N64 PolarHBondContact O-N 3.43Å; N64-I66 PolarHBondContact O-N 2.88Å; N64-Y67 PolarHBondContact O-N 3.43Å; N64-R68 WeakPolarHBondContact O-CG 3.33Å; N64-R68 PolarHBondContact O-N 3.22Å; N64-V213 HydrophobicContact CB-CG1 4.35Å; N64-V213 HydrophobicContact CB-CG2 4.39Å
65	S	89	Confident	84.4	Confident	63 Å²	63	77.3 Å²	77.3	44%	0.441	39%	0.389	S	S	.	.	H	α-helix	trans	-62.1	-40.6	174.2	178.6	0	0	0	0	112.4	K61 I63 R68 K69	K61-S65 WeakPolarHBondContact O-CB 3.27Å; K61-S65 PolarHBondContact O-N 2.86Å; I63-S65 VanDerWaalsContact C-N 3.31Å; I63-S65 PolarHBondContact O-N 2.89Å; S65-R68 PolarHBondContact O-N 3.2Å; S65-K69 WeakPolarHBondContact O-CB 3.39Å; S65-K69 PolarHBondContact O-N 3.38Å
66	I	91.8	Very high	86.2	Confident	86 Å²	86	74.4 Å²	74.4	44%	0.441	37%	0.369	S	S	.	.	H	α-helix	trans	-64.2	-44.2	175	-68.2	162.4	0	0	0	110.9	K62 I63 N64 K69 T70	K62-I66 HydrophobicContact CG-CD1 4.32Å; K62-I66 WeakPolarHBondContact O-CD1 3.17Å; K62-I66 VanDerWaalsContact O-CG1 3.24Å; K62-I66 WeakPolarHBondContact O-CG1 3.37Å; K62-I66 PolarHBondContact O-N 3.43Å; K62-I66 VanDerWaalsContact O-N 3.11Å; I63-I66 WeakPolarHBondContact O-CB 3.21Å; I63-I66 PolarHBondContact O-N 3.13Å; I63-I66 VanDerWaalsContact O-N 3.1Å; N64-I66 PolarHBondContact O-N 2.88Å; I66-K69 PolarHBondContact O-N 2.75Å; I66-T70 WeakPolarHBondContact O-CB 3.11Å; I66-T70 PolarHBondContact O-N 3.42Å; I66-T70 PolarHBondContact O-OG1 3.26Å
67	Y	92.3	Very high	87.9	Confident	59 Å²	59	74.3 Å²	74.3	23%	0.231	38%	0.375	C	S	.	.	H	α-helix	trans	-63	-44.1	177.1	-66.8	-21.4	0	0	0	112.2	I63 N64 T70 F71 Y195 Q202	I63-Y67 HydrophobicContact CG2-CD2 3.84Å; I63-Y67 HydrophobicContact CG2-CE1 4.2Å; I63-Y67 HydrophobicContact CG2-CE2 3.3Å; I63-Y67 HydrophobicContact CG2-CG 4.49Å; I63-Y67 PolarHBondContact O-N 3.4Å; N64-Y67 PolarHBondContact O-N 3.43Å; Y67-T70 PolarHBondContact O-N 3.44Å; Y67-F71 WeakPolarHBondContact O-CB 3.43Å; Y67-F71 PolarHBondContact O-N 3.34Å; Y67-Y195 HydrophobicContact CD1-CD2 4.09Å; Y67-Y195 HydrophobicContact CD2-CD2 4.28Å; Y67-Y195 HydrophobicContact CD2-CE2 4.09Å; Y67-Y195 HydrophobicContact CE2-CE2 4.44Å; Y67-Y195 AromaticContact CG-CD2 3.85Å; Y67-Y195 HydrophobicContact CG-CD2 3.85Å; Y67-Y195 HydrophobicContact CG-CE2 4.14Å; Y67-Q202 PolarHBondContact OH-NE2 3.37Å
68	R	93.1	Very high	89.3	Confident	25 Å²	25	70.6 Å²	70.6	9%	0.094	36%	0.356	C	S	.	.	H	α-helix	trans	-58.8	-50.7	174.2	-73.5	-167	-67.2	-96.4	8	111.6	E50 N64 S65 T70 F71 E72 V213 Y214	E50-R68 IonicContact OE1-CZ 3.16Å; E50-R68 IonicContact OE1-NH2 3.62Å; E50-R68 PolarHBondContact OE1-NH2 3.46Å; N64-R68 WeakPolarHBondContact O-CG 3.33Å; N64-R68 PolarHBondContact O-N 3.22Å; S65-R68 PolarHBondContact O-N 3.2Å; R68-T70 VanDerWaalsContact C-N 3.34Å; R68-T70 PolarHBondContact O-N 3.05Å; R68-F71 WeakPolarHBondContact O-CB 3.45Å; R68-F71 PolarHBondContact O-N 2.93Å; R68-E72 WeakPolarHBondContact O-CB 3.37Å; R68-E72 VanDerWaalsContact O-CG 3.29Å; R68-E72 WeakPolarHBondContact O-CG 3.45Å; R68-E72 PolarHBondContact O-N 3.33Å; R68-V213 HydrophobicContact CG-CG1 3.4Å; R68-V213 PolarHBondContact NH1-O 3.12Å; R68-V213 VanDerWaalsContact NH1-O 3.09Å; R68-Y214 HydrophobicContact CG-CE1 4.2Å; R68-Y214 HydrophobicContact CG-CE2 4.25Å
69	K	93.4	Very high	90.3	Very high	129 Å²	129	68 Å²	68	56%	0.561	35%	0.349	S	S	*	.	H	α-helix	trans	-60	-45.5	-179.3	-174.4	174.3	179.4	178.7	0	111.7	S65 I66 F71 E72 D73	S65-K69 WeakPolarHBondContact O-CB 3.39Å; S65-K69 PolarHBondContact O-N 3.38Å; I66-K69 PolarHBondContact O-N 2.75Å; K69-F71 VanDerWaalsContact C-N 3.31Å; K69-F71 PolarHBondContact O-N 2.98Å; K69-E72 PolarHBondContact O-N 2.77Å; K69-D73 WeakPolarHBondContact O-CB 3.32Å; K69-D73 PolarHBondContact O-N 3.32Å
70	T	93.3	Very high	91	Very high	49 Å²	49	60.4 Å²	60.4	30%	0.301	32%	0.317	S	S	.	.	H	α-helix	trans	-61.5	-41.2	177.7	-52.5	0	0	0	0	111.4	I66 Y67 R68 N74 Y195	I66-T70 WeakPolarHBondContact O-CB 3.11Å; I66-T70 PolarHBondContact O-N 3.42Å; I66-T70 PolarHBondContact O-OG1 3.26Å; Y67-T70 PolarHBondContact O-N 3.44Å; R68-T70 VanDerWaalsContact C-N 3.34Å; R68-T70 PolarHBondContact O-N 3.05Å; T70-N74 WeakPolarHBondContact O-CB 3.35Å; T70-N74 PolarHBondContact O-N 3.4Å; T70-N74 VanDerWaalsContact O-N 3.08Å; T70-N74 PolarHBondContact O-ND2 2.82Å; T70-Y195 WeakPolarHBondContact CG2-O 3.35Å
71	F	94.2	Very high	91.6	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-65.9	-45.3	177.4	-171	-109.4	0	0	0	112.1	L46 Y67 R68 K69 N74 L75 L190 Q193 I205 L208 Y214	L46-F71 HydrophobicContact CD1-CE1 4.06Å; Y67-F71 WeakPolarHBondContact O-CB 3.43Å; Y67-F71 PolarHBondContact O-N 3.34Å; R68-F71 WeakPolarHBondContact O-CB 3.45Å; R68-F71 PolarHBondContact O-N 2.93Å; K69-F71 VanDerWaalsContact C-N 3.31Å; K69-F71 PolarHBondContact O-N 2.98Å; F71-N74 PolarHBondContact O-N 3.5Å; F71-L75 HydrophobicContact CD1-CD1 3.82Å; F71-L75 HydrophobicContact CD1-CG 4.46Å; F71-L75 HydrophobicContact CE1-CD1 3.62Å; F71-L75 HydrophobicContact CE1-CG 4.32Å; F71-L75 HydrophobicContact CZ-CD1 4.31Å; F71-L75 WeakPolarHBondContact O-CG 3.48Å; F71-L75 PolarHBondContact O-N 3.31Å; F71-L190 HydrophobicContact CE1-CD2 3.83Å; F71-L190 HydrophobicContact CZ-CD2 3.86Å; F71-Q193 HydrophobicContact CD2-CB 4.07Å; F71-Q193 HydrophobicContact CE2-CB 3.49Å; F71-Q193 VanDerWaalsContact CE2-CB 3.49Å; F71-Q193 HydrophobicContact CZ-CB 4.22Å; F71-I205 HydrophobicContact CE1-CD1 4.25Å; F71-I205 HydrophobicContact CZ-CB 4.41Å; F71-I205 HydrophobicContact CZ-CD1 4.47Å; F71-L208 HydrophobicContact CB-CD1 4.36Å; F71-L208 HydrophobicContact CD1-CD1 3.99Å; F71-L208 HydrophobicContact CD2-CD1 3.76Å; F71-L208 HydrophobicContact CE1-CD1 4.14Å; F71-L208 HydrophobicContact CE2-CD1 3.9Å; F71-L208 HydrophobicContact CG-CD1 3.78Å; F71-L208 HydrophobicContact CZ-CD1 4.1Å; F71-Y214 HydrophobicContact CD1-CE2 4.06Å; F71-Y214 HydrophobicContact CE1-CE2 4.42Å
72	E	94.3	Very high	92.2	Very high	14 Å²	14	57.4 Å²	57.4	7%	0.065	30%	0.298	C	S	.	.	H	α-helix	trans	-62.8	-44.6	176.6	-70.5	171	-169.8	0	0	112.2	R68 K69 N74 L75 Q76 K84 L97 Y214	R68-E72 WeakPolarHBondContact O-CB 3.37Å; R68-E72 VanDerWaalsContact O-CG 3.29Å; R68-E72 WeakPolarHBondContact O-CG 3.45Å; R68-E72 PolarHBondContact O-N 3.33Å; K69-E72 PolarHBondContact O-N 2.77Å; E72-N74 VanDerWaalsContact C-N 3.3Å; E72-N74 PolarHBondContact O-N 3.14Å; E72-L75 PolarHBondContact O-N 3.05Å; E72-Q76 WeakPolarHBondContact O-CG 3.16Å; E72-Q76 PolarHBondContact O-N 3.43Å; E72-K84 IonicContact OE1-NZ 3.36Å; E72-K84 WeakPolarHBondContact OE2-CE 3.48Å; E72-K84 IonicContact OE2-NZ 2.73Å; E72-K84 PolarHBondContact OE2-NZ 3.47Å; E72-L97 HydrophobicContact CG-CD2 4.03Å; E72-Y214 PolarHBondContact OE1-OH 3.32Å
73	D	94.7	Very high	92.6	Very high	69 Å²	69	52 Å²	52	37%	0.369	28%	0.275	S	S	.	.	H	α-helix	trans	-61.1	-40.2	177.2	-68.2	-17.9	0	0	0	110.7	K69 Q76 T77	K69-D73 WeakPolarHBondContact O-CB 3.32Å; K69-D73 PolarHBondContact O-N 3.32Å; D73-Q76 PolarHBondContact O-N 3.15Å; D73-T77 WeakPolarHBondContact O-CB 3.32Å; D73-T77 PolarHBondContact O-N 3.36Å; D73-T77 PolarHBondContact O-OG1 3.23Å
74	N	93.9	Very high	92.8	Very high	56 Å²	56	54.6 Å²	54.6	30%	0.299	28%	0.284	S	S	.	.	H	α-helix	trans	-67.7	-39.2	176.1	-72.3	-17.7	0	0	0	112.5	T70 F71 E72 T77 I78 A194	T70-N74 WeakPolarHBondContact O-CB 3.35Å; T70-N74 PolarHBondContact O-N 3.4Å; T70-N74 VanDerWaalsContact O-N 3.08Å; T70-N74 PolarHBondContact O-ND2 2.82Å; F71-N74 PolarHBondContact O-N 3.5Å; E72-N74 VanDerWaalsContact C-N 3.3Å; E72-N74 PolarHBondContact O-N 3.14Å; N74-T77 PolarHBondContact O-N 3.06Å; N74-I78 PolarHBondContact O-N 3.32Å; N74-A194 PolarHBondContact ND2-O 3.25Å
75	L	94.3	Very high	92.7	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63	-43.4	174.4	-73.4	173.3	0	0	0	111.8	F71 E72 T77 I78 G79 V80 I82 I189 L190 Q193	F71-L75 HydrophobicContact CD1-CD1 3.82Å; F71-L75 HydrophobicContact CD1-CG 4.46Å; F71-L75 HydrophobicContact CE1-CD1 3.62Å; F71-L75 HydrophobicContact CE1-CG 4.32Å; F71-L75 HydrophobicContact CZ-CD1 4.31Å; F71-L75 WeakPolarHBondContact O-CG 3.48Å; F71-L75 PolarHBondContact O-N 3.31Å; E72-L75 PolarHBondContact O-N 3.05Å; L75-T77 VanDerWaalsContact C-N 3.34Å; L75-I78 PolarHBondContact O-N 3.38Å; L75-G79 PolarHBondContact O-N 2.9Å; L75-V80 HydrophobicContact CB-CB 4.3Å; L75-V80 HydrophobicContact CD2-CG2 4.34Å; L75-V80 WeakPolarHBondContact O-CB 3.47Å; L75-V80 PolarHBondContact O-N 2.95Å; L75-V80 VanDerWaalsContact O-N 3.08Å; L75-I82 HydrophobicContact CB-CD1 3.93Å; L75-I82 HydrophobicContact CD1-CD1 4.41Å; L75-I189 HydrophobicContact CD2-CG2 3.87Å; L75-L190 HydrophobicContact CD1-CD2 3.91Å; L75-L190 HydrophobicContact CD2-CD2 4.02Å; L75-Q193 HydrophobicContact CD2-CG 3.65Å; L75-Q193 HydrophobicContact CG-CG 4.4Å
76	Q	93.6	Very high	92.5	Very high	110 Å²	110	55.5 Å²	55.5	51%	0.514	28%	0.283	S	S	.	.	H	α-helix	trans	-64.8	-38.5	175.9	-71.1	-176.9	-18.7	0	0	112	E72 D73 I78 G79 I82	E72-Q76 WeakPolarHBondContact O-CG 3.16Å; E72-Q76 PolarHBondContact O-N 3.43Å; D73-Q76 PolarHBondContact O-N 3.15Å; Q76-I78 PolarHBondContact O-N 3.33Å; Q76-G79 PolarHBondContact O-N 3.22Å; Q76-I82 HydrophobicContact CG-CD1 3.67Å; Q76-I82 HydrophobicContact CG-CG1 4.1Å
77	T	93.1	Very high	92	Very high	118 Å²	118	53.2 Å²	53.2	72%	0.724	27%	0.273	S	S	*	.	H	α-helix	trans	-60	-32.9	176.9	-59.4	0	0	0	0	112.3	D73 N74 L75 G79	D73-T77 WeakPolarHBondContact O-CB 3.32Å; D73-T77 PolarHBondContact O-N 3.36Å; D73-T77 PolarHBondContact O-OG1 3.23Å; N74-T77 PolarHBondContact O-N 3.06Å; L75-T77 VanDerWaalsContact C-N 3.34Å; T77-G79 VanDerWaalsContact C-N 3.31Å
78	I	91.1	Very high	91.3	Very high	59 Å²	59	58.4 Å²	58.4	30%	0.303	30%	0.297	S	S	.	.	H	α-helix	trans	-78.5	-17.4	176.3	-70.9	171.5	0	0	0	112.4	N74 L75 Q76 L105 Q193	N74-I78 PolarHBondContact O-N 3.32Å; L75-I78 PolarHBondContact O-N 3.38Å; Q76-I78 PolarHBondContact O-N 3.33Å; I78-L105 HydrophobicContact CG2-CD1 3.62Å; I78-L105 HydrophobicContact CG2-CD2 3.92Å; I78-L105 HydrophobicContact CG2-CG 4.44Å; I78-Q193 HydrophobicContact CD1-CG 4.1Å
79	G	92.1	Very high	90.3	Very high	30 Å²	30	58.7 Å²	58.7	31%	0.309	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.3	17.1	-179.5	0	0	0	0	0	114.3	L75 Q76 T77	L75-G79 PolarHBondContact O-N 2.9Å; Q76-G79 PolarHBondContact O-N 3.22Å; T77-G79 VanDerWaalsContact C-N 3.31Å
80	V	93.4	Very high	89.1	Confident	9 Å²	9	60.1 Å²	60.1	6%	0.055	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	128.3	167.2	-178.3	0	0	0	0	108.4	L75 I82 L99 L105 I189	L75-V80 HydrophobicContact CB-CB 4.3Å; L75-V80 HydrophobicContact CD2-CG2 4.34Å; L75-V80 WeakPolarHBondContact O-CB 3.47Å; L75-V80 PolarHBondContact O-N 2.95Å; L75-V80 VanDerWaalsContact O-N 3.08Å; V80-I82 HydrophobicContact CG1-CG1 4.35Å; V80-L99 HydrophobicContact CG1-CB 4.26Å; V80-L99 HydrophobicContact CG1-CD2 4.08Å; V80-L105 HydrophobicContact CG2-CD2 3.75Å; V80-I189 HydrophobicContact CG2-CD1 4.49Å; V80-I189 HydrophobicContact CG2-CG2 4.01Å
81	Q	93.8	Very high	88.2	Confident	71 Å²	71	60.9 Å²	60.9	33%	0.332	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	135.9	177.4	-59.6	-173.9	6.4	0	0	109.6	H100	Q81-H100 HydrophobicContact CB-CB 4.31Å; Q81-H100 PolarHBondContact N-O 3.41Å; Q81-H100 PolarHBondContact O-N 3.08Å
82	I	94	Very high	87.5	Confident	30 Å²	30	62.7 Å²	62.7	15%	0.154	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	133.8	-168.4	-52.2	-172.5	0	0	0	109.4	L75 Q76 V80 L97 K98 L99	L75-I82 HydrophobicContact CB-CD1 3.93Å; L75-I82 HydrophobicContact CD1-CD1 4.41Å; Q76-I82 HydrophobicContact CG-CD1 3.67Å; Q76-I82 HydrophobicContact CG-CG1 4.1Å; V80-I82 HydrophobicContact CG1-CG1 4.35Å; I82-L97 HydrophobicContact CG2-CD1 3.15Å; I82-L97 HydrophobicContact CG2-CD2 3.93Å; I82-L97 HydrophobicContact CG2-CG 3.45Å; I82-L97 VanDerWaalsContact CG2-CG 3.45Å; I82-K98 WeakPolarHBondContact CA-O 3.47Å; I82-L99 HydrophobicContact CB-CD2 4.4Å; I82-L99 HydrophobicContact CD1-CD2 4.13Å; I82-L99 HydrophobicContact CG1-CD2 3.79Å; I82-L99 HydrophobicContact CG2-CD2 4.13Å
83	E	92.6	Very high	87.1	Confident	26 Å²	26	63 Å²	63	12%	0.121	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	132.2	171	-178.6	-178.7	121	0	0	109.6	F35 N36 K98	F35-E83 WeakPolarHBondContact CB-OE2 3.35Å; F35-E83 HydrophobicContact CD2-CB 3.6Å; F35-E83 HydrophobicContact CD2-CG 4.44Å; F35-E83 WeakPolarHBondContact CD2-OE2 3.44Å; F35-E83 HydrophobicContact CE1-CB 4.48Å; F35-E83 HydrophobicContact CE2-CB 3.51Å; F35-E83 HydrophobicContact CG-CB 4.17Å; F35-E83 WeakPolarHBondContact CG-OE2 3.48Å; F35-E83 HydrophobicContact CZ-CB 3.98Å; N36-E83 PolarHBondContact N-OE1 3.42Å; N36-E83 PolarHBondContact N-OE2 3.29Å; N36-E83 PolarHBondContact ND2-OE1 2.85Å; N36-E83 VanDerWaalsContact ND2-OE1 3.12Å; N36-E83 PolarHBondContact OD1-OE1 3.17Å; E83-K98 HydrophobicContact CB-CB 4.27Å; E83-K98 HydrophobicContact CB-CD 4.38Å; E83-K98 HydrophobicContact CG-CD 4.39Å; E83-K98 PolarHBondContact N-O 3.32Å; E83-K98 PolarHBondContact O-N 2.68Å; E83-K98 WeakPolarHBondContact OE1-CE 3.28Å; E83-K98 IonicContact OE1-NZ 3.03Å; E83-K98 PolarHBondContact OE1-NZ 3.14Å
84	K	90.7	Very high	86.7	Confident	115 Å²	115	60.2 Å²	60.2	50%	0.5	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	133.1	178.5	-73.1	179.7	-178.3	-174.8	0	109.9	E72 Y96 L97	E72-K84 IonicContact OE1-NZ 3.36Å; E72-K84 WeakPolarHBondContact OE2-CE 3.48Å; E72-K84 IonicContact OE2-NZ 2.73Å; E72-K84 PolarHBondContact OE2-NZ 3.47Å; K84-Y96 WeakPolarHBondContact CA-O 3.32Å; K84-L97 HydrophobicContact CD-CD1 4.1Å; K84-L97 HydrophobicContact CG-CD1 3.33Å
85	E	87.4	Confident	86.5	Confident	27 Å²	27	58.7 Å²	58.7	13%	0.126	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	128.8	173.3	-171.1	175.4	163.4	0	0	110.5	Y96 K98 H618 F620	E85-Y96 PolarHBondContact N-O 3.22Å; E85-Y96 WeakPolarHBondContact O-CB 3.44Å; E85-Y96 PolarHBondContact O-N 3.15Å; E85-K98 WeakPolarHBondContact OE2-CE 3.21Å; E85-K98 IonicContact OE2-NZ 2.87Å; E85-K98 PolarHBondContact OE2-NZ 2.99Å; E85-H618 IonicContact OE1-CE1 3.53Å; E85-F620 VanDerWaalsContact OE2-CZ 3.31Å; E85-F620 WeakPolarHBondContact OE2-CZ 3.26Å
86	D	85.6	Confident	86.4	Confident	84 Å²	84	58.8 Å²	58.8	45%	0.449	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	124.2	-174.8	-64.8	-11.4	0	0	0	110.2	V93 H95	D86-V93 HydrophobicContact CB-CG1 4.38Å; D86-H95 IonicContact OD1-CE1 3.95Å; D86-H95 IonicContact OD1-CG 3.48Å; D86-H95 IonicContact OD1-ND1 2.68Å; D86-H95 PolarHBondContact OD1-ND1 3.09Å; D86-H95 IonicContact OD2-CE1 3.68Å; D86-H95 IonicContact OD2-ND1 3.77Å; D86-H95 PolarHBondContact OD2-ND1 3.22Å
87	V	82.3	Confident	86.4	Confident	37 Å²	37	53.6 Å²	53.6	22%	0.224	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	113.4	175.8	-177.8	0	0	0	0	108.9	T94 Y96 I621	V87-T94 PolarHBondContact N-O 2.91Å; V87-T94 PolarHBondContact O-N 2.62Å; V87-Y96 HydrophobicContact CB-CD2 4.49Å; V87-Y96 HydrophobicContact CB-CE2 3.92Å; V87-Y96 HydrophobicContact CG2-CD2 3.86Å; V87-Y96 HydrophobicContact CG2-CE2 3.55Å; V87-I621 HydrophobicContact CG2-CD1 3.95Å
88	K	77.5	Confident	86.4	Confident	168 Å²	168	48 Å²	48	73%	0.73	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	121.9	179.6	-62.7	-176.3	-178.7	177.9	0	110.5	V93	K88-V93 HydrophobicContact CG-CG1 4.16Å; K88-V93 HydrophobicContact CG-CG2 4.15Å
89	T	71.6	Confident	86.5	Confident	32 Å²	32	45.4 Å²	45.4	20%	0.196	24%	0.235	C	C	.	.			trans	-104.9	163.9	165.5	-50.5	0	0	0	0	108.7	S91 L92	T89-S91 PolarHBondContact O-N 3.16Å; T89-L92 WeakPolarHBondContact CA-O 3.15Å; T89-L92 WeakPolarHBondContact CB-O 3.21Å; T89-L92 PolarHBondContact N-O 2.89Å; T89-L92 PolarHBondContact O-N 3.38Å
90	E	68.8	Low	86.7	Confident	158 Å²	158	45.2 Å²	45.2	74%	0.738	23%	0.226	S	C	*	.	S	Bend	trans	-50.9	-31.1	-178.1	-67.2	176.8	170.5	0	0	114.5	N607	E90-N607 VanDerWaalsContact CD-ND2 3.32Å; E90-N607 PolarHBondContact OE1-ND2 3.4Å; E90-N607 PolarHBondContact OE2-ND2 2.93Å
91	S	73.1	Confident	86.7	Confident	65 Å²	65	44.9 Å²	44.9	46%	0.455	22%	0.224	S	C	.	.	S	Bend	trans	-114.3	-22.6	-176.6	57.1	0	0	0	0	115	V52 T89	V52-S91 PolarHBondContact N-O 3.18Å; T89-S91 PolarHBondContact O-N 3.16Å
92	L	80.7	Confident	86.7	Confident	39 Å²	39	42.8 Å²	42.8	20%	0.204	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	136.6	-167.8	-68.3	164.7	0	0	0	110.4	P51 T89	P51-L92 HydrophobicContact CB-CD2 4.41Å; T89-L92 WeakPolarHBondContact CA-O 3.15Å; T89-L92 WeakPolarHBondContact CB-O 3.21Å; T89-L92 PolarHBondContact N-O 2.89Å; T89-L92 PolarHBondContact O-N 3.38Å
93	V	84.9	Confident	86.5	Confident	21 Å²	21	43.5 Å²	43.5	13%	0.127	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	115.8	164.1	-173.3	0	0	0	0	107.4	E50 V52 D86 K88	E50-V93 PolarHBondContact N-O 3.48Å; E50-V93 PolarHBondContact O-N 2.7Å; V52-V93 HydrophobicContact CG2-CG2 3.78Å; D86-V93 HydrophobicContact CB-CG1 4.38Å; K88-V93 HydrophobicContact CG-CG1 4.16Å; K88-V93 HydrophobicContact CG-CG2 4.15Å
94	T	85.7	Confident	86.5	Confident	10 Å²	10	46.9 Å²	46.9	6%	0.061	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	120.4	173	-64.3	0	0	0	0	108.7	V47 D49 V87 Y96 Y624	V47-T94 HydrophobicContact CG1-CG2 3.41Å; V47-T94 VanDerWaalsContact CG1-CG2 3.41Å; D49-T94 WeakPolarHBondContact OD1-CB 3.07Å; D49-T94 WeakPolarHBondContact OD1-CG2 3.29Å; D49-T94 PolarHBondContact OD1-OG1 3.5Å; V87-T94 PolarHBondContact N-O 2.91Å; V87-T94 PolarHBondContact O-N 2.62Å; T94-Y96 HydrophobicContact CG2-CD2 4.09Å; T94-Y96 HydrophobicContact CG2-CE1 4.17Å; T94-Y96 HydrophobicContact CG2-CE2 3.45Å; T94-Y96 VanDerWaalsContact CG2-CE2 3.45Å; T94-Y96 VanDerWaalsContact CG2-CZ 3.49Å; T94-Y624 HydrophobicContact CG2-CE1 4.01Å
95	H	90.6	Very high	86.6	Confident	23 Å²	23	42.1 Å²	42.1	11%	0.106	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	126.5	177.5	-60.4	-84.3	0	0	0	109.8	V47 W48 E50 D86	V47-H95 WeakPolarHBondContact CA-O 3.34Å; W48-H95 AromaticContact CD1-CD2 3.85Å; W48-H95 HydrophobicContact CD2-CB 3.61Å; W48-H95 AromaticContact CE2-CD2 3.6Å; W48-H95 AromaticContact CE2-CG 3.52Å; W48-H95 HydrophobicContact CE3-CB 3.76Å; W48-H95 HydrophobicContact CG-CB 4.36Å; W48-H95 HydrophobicContact CH2-CB 3.45Å; W48-H95 VanDerWaalsContact CH2-CB 3.45Å; W48-H95 HydrophobicContact CZ2-CB 3.26Å; W48-H95 AromaticContact CZ2-CD2 3.95Å; W48-H95 AromaticContact CZ2-CG 3.47Å; W48-H95 VanDerWaalsContact CZ2-CG 3.47Å; W48-H95 HydrophobicContact CZ3-CB 3.69Å; W48-H95 PolarHBondContact N-O 2.9Å; W48-H95 AromaticContact NE1-CD2 3.24Å; W48-H95 PolarHBondContact NE1-CD2 3.03Å; W48-H95 AromaticContact NE1-CG 3.69Å; W48-H95 PolarHBondContact O-N 3.11Å; E50-H95 IonicContact OE2-NE2 2.64Å; D86-H95 IonicContact OD1-CE1 3.95Å; D86-H95 IonicContact OD1-CG 3.48Å; D86-H95 IonicContact OD1-ND1 2.68Å; D86-H95 PolarHBondContact OD1-ND1 3.09Å; D86-H95 IonicContact OD2-CE1 3.68Å; D86-H95 IonicContact OD2-ND1 3.77Å; D86-H95 PolarHBondContact OD2-ND1 3.22Å
96	Y	91.4	Very high	86.9	Confident	3 Å²	3	40.9 Å²	40.9	1%	0.012	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	126.4	175.7	-62.9	-90.9	0	0	0	109.8	V45 V47 K84 E85 V87 T94 F620 I621 Y624	V45-Y96 HydrophobicContact CG1-CD1 4.1Å; V47-Y96 HydrophobicContact CG1-CD1 4.24Å; V47-Y96 HydrophobicContact CG1-CE1 4.1Å; V47-Y96 HydrophobicContact CG2-CD1 3.56Å; V47-Y96 HydrophobicContact CG2-CE1 3.82Å; K84-Y96 WeakPolarHBondContact CA-O 3.32Å; E85-Y96 PolarHBondContact N-O 3.22Å; E85-Y96 WeakPolarHBondContact O-CB 3.44Å; E85-Y96 PolarHBondContact O-N 3.15Å; V87-Y96 HydrophobicContact CB-CD2 4.49Å; V87-Y96 HydrophobicContact CB-CE2 3.92Å; V87-Y96 HydrophobicContact CG2-CD2 3.86Å; V87-Y96 HydrophobicContact CG2-CE2 3.55Å; T94-Y96 HydrophobicContact CG2-CD2 4.09Å; T94-Y96 HydrophobicContact CG2-CE1 4.17Å; T94-Y96 HydrophobicContact CG2-CE2 3.45Å; T94-Y96 VanDerWaalsContact CG2-CE2 3.45Å; T94-Y96 VanDerWaalsContact CG2-CZ 3.49Å; Y96-F620 AromaticContact CD1-CD2 3.64Å; Y96-F620 HydrophobicContact CD1-CD2 3.64Å; Y96-F620 AromaticContact CD1-CE2 3.99Å; Y96-F620 HydrophobicContact CD1-CE2 3.99Å; Y96-F620 HydrophobicContact CD2-CE2 4.16Å; Y96-F620 HydrophobicContact CE1-CD2 4.05Å; Y96-F620 HydrophobicContact CE1-CE2 4.47Å; Y96-F620 AromaticContact CG-CD2 3.96Å; Y96-F620 HydrophobicContact CG-CD2 3.96Å; Y96-F620 AromaticContact CG-CE2 3.82Å; Y96-F620 HydrophobicContact CG-CE2 3.82Å; Y96-I621 HydrophobicContact CE2-CG1 4.38Å; Y96-Y624 HydrophobicContact CE1-CD1 4.18Å; Y96-Y624 HydrophobicContact CE1-CG 4.29Å; Y96-Y624 WeakPolarHBondContact OH-CD1 3.46Å
97	L	93.4	Very high	87.3	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	104.1	174.6	-162.1	73.3	0	0	0	109.2	V45 L46 W48 E72 I82 K84 L99	V45-L97 WeakPolarHBondContact CA-O 3.44Å; L46-L97 HydrophobicContact CB-CB 3.99Å; L46-L97 HydrophobicContact CB-CD2 4.41Å; L46-L97 HydrophobicContact CD1-CD2 3.87Å; L46-L97 HydrophobicContact CG-CD2 4.29Å; L46-L97 PolarHBondContact N-O 3.26Å; L46-L97 PolarHBondContact O-N 2.94Å; W48-L97 HydrophobicContact CZ3-CB 4.21Å; E72-L97 HydrophobicContact CG-CD2 4.03Å; I82-L97 HydrophobicContact CG2-CD1 3.15Å; I82-L97 HydrophobicContact CG2-CD2 3.93Å; I82-L97 HydrophobicContact CG2-CG 3.45Å; I82-L97 VanDerWaalsContact CG2-CG 3.45Å; K84-L97 HydrophobicContact CD-CD1 4.1Å; K84-L97 HydrophobicContact CG-CD1 3.33Å; L97-L99 HydrophobicContact CD2-CD2 4.05Å; L97-L99 HydrophobicContact CG-CD2 4.22Å
98	K	93.7	Very high	87.8	Confident	1 Å²	1	40.4 Å²	40.4	0%	0.004	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	130.9	176	-49.8	174	-165.9	174.1	0	108.9	F35 N36 I42 I82 E83 E85	F35-K98 HydrophobicContact CD1-CB 4.16Å; F35-K98 HydrophobicContact CD1-CD 4.4Å; F35-K98 HydrophobicContact CE1-CB 3.53Å; F35-K98 HydrophobicContact CZ-CB 3.98Å; F35-K98 WeakPolarHBondContact CZ-O 3.37Å; N36-K98 PolarHBondContact OD1-NZ 3.06Å; I42-K98 HydrophobicContact CD1-CD 3.85Å; I42-K98 HydrophobicContact CD1-CG 4.28Å; I42-K98 HydrophobicContact CG1-CB 4.26Å; I42-K98 HydrophobicContact CG1-CD 4.22Å; I42-K98 HydrophobicContact CG1-CG 4.48Å; I42-K98 HydrophobicContact CG2-CB 4.31Å; I82-K98 WeakPolarHBondContact CA-O 3.47Å; E83-K98 HydrophobicContact CB-CB 4.27Å; E83-K98 HydrophobicContact CB-CD 4.38Å; E83-K98 HydrophobicContact CG-CD 4.39Å; E83-K98 PolarHBondContact N-O 3.32Å; E83-K98 PolarHBondContact O-N 2.68Å; E83-K98 WeakPolarHBondContact OE1-CE 3.28Å; E83-K98 IonicContact OE1-NZ 3.03Å; E83-K98 PolarHBondContact OE1-NZ 3.14Å; E85-K98 WeakPolarHBondContact OE2-CE 3.21Å; E85-K98 IonicContact OE2-NZ 2.87Å; E85-K98 PolarHBondContact OE2-NZ 2.99Å
99	L	94.4	Very high	88.5	Confident	4 Å²	4	33.6 Å²	33.6	2%	0.021	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	134	179.7	-57.4	177.4	0	0	0	110.3	D43 Y44 L46 V80 I82 L97 L190	D43-L99 PolarHBondContact N-O 2.88Å; Y44-L99 PolarHBondContact N-O 3.38Å; Y44-L99 WeakPolarHBondContact O-CB 3.33Å; Y44-L99 PolarHBondContact O-N 3.41Å; L46-L99 HydrophobicContact CD1-CD1 4.29Å; L46-L99 HydrophobicContact CD2-CD1 4.3Å; L46-L99 HydrophobicContact CG-CD1 4.01Å; V80-L99 HydrophobicContact CG1-CB 4.26Å; V80-L99 HydrophobicContact CG1-CD2 4.08Å; I82-L99 HydrophobicContact CB-CD2 4.4Å; I82-L99 HydrophobicContact CD1-CD2 4.13Å; I82-L99 HydrophobicContact CG1-CD2 3.79Å; I82-L99 HydrophobicContact CG2-CD2 4.13Å; L97-L99 HydrophobicContact CD2-CD2 4.05Å; L97-L99 HydrophobicContact CG-CD2 4.22Å; L99-L190 HydrophobicContact CD1-CD1 3.93Å; L99-L190 HydrophobicContact CD1-CD2 3.77Å; L99-L190 HydrophobicContact CD1-CG 4.27Å
100	H	94.6	Very high	89.5	Confident	26 Å²	26	32.1 Å²	32.1	12%	0.12	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	127.6	173.4	174.9	72.8	0	0	0	110.4	F35 R40 K41 D43 Q81 R182	F35-H100 HydrophobicContact CE1-CB 3.82Å; F35-H100 HydrophobicContact CE2-CB 4.21Å; F35-H100 HydrophobicContact CZ-CB 3.61Å; R40-H100 HydrophobicContact CB-CB 4.36Å; K41-H100 PolarHBondContact O-ND1 3.21Å; D43-H100 IonicContact OD2-ND1 3.82Å; Q81-H100 HydrophobicContact CB-CB 4.31Å; Q81-H100 PolarHBondContact N-O 3.41Å; Q81-H100 PolarHBondContact O-N 3.08Å; H100-R182 PolarHBondContact CE1-NH2 3.23Å; H100-R182 PolarHBondContact ND1-NH2 2.63Å
101	I	93.9	Very high	90.5	Very high	3 Å²	3	28 Å²	28	2%	0.015	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	121.1	175.7	-59.7	159.1	0	0	0	109.4	D43 L105 M106 R182 V185 A186 I189	D43-I101 HydrophobicContact CB-CD1 4.45Å; D43-I101 PolarHBondContact OD2-N 2.94Å; I101-L105 HydrophobicContact CG2-CB 4.05Å; I101-L105 HydrophobicContact CG2-CD2 4.17Å; I101-L105 HydrophobicContact CG2-CG 4.13Å; I101-M106 HydrophobicContact CG2-CB 3.98Å; I101-M106 HydrophobicContact CG2-SD 4.39Å; I101-R182 WeakPolarHBondContact CD1-O 3.33Å; I101-R182 PolarHBondContact O-NH2 3.2Å; I101-V185 HydrophobicContact CD1-CB 4.15Å; I101-V185 HydrophobicContact CD1-CG1 3.83Å; I101-V185 HydrophobicContact CG2-CG1 4.43Å; I101-A186 HydrophobicContact CD1-CB 3.56Å; I101-A186 HydrophobicContact CG1-CB 4.46Å; I101-I189 HydrophobicContact CD1-CD1 4.42Å; I101-I189 HydrophobicContact CG1-CD1 4.35Å
102	S	93.2	Very high	91.2	Very high	26 Å²	26	28 Å²	28	18%	0.182	15%	0.145	C	C	.	.			trans	-64.7	154.3	174.3	64.6	0	0	0	0	112.1	D104 L105 M106	S102-D104 VanDerWaalsContact C-N 3.33Å; S102-D104 PolarHBondContact O-N 2.9Å; S102-L105 PolarHBondContact O-N 3.39Å; S102-L105 WeakPolarHBondContact OG-CB 3.47Å; S102-M106 WeakPolarHBondContact O-CB 3.45Å; S102-M106 PolarHBondContact O-N 3.27Å
103	W	91.5	Very high	91.5	Very high	45 Å²	45	27.4 Å²	27.4	17%	0.17	14%	0.142	C	C	.	.	H	α-helix	trans	-56.1	-42.8	-178.3	174.2	-101.4	0	0	0	113.6	M106 C107 L164 K173 Y176 F177	W103-M106 WeakPolarHBondContact O-CB 3.32Å; W103-M106 PolarHBondContact O-N 3.5Å; W103-C107 PolarHBondContact O-N 2.8Å; W103-C107 PolarHBondContact O-SG 3.36Å; W103-L164 HydrophobicContact CZ2-CD1 4.26Å; W103-L164 HydrophobicContact CZ2-CD2 4.09Å; W103-K173 HydrophobicContact CD2-CB 4.05Å; W103-K173 HydrophobicContact CD2-CD 4.39Å; W103-K173 HydrophobicContact CD2-CG 4.2Å; W103-K173 HydrophobicContact CE3-CB 3.91Å; W103-K173 HydrophobicContact CE3-CG 4.46Å; W103-K173 VanDerWaalsContact CE3-O 3.23Å; W103-K173 HydrophobicContact CG-CD 4.4Å; W103-K173 HydrophobicContact CH2-CB 4.49Å; W103-K173 HydrophobicContact CZ2-CG 4.26Å; W103-K173 HydrophobicContact CZ3-CB 4.13Å; W103-K173 WeakPolarHBondContact CZ3-O 3.32Å; W103-Y176 AromaticContact CH2-CD1 3.78Å; W103-Y176 HydrophobicContact CH2-CD1 3.78Å; W103-Y176 HydrophobicContact CH2-CG 4.09Å; W103-Y176 HydrophobicContact CZ3-CD1 4.18Å; W103-Y176 HydrophobicContact CZ3-CG 4.5Å; W103-F177 HydrophobicContact CE3-CD2 4.09Å; W103-F177 HydrophobicContact CE3-CE2 4.01Å; W103-F177 HydrophobicContact CH2-CD2 4.14Å; W103-F177 AromaticContact CH2-CE2 3.7Å; W103-F177 HydrophobicContact CH2-CE2 3.7Å; W103-F177 AromaticContact CZ3-CD2 3.47Å; W103-F177 HydrophobicContact CZ3-CD2 3.47Å; W103-F177 VanDerWaalsContact CZ3-CD2 3.47Å; W103-F177 AromaticContact CZ3-CE2 3.41Å; W103-F177 HydrophobicContact CZ3-CE2 3.41Å; W103-F177 VanDerWaalsContact CZ3-CE2 3.41Å
104	D	91.8	Very high	91.6	Very high	97 Å²	97	29.5 Å²	29.5	52%	0.519	15%	0.152	S	C	.	.	H	α-helix	trans	-67.3	-40.4	-179.1	-77.5	-56	0	0	0	112.4	S102 M106 C107 H108 K161	S102-D104 VanDerWaalsContact C-N 3.33Å; S102-D104 PolarHBondContact O-N 2.9Å; D104-M106 VanDerWaalsContact C-N 3.34Å; D104-C107 PolarHBondContact O-N 2.73Å; D104-H108 PolarHBondContact O-N 3.29Å; D104-K161 IonicContact OD1-NZ 2.84Å; D104-K161 PolarHBondContact OD1-NZ 2.88Å
105	L	92.7	Very high	91.7	Very high	16 Å²	16	29.4 Å²	29.4	8%	0.084	15%	0.151	C	C	.	.	H	α-helix	trans	-66.5	-40.4	175.5	-172.6	61.9	0	0	0	110.7	I78 V80 I101 S102 C107 H108 H109 I189	I78-L105 HydrophobicContact CG2-CD1 3.62Å; I78-L105 HydrophobicContact CG2-CD2 3.92Å; I78-L105 HydrophobicContact CG2-CG 4.44Å; V80-L105 HydrophobicContact CG2-CD2 3.75Å; I101-L105 HydrophobicContact CG2-CB 4.05Å; I101-L105 HydrophobicContact CG2-CD2 4.17Å; I101-L105 HydrophobicContact CG2-CG 4.13Å; S102-L105 PolarHBondContact O-N 3.39Å; S102-L105 WeakPolarHBondContact OG-CB 3.47Å; L105-C107 PolarHBondContact O-N 2.81Å; L105-H108 PolarHBondContact O-N 3.3Å; L105-H109 VanDerWaalsContact CD1-CD2 3.45Å; L105-H109 WeakPolarHBondContact CD1-CD2 3.47Å; L105-H109 PolarHBondContact O-CD2 3.08Å; L105-H109 PolarHBondContact O-N 2.96Å; L105-I189 HydrophobicContact CD2-CD1 3.95Å; L105-I189 HydrophobicContact CG-CD1 4.16Å
106	M	94	Very high	91.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-59.5	-46.7	174.6	-170.5	65	-166.2	0	0	111.4	I101 S102 W103 D104 H108 A110 L115 F177 Q181 R182 V185	I101-M106 HydrophobicContact CG2-CB 3.98Å; I101-M106 HydrophobicContact CG2-SD 4.39Å; S102-M106 WeakPolarHBondContact O-CB 3.45Å; S102-M106 PolarHBondContact O-N 3.27Å; W103-M106 WeakPolarHBondContact O-CB 3.32Å; W103-M106 PolarHBondContact O-N 3.5Å; D104-M106 VanDerWaalsContact C-N 3.34Å; M106-H108 PolarHBondContact O-N 3.23Å; M106-A110 WeakPolarHBondContact O-CB 3.35Å; M106-A110 PolarHBondContact O-N 2.94Å; M106-L115 HydrophobicContact CE-CD1 4.24Å; M106-F177 HydrophobicContact CB-CD2 4.33Å; M106-F177 HydrophobicContact CB-CE2 4.19Å; M106-F177 HydrophobicContact CE-CB 3.81Å; M106-F177 HydrophobicContact CE-CD1 3.54Å; M106-F177 HydrophobicContact CE-CD2 4.12Å; M106-F177 HydrophobicContact CE-CE1 4.1Å; M106-F177 HydrophobicContact CE-CG 3.55Å; M106-F177 HydrophobicContact CG-CB 4.47Å; M106-F177 HydrophobicContact CG-CD1 4.31Å; M106-F177 HydrophobicContact CG-CD2 3.31Å; M106-F177 HydrophobicContact CG-CE1 4.41Å; M106-F177 HydrophobicContact CG-CE2 3.44Å; M106-F177 VanDerWaalsContact CG-CE2 3.44Å; M106-F177 HydrophobicContact CG-CG 3.79Å; M106-F177 HydrophobicContact CG-CZ 4Å; M106-F177 HydrophobicContact SD-CG 4.5Å; M106-Q181 HydrophobicContact CE-CB 4.17Å; M106-R182 HydrophobicContact CE-CG 4.08Å; M106-R182 HydrophobicContact SD-CG 4.27Å; M106-V185 HydrophobicContact CE-CB 4.14Å; M106-V185 HydrophobicContact CE-CG2 3.56Å; M106-V185 HydrophobicContact SD-CB 3.74Å; M106-V185 HydrophobicContact SD-CG1 3.86Å; M106-V185 HydrophobicContact SD-CG2 3.67Å
107	C	93.2	Very high	91.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.9	-41.6	177.9	-69.1	0	0	0	0	112.4	W103 D104 L105 E111 F159 K161	W103-C107 PolarHBondContact O-N 2.8Å; W103-C107 PolarHBondContact O-SG 3.36Å; D104-C107 PolarHBondContact O-N 2.73Å; L105-C107 PolarHBondContact O-N 2.81Å; C107-E111 PolarHBondContact O-N 2.96Å; C107-E111 VanDerWaalsContact O-N 3.14Å; C107-F159 HydrophobicContact CB-CE1 4.05Å; C107-F159 HydrophobicContact CB-CZ 4.3Å; C107-K161 HydrophobicContact CB-CD 4.19Å; C107-K161 HydrophobicContact CB-CG 4.43Å
108	H	92.7	Very high	90.9	Very high	112 Å²	112	32.6 Å²	32.6	52%	0.519	17%	0.166	S	C	.	.	H	α-helix	trans	-64.6	-50.3	179.3	-179.3	64.9	0	0	0	111.5	D104 L105 M106 A110 E111 C112	D104-H108 PolarHBondContact O-N 3.29Å; L105-H108 PolarHBondContact O-N 3.3Å; M106-H108 PolarHBondContact O-N 3.23Å; H108-A110 PolarHBondContact O-N 3.14Å; H108-E111 PolarHBondContact O-N 2.73Å; H108-C112 PolarHBondContact O-N 2.89Å; H108-C112 PolarHBondContact O-SG 3.34Å; H108-C112 VanDerWaalsContact O-SG 3.33Å
109	H	92.1	Very high	90.2	Very high	25 Å²	25	36.6 Å²	36.6	12%	0.116	19%	0.187	C	C	.	.	H	α-helix	trans	-68.4	-33.6	177.4	-80.5	-87.3	0	0	0	112.5	L105 E111 C112 L113 V185 D188	L105-H109 VanDerWaalsContact CD1-CD2 3.45Å; L105-H109 WeakPolarHBondContact CD1-CD2 3.47Å; L105-H109 PolarHBondContact O-CD2 3.08Å; L105-H109 PolarHBondContact O-N 2.96Å; H109-E111 VanDerWaalsContact C-N 3.28Å; H109-E111 PolarHBondContact O-N 3.37Å; H109-C112 PolarHBondContact O-N 3.46Å; H109-L113 VanDerWaalsContact O-CB 3.27Å; H109-L113 WeakPolarHBondContact O-CB 3.49Å; H109-L113 VanDerWaalsContact O-CG 3.23Å; H109-L113 WeakPolarHBondContact O-CG 3.47Å; H109-L113 PolarHBondContact O-N 2.9Å; H109-V185 HydrophobicContact CB-CG1 3.53Å; H109-V185 HydrophobicContact CB-CG2 4.22Å; H109-D188 IonicContact ND1-OD2 3.44Å
110	A	92.2	Very high	89.4	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.7	-37.7	175	0	0	0	0	0	112.3	M106 H108 N114 L115 F159 F177	M106-A110 WeakPolarHBondContact O-CB 3.35Å; M106-A110 PolarHBondContact O-N 2.94Å; H108-A110 PolarHBondContact O-N 3.14Å; A110-N114 PolarHBondContact O-N 3.02Å; A110-L115 HydrophobicContact CB-CB 4.32Å; A110-L115 HydrophobicContact CB-CD1 3.75Å; A110-L115 HydrophobicContact CB-CG 4.2Å; A110-L115 PolarHBondContact O-N 2.93Å; A110-F159 HydrophobicContact CB-CD1 3.67Å; A110-F159 HydrophobicContact CB-CE1 4.05Å; A110-F159 HydrophobicContact CB-CG 4.3Å; A110-F177 HydrophobicContact CB-CE1 3.76Å; A110-F177 HydrophobicContact CB-CZ 3.88Å
111	E	91	Very high	88.5	Confident	73 Å²	73	45 Å²	45	34%	0.341	23%	0.228	S	C	.	.	H	α-helix	trans	-71.2	-42.9	174	-172.8	160.7	-172.4	0	0	111.3	C107 H108 H109 L113 N114 F159 K161	C107-E111 PolarHBondContact O-N 2.96Å; C107-E111 VanDerWaalsContact O-N 3.14Å; H108-E111 PolarHBondContact O-N 2.73Å; H109-E111 VanDerWaalsContact C-N 3.28Å; H109-E111 PolarHBondContact O-N 3.37Å; E111-L113 VanDerWaalsContact C-N 3.29Å; E111-L113 PolarHBondContact O-N 2.81Å; E111-N114 PolarHBondContact O-N 2.65Å; E111-N114 VanDerWaalsContact O-N 3.15Å; E111-N114 PolarHBondContact O-OD1 3.36Å; E111-F159 HydrophobicContact CB-CD1 4.42Å; E111-K161 PolarHBondContact OE2-N 2.83Å; E111-K161 VanDerWaalsContact OE2-N 3.16Å
112	C	87.9	Confident	87.6	Confident	64 Å²	64	46 Å²	46	43%	0.432	23%	0.233	S	C	.	.	H	α-helix	trans	-63.6	-31.9	175.5	-67.9	0	0	0	0	113.7	H108 H109	H108-C112 PolarHBondContact O-N 2.89Å; H108-C112 PolarHBondContact O-SG 3.34Å; H108-C112 VanDerWaalsContact O-SG 3.33Å; H109-C112 PolarHBondContact O-N 3.46Å
113	L	87.3	Confident	86.2	Confident	27 Å²	27	51.5 Å²	51.5	14%	0.141	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-0.9	177.5	-67.7	180	0	0	0	113.2	H109 E111 L115 V185 D188	H109-L113 VanDerWaalsContact O-CB 3.27Å; H109-L113 WeakPolarHBondContact O-CB 3.49Å; H109-L113 VanDerWaalsContact O-CG 3.23Å; H109-L113 WeakPolarHBondContact O-CG 3.47Å; H109-L113 PolarHBondContact O-N 2.9Å; E111-L113 VanDerWaalsContact C-N 3.29Å; E111-L113 PolarHBondContact O-N 2.81Å; L113-L115 HydrophobicContact CB-CD2 4.02Å; L113-L115 HydrophobicContact CB-CG 4.02Å; L113-L115 PolarHBondContact O-N 3.47Å; L113-V185 HydrophobicContact CD1-CG2 3.69Å; L113-D188 HydrophobicContact CD1-CB 4.37Å; L113-D188 HydrophobicContact CD2-CB 4.48Å
114	N	87.3	Confident	84.8	Confident	65 Å²	65	53 Å²	53	35%	0.348	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	41.8	-173.3	-68.1	-47.6	0	0	0	112.9	A110 E111 R116 E390	A110-N114 PolarHBondContact O-N 3.02Å; E111-N114 PolarHBondContact O-N 2.65Å; E111-N114 VanDerWaalsContact O-N 3.15Å; E111-N114 PolarHBondContact O-OD1 3.36Å; N114-R116 PolarHBondContact O-N 3.12Å; N114-E390 HydrophobicContact CB-CG 4.35Å
115	L	87.7	Confident	83.5	Confident	8 Å²	8	57.3 Å²	57.3	4%	0.042	29%	0.289	C	S	.	.			trans	-58.8	137.4	178.3	-64.2	-174	0	0	0	109.9	M106 A110 L113 F159 Q181 V185	M106-L115 HydrophobicContact CE-CD1 4.24Å; A110-L115 HydrophobicContact CB-CB 4.32Å; A110-L115 HydrophobicContact CB-CD1 3.75Å; A110-L115 HydrophobicContact CB-CG 4.2Å; A110-L115 PolarHBondContact O-N 2.93Å; L113-L115 HydrophobicContact CB-CD2 4.02Å; L113-L115 HydrophobicContact CB-CG 4.02Å; L113-L115 PolarHBondContact O-N 3.47Å; L115-F159 WeakPolarHBondContact O-CB 3.48Å; L115-F159 PolarHBondContact O-N 3.49Å; L115-Q181 HydrophobicContact CD1-CB 4.25Å; L115-Q181 HydrophobicContact CD1-CG 4.39Å; L115-V185 HydrophobicContact CD1-CG2 4.1Å
116	R	86.5	Confident	81.9	Confident	62 Å²	62	59.2 Å²	59.2	23%	0.234	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	129.3	-179.9	-63.1	-67.5	178.9	141	-3.9	110.1	N114 C157 D382 E390	N114-R116 PolarHBondContact O-N 3.12Å; R116-C157 WeakPolarHBondContact CA-O 3.31Å; R116-D382 HydrophobicContact CG-CB 4.15Å; R116-E390 IonicContact CZ-OE1 3.42Å; R116-E390 IonicContact NE-OE1 3.94Å; R116-E390 PolarHBondContact NE-OE1 3.35Å; R116-E390 VanDerWaalsContact NE-OE1 3.08Å; R116-E390 IonicContact NH2-OE1 3.62Å; R116-E390 PolarHBondContact NH2-OE1 3.45Å
117	A	85	Confident	80.5	Confident	3 Å²	3	66 Å²	66	3%	0.025	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	143.5	-177.6	0	0	0	0	0	111.5	T156 C157 F159 F167 Y176	A117-T156 CarbonylContact O-C 3.59Å; A117-T156 WeakPolarHBondContact O-CA 3.35Å; A117-T156 WeakPolarHBondContact O-CB 3.13Å; A117-C157 PolarHBondContact N-O 2.9Å; A117-C157 PolarHBondContact O-N 2.7Å; A117-F159 HydrophobicContact CB-CB 4.14Å; A117-F159 HydrophobicContact CB-CD2 3.95Å; A117-F167 HydrophobicContact CB-CD1 3.65Å; A117-F167 HydrophobicContact CB-CD2 4.1Å; A117-F167 HydrophobicContact CB-CE1 3.65Å; A117-F167 HydrophobicContact CB-CE2 4.11Å; A117-F167 HydrophobicContact CB-CG 3.89Å; A117-F167 HydrophobicContact CB-CZ 3.89Å; A117-Y176 WeakPolarHBondContact CB-OH 3.46Å
118	P	85.2	Confident	79.2	Confident	27 Å²	27	68.8 Å²	68.8	18%	0.175	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	128.9	-175.9	31.1	-34.8	0	0	0	112.2	Y154 F167 I168	P118-Y154 HydrophobicContact CB-CD1 3.83Å; P118-Y154 HydrophobicContact CB-CD2 3.71Å; P118-Y154 HydrophobicContact CB-CE1 4.41Å; P118-Y154 HydrophobicContact CB-CE2 4.29Å; P118-Y154 HydrophobicContact CB-CG 3.44Å; P118-Y154 VanDerWaalsContact CB-CG 3.44Å; P118-F167 WeakPolarHBondContact O-CA 3.2Å; P118-I168 PolarHBondContact O-N 2.89Å
119	L	79.5	Confident	78.1	Confident	85 Å²	85	71.3 Å²	71.3	45%	0.445	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-50.5	178.4	-172.9	71.2	0	0	0	112.1	Y155 I168	L119-Y155 WeakPolarHBondContact CB-O 3.21Å; L119-Y155 PolarHBondContact N-O 3.38Å; L119-I168 WeakPolarHBondContact O-CD1 3.5Å; L119-I168 WeakPolarHBondContact O-CG1 3.36Å
120	E	77.2	Confident	77.1	Confident	123 Å²	123	71.6 Å²	71.6	58%	0.575	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.9	143.4	-175.9	-174.1	178.4	-176.3	0	0	111.1	Y154 Y155	E120-Y154 CarbonylContact O-C 3.49Å; E120-Y154 WeakPolarHBondContact O-CA 3.15Å; E120-Y155 HydrophobicContact CB-CD2 4.13Å; E120-Y155 PolarHBondContact O-N 3.19Å
121	L	77.4	Confident	76	Confident	83 Å²	83	73.2 Å²	73.2	44%	0.435	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	132.2	179.7	-172.6	76.7	0	0	0	111.8	P152 Y154	L121-P152 HydrophobicContact CD1-CB 3.48Å; L121-P152 VanDerWaalsContact CD1-CB 3.48Å; L121-Y154 HydrophobicContact CB-CD1 4.38Å; L121-Y154 HydrophobicContact CB-CE1 4.37Å; L121-Y154 HydrophobicContact CD1-CD1 4.08Å; L121-Y154 HydrophobicContact CD1-CE1 3.66Å
122	Q	73.5	Confident	75.1	Confident	24 Å²	24	73.6 Å²	73.6	11%	0.112	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	115.4	177.8	175.9	178.3	-46.8	0	0	111.6	T124 E153 Y155 R807	Q122-T124 PolarHBondContact O-N 2.88Å; Q122-T124 VanDerWaalsContact O-N 3.16Å; Q122-E153 HydrophobicContact CB-CB 3.86Å; Q122-E153 WeakPolarHBondContact CB-O 3.34Å; Q122-E153 HydrophobicContact CG-CB 4.26Å; Q122-E153 PolarHBondContact N-O 2.85Å; Q122-E153 PolarHBondContact NE2-OE2 3.25Å; Q122-Y155 HydrophobicContact CB-CE2 4.35Å; Q122-R807 VanDerWaalsContact NE2-CZ 3.33Å; Q122-R807 VanDerWaalsContact NE2-NH1 3.15Å
123	N	64.6	Low	74.4	Confident	143 Å²	143	73.7 Å²	73.7	77%	0.765	36%	0.359	S	S	*	.			trans	-81.6	15.2	-177.7	-72.3	-24.6	0	0	0	115.4	K125	N123-K125 PolarHBondContact O-N 2.99Å
124	T	62.8	Low	73.9	Confident	75 Å²	75	73.6 Å²	73.6	46%	0.46	36%	0.359	S	S	.	.			trans	-95.3	96	-170.5	-42.8	0	0	0	0	111.8	Q122 M126	Q122-T124 PolarHBondContact O-N 2.88Å; Q122-T124 VanDerWaalsContact O-N 3.16Å; T124-M126 PolarHBondContact O-N 3.47Å
125	K	62.9	Low	73.3	Confident	188 Å²	188	76.3 Å²	76.3	82%	0.817	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-72.4	127.3	170.4	-68.1	-173.8	178.5	-177.6	0	110.6	N123 K127	N123-K125 PolarHBondContact O-N 2.99Å; K125-K127 PolarHBondContact O-N 3.31Å
126	M	59.9	Low	72.8	Confident	57 Å²	57	81.3 Å²	81.3	28%	0.281	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-65.9	123.2	169	-69.3	-153.7	-38.1	0	0	110	T124 K376 R380	T124-M126 PolarHBondContact O-N 3.47Å; M126-K376 HydrophobicContact SD-CD 4.11Å; M126-K376 WeakPolarHBondContact SD-CE 3.4Å; M126-R380 VanDerWaalsContact CE-NH1 3.26Å
127	K	64.3	Low	72.5	Confident	143 Å²	143	83.4 Å²	83.4	62%	0.622	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-89.5	130.7	165.4	-65.2	-179.6	-178.5	176.6	0	108.8	K125 I132	K125-K127 PolarHBondContact O-N 3.31Å; K127-I132 HydrophobicContact CB-CD1 3.9Å; K127-I132 HydrophobicContact CB-CG1 3.93Å
128	N	67.2	Low	71.6	Confident	58 Å²	58	86.4 Å²	86.4	31%	0.31	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-70.5	140.6	173.9	-74.9	-28.7	0	0	0	109.6	S130 E131 I132 Y257	N128-S130 PolarHBondContact O-N 3.4Å; N128-E131 HydrophobicContact CB-CB 4.1Å; N128-E131 WeakPolarHBondContact O-CB 3.4Å; N128-E131 PolarHBondContact O-N 3.04Å; N128-I132 WeakPolarHBondContact O-CG1 3.27Å; N128-I132 PolarHBondContact O-N 3.23Å; N128-Y257 HydrophobicContact CB-CE2 4.49Å; N128-Y257 WeakPolarHBondContact ND2-CD2 3.26Å
129	W	68.9	Low	71.1	Confident	164 Å²	164	88.8 Å²	88.8	62%	0.621	46%	0.455	S	S	*	.	H	α-helix	trans	-58.4	-39.2	-179.7	176.3	80.6	0	0	0	112.1	E131 I132 L133	W129-E131 VanDerWaalsContact C-N 3.33Å; W129-E131 PolarHBondContact O-N 3.42Å; W129-I132 WeakPolarHBondContact O-CB 3.23Å; W129-I132 PolarHBondContact O-N 3.29Å; W129-L133 HydrophobicContact CH2-CD1 3.86Å; W129-L133 HydrophobicContact CH2-CD2 4.2Å; W129-L133 HydrophobicContact CH2-CG 4.49Å; W129-L133 HydrophobicContact CZ2-CD1 3.72Å; W129-L133 HydrophobicContact CZ3-CD2 4.31Å; W129-L133 WeakPolarHBondContact O-CB 3.45Å; W129-L133 PolarHBondContact O-N 3.48Å
130	S	70.9	Confident	70.5	Confident	32 Å²	32	89.4 Å²	89.4	22%	0.224	46%	0.464	C	S	.	.	H	α-helix	trans	-65.2	-33.7	174.6	47.8	0	0	0	0	113	N128 L133 L134 Y257	N128-S130 PolarHBondContact O-N 3.4Å; S130-L133 PolarHBondContact O-N 2.59Å; S130-L134 VanDerWaalsContact O-CB 3.23Å; S130-L134 WeakPolarHBondContact O-CB 3.47Å; S130-L134 WeakPolarHBondContact O-CD1 3.44Å; S130-L134 WeakPolarHBondContact O-CG 3.07Å; S130-L134 PolarHBondContact O-N 2.71Å; S130-Y257 VanDerWaalsContact CB-OH 3.22Å; S130-Y257 WeakPolarHBondContact CB-OH 3.45Å; S130-Y257 PolarHBondContact OG-OH 2.95Å
131	E	69.3	Low	70.1	Confident	34 Å²	34	84.6 Å²	84.6	16%	0.159	44%	0.444	C	S	.	.	H	α-helix	trans	-68.5	-40.2	173.9	-168.2	-164.6	152.9	0	0	110.5	N128 W129 K135	N128-E131 HydrophobicContact CB-CB 4.1Å; N128-E131 WeakPolarHBondContact O-CB 3.4Å; N128-E131 PolarHBondContact O-N 3.04Å; W129-E131 VanDerWaalsContact C-N 3.33Å; W129-E131 PolarHBondContact O-N 3.42Å; E131-K135 HydrophobicContact CG-CD 4.25Å; E131-K135 WeakPolarHBondContact O-CB 3.29Å; E131-K135 WeakPolarHBondContact O-CG 3.28Å; E131-K135 PolarHBondContact O-N 2.92Å; E131-K135 WeakPolarHBondContact OE1-CE 3.33Å; E131-K135 IonicContact OE1-NZ 3.95Å; E131-K135 PolarHBondContact OE1-NZ 2.85Å
132	I	71.4	Confident	69.9	Low	81 Å²	81	86.3 Å²	86.3	42%	0.415	45%	0.452	S	S	.	.	H	α-helix	trans	-63	-47.2	173.7	-60.9	168.1	0	0	0	109.8	K127 N128 W129 K135 T136	K127-I132 HydrophobicContact CB-CD1 3.9Å; K127-I132 HydrophobicContact CB-CG1 3.93Å; N128-I132 WeakPolarHBondContact O-CG1 3.27Å; N128-I132 PolarHBondContact O-N 3.23Å; W129-I132 WeakPolarHBondContact O-CB 3.23Å; W129-I132 PolarHBondContact O-N 3.29Å; I132-K135 PolarHBondContact O-N 3.24Å; I132-T136 WeakPolarHBondContact O-CB 3.24Å; I132-T136 PolarHBondContact O-N 3.46Å; I132-T136 PolarHBondContact O-OG1 3.18Å
133	L	74.2	Confident	70	Confident	65 Å²	65	88.8 Å²	88.8	34%	0.34	47%	0.465	S	S	.	.	H	α-helix	trans	-62.2	-50.7	179.2	-171.6	97	0	0	0	111.7	W129 S130 K135 T136 I137	W129-L133 HydrophobicContact CH2-CD1 3.86Å; W129-L133 HydrophobicContact CH2-CD2 4.2Å; W129-L133 HydrophobicContact CH2-CG 4.49Å; W129-L133 HydrophobicContact CZ2-CD1 3.72Å; W129-L133 HydrophobicContact CZ3-CD2 4.31Å; W129-L133 WeakPolarHBondContact O-CB 3.45Å; W129-L133 PolarHBondContact O-N 3.48Å; S130-L133 PolarHBondContact O-N 2.59Å; L133-K135 VanDerWaalsContact C-N 3.33Å; L133-K135 PolarHBondContact O-N 2.87Å; L133-T136 CarbonylContact O-C 3.51Å; L133-T136 WeakPolarHBondContact O-CA 3.45Å; L133-T136 WeakPolarHBondContact O-CB 3.47Å; L133-T136 PolarHBondContact O-N 2.73Å; L133-I137 HydrophobicContact CD1-CD1 4.48Å; L133-I137 HydrophobicContact CD2-CD1 3.92Å; L133-I137 HydrophobicContact CG-CD1 3.8Å; L133-I137 WeakPolarHBondContact O-CG1 3.43Å; L133-I137 PolarHBondContact O-N 2.76Å
134	L	75.7	Confident	70.5	Confident	26 Å²	26	84 Å²	84	14%	0.136	44%	0.443	C	S	.	.	H	α-helix	trans	-61.4	-42.3	179.2	-73.4	168.2	0	0	0	111.3	S130 T136 I137 G138 I139 M143	S130-L134 VanDerWaalsContact O-CB 3.23Å; S130-L134 WeakPolarHBondContact O-CB 3.47Å; S130-L134 WeakPolarHBondContact O-CD1 3.44Å; S130-L134 WeakPolarHBondContact O-CG 3.07Å; S130-L134 PolarHBondContact O-N 2.71Å; L134-T136 VanDerWaalsContact C-N 3.29Å; L134-T136 PolarHBondContact O-N 2.77Å; L134-I137 CarbonylContact O-C 3.58Å; L134-I137 PolarHBondContact O-N 2.66Å; L134-G138 PolarHBondContact O-N 3.06Å; L134-I139 CarbonylContact C-O 3.59Å; L134-I139 HydrophobicContact CD2-CB 3.95Å; L134-I139 HydrophobicContact CD2-CD1 4.3Å; L134-I139 HydrophobicContact CD2-CG2 3.98Å; L134-I139 PolarHBondContact O-N 2.75Å; L134-M143 HydrophobicContact CD1-CE 4.14Å
135	K	75.3	Confident	71.2	Confident	122 Å²	122	82.4 Å²	82.4	53%	0.53	43%	0.43	S	S	.	.	H	α-helix	trans	-62.2	-37	172.6	-77.1	176.9	173.6	173.3	0	112.2	E131 I132 L133 I137 G138	E131-K135 HydrophobicContact CG-CD 4.25Å; E131-K135 WeakPolarHBondContact O-CB 3.29Å; E131-K135 WeakPolarHBondContact O-CG 3.28Å; E131-K135 PolarHBondContact O-N 2.92Å; E131-K135 WeakPolarHBondContact OE1-CE 3.33Å; E131-K135 IonicContact OE1-NZ 3.95Å; E131-K135 PolarHBondContact OE1-NZ 2.85Å; I132-K135 PolarHBondContact O-N 3.24Å; L133-K135 VanDerWaalsContact C-N 3.33Å; L133-K135 PolarHBondContact O-N 2.87Å; K135-I137 VanDerWaalsContact C-N 3.34Å; K135-G138 PolarHBondContact O-N 3.24Å
136	T	77.7	Confident	71.9	Confident	113 Å²	113	81.1 Å²	81.1	69%	0.693	43%	0.432	S	S	*	.	H	α-helix	trans	-68.4	-33.8	176.2	-53.2	0	0	0	0	111.6	I132 L133 L134 G138	I132-T136 WeakPolarHBondContact O-CB 3.24Å; I132-T136 PolarHBondContact O-N 3.46Å; I132-T136 PolarHBondContact O-OG1 3.18Å; L133-T136 CarbonylContact O-C 3.51Å; L133-T136 WeakPolarHBondContact O-CA 3.45Å; L133-T136 WeakPolarHBondContact O-CB 3.47Å; L133-T136 PolarHBondContact O-N 2.73Å; L134-T136 VanDerWaalsContact C-N 3.29Å; L134-T136 PolarHBondContact O-N 2.77Å; T136-G138 VanDerWaalsContact C-N 3.31Å
137	I	79	Confident	72.8	Confident	106 Å²	106	79.5 Å²	79.5	54%	0.544	43%	0.425	S	S	.	.	H	α-helix	trans	-84.9	-4.6	177	-59.9	167.6	0	0	0	111.7	L133 L134 K135 I139	L133-I137 HydrophobicContact CD1-CD1 4.48Å; L133-I137 HydrophobicContact CD2-CD1 3.92Å; L133-I137 HydrophobicContact CG-CD1 3.8Å; L133-I137 WeakPolarHBondContact O-CG1 3.43Å; L133-I137 PolarHBondContact O-N 2.76Å; L134-I137 CarbonylContact O-C 3.58Å; L134-I137 PolarHBondContact O-N 2.66Å; K135-I137 VanDerWaalsContact C-N 3.34Å; I137-I139 VanDerWaalsContact C-N 3.31Å; I137-I139 HydrophobicContact CG2-CD1 3.86Å; I137-I139 HydrophobicContact CG2-CG1 4.09Å; I137-I139 PolarHBondContact O-N 3.43Å
138	G	67.2	Low	73.6	Confident	65 Å²	65	73.7 Å²	73.7	67%	0.67	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	10.7	-179.8	0	0	0	0	0	114.9	L134 K135 T136	L134-G138 PolarHBondContact O-N 3.06Å; K135-G138 PolarHBondContact O-N 3.24Å; T136-G138 VanDerWaalsContact C-N 3.31Å
139	I	73.2	Confident	74.2	Confident	78 Å²	78	75 Å²	75	40%	0.4	41%	0.409	S	S	.	.			trans	-88.4	127.7	177.1	-60.2	172.3	0	0	0	108.1	L134 I137 S141	L134-I139 CarbonylContact C-O 3.59Å; L134-I139 HydrophobicContact CD2-CB 3.95Å; L134-I139 HydrophobicContact CD2-CD1 4.3Å; L134-I139 HydrophobicContact CD2-CG2 3.98Å; L134-I139 PolarHBondContact O-N 2.75Å; I137-I139 VanDerWaalsContact C-N 3.31Å; I137-I139 HydrophobicContact CG2-CD1 3.86Å; I137-I139 HydrophobicContact CG2-CG1 4.09Å; I137-I139 PolarHBondContact O-N 3.43Å; I139-S141 PolarHBondContact O-N 3.28Å
140	P	68.4	Low	74.6	Confident	98 Å²	98	70.9 Å²	70.9	64%	0.636	41%	0.405	S	S	*	.			trans	-57.7	140.9	175.1	24.3	-32.8	0	0	0	109.7	I142	P140-I142 PolarHBondContact O-N 3.38Å
141	S	67.3	Low	75	Confident	22 Å²	22	71.7 Å²	71.7	15%	0.154	41%	0.41	C	S	.	.			trans	-72	75.8	-178.9	49.7	0	0	0	0	110.9	I139 M143 S144	I139-S141 PolarHBondContact O-N 3.28Å; S141-M143 PolarHBondContact O-N 3.12Å; S141-S144 WeakPolarHBondContact CB-OG 3.44Å; S141-S144 PolarHBondContact O-N 2.85Å; S141-S144 PolarHBondContact O-OG 2.78Å; S141-S144 PolarHBondContact OG-OG 3.49Å
142	I	73.8	Confident	75.4	Confident	118 Å²	118	73.4 Å²	73.4	61%	0.605	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-28.4	179.9	-62.1	164.9	0	0	0	111.4	P140 Y255	P140-I142 PolarHBondContact O-N 3.38Å; I142-Y255 HydrophobicContact CG2-CD2 4.25Å; I142-Y255 HydrophobicContact CG2-CE2 4.35Å
143	M	76.9	Confident	75.7	Confident	76 Å²	76	71.2 Å²	71.2	37%	0.374	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-19.8	179.6	-56.2	177.7	-147.4	0	0	114	L134 S141 Y255 R256 Y257	L134-M143 HydrophobicContact CD1-CE 4.14Å; S141-M143 PolarHBondContact O-N 3.12Å; M143-Y255 WeakPolarHBondContact CG-O 3.42Å; M143-R256 WeakPolarHBondContact O-CA 3.01Å; M143-Y257 HydrophobicContact CB-CD1 4.32Å; M143-Y257 HydrophobicContact CB-CD2 3.88Å; M143-Y257 HydrophobicContact CB-CE1 3.91Å; M143-Y257 HydrophobicContact CB-CE2 3.46Å; M143-Y257 VanDerWaalsContact CB-CE2 3.46Å; M143-Y257 HydrophobicContact CB-CG 4.26Å; M143-Y257 VanDerWaalsContact CB-CZ 3.42Å; M143-Y257 HydrophobicContact CG-CE1 4.49Å; M143-Y257 VanDerWaalsContact O-CD2 3.29Å; M143-Y257 WeakPolarHBondContact O-CD2 3.23Å; M143-Y257 PolarHBondContact O-N 3.42Å; M143-Y257 HydrophobicContact SD-CE1 3.75Å; M143-Y257 PolarHBondContact SD-OH 3.26Å
144	S	74.7	Confident	75.8	Confident	44 Å²	44	71.7 Å²	71.7	31%	0.308	41%	0.41	S	S	.	.			trans	-78.4	135.2	-178	65.3	0	0	0	0	111.2	S141	S141-S144 WeakPolarHBondContact CB-OG 3.44Å; S141-S144 PolarHBondContact O-N 2.85Å; S141-S144 PolarHBondContact O-OG 2.78Å; S141-S144 PolarHBondContact OG-OG 3.49Å
145	Q	77.4	Confident	75.9	Confident	41 Å²	41	74.2 Å²	74.2	19%	0.192	42%	0.418	C	S	.	.			trans	-128.5	131.6	176	-179.1	168	21.4	0	0	109.4	V147 Y247	Q145-V147 HydrophobicContact CG-CG2 4.25Å; Q145-V147 PolarHBondContact O-N 2.87Å; Q145-Y247 HydrophobicContact CG-CD1 3.8Å; Q145-Y247 HydrophobicContact CG-CE1 4.15Å; Q145-Y247 VanDerWaalsContact NE2-CE1 3.33Å; Q145-Y247 PolarHBondContact OE1-O 3.03Å
146	N	77.2	Confident	76.2	Confident	160 Å²	160	70 Å²	70	86%	0.856	40%	0.403	S	S	*	.			trans	-77.8	111.5	167.3	-68.1	-27	0	0	0	107.6
147	V	79.7	Confident	76.5	Confident	23 Å²	23	66.5 Å²	66.5	14%	0.139	38%	0.382	C	S	.	.			trans	-97.3	127.3	177.8	-173.3	0	0	0	0	108	Q145 S150 I243 Y247 P259 H262	Q145-V147 HydrophobicContact CG-CG2 4.25Å; Q145-V147 PolarHBondContact O-N 2.87Å; V147-S150 PolarHBondContact O-OG 3.4Å; V147-S150 VanDerWaalsContact O-OG 3.1Å; V147-I243 HydrophobicContact CG1-CG2 3.6Å; V147-Y247 HydrophobicContact CB-CD1 4.29Å; V147-Y247 HydrophobicContact CG1-CD1 4.1Å; V147-Y247 HydrophobicContact CG1-CD2 4.45Å; V147-Y247 HydrophobicContact CG1-CG 4.02Å; V147-Y247 HydrophobicContact CG2-CD1 3.94Å; V147-Y247 HydrophobicContact CG2-CG 4.41Å; V147-P259 HydrophobicContact CG2-CB 4.26Å; V147-H262 VanDerWaalsContact CG1-CE1 3.48Å; V147-H262 WeakPolarHBondContact CG1-CE1 3.47Å
148	P	80.1	Confident	76.8	Confident	21 Å²	21	63.7 Å²	63.7	14%	0.136	37%	0.371	C	S	.	.	S	Bend	trans	-61.1	157.9	177.3	28.1	-35.7	0	0	0	111.1	S150 P235 I243 Y247 H262	P148-S150 VanDerWaalsContact C-N 3.31Å; P148-S150 PolarHBondContact O-N 3.14Å; P148-P235 HydrophobicContact CB-CB 4.21Å; P148-P235 HydrophobicContact CG-CB 4.12Å; P148-I243 HydrophobicContact CG-CD1 4.42Å; P148-I243 HydrophobicContact CG-CG1 4.4Å; P148-Y247 HydrophobicContact CG-CE2 3.85Å; P148-H262 PolarHBondContact O-NE2 2.74Å; P148-H262 VanDerWaalsContact O-NE2 3.08Å
149	N	79.6	Confident	77.8	Confident	85 Å²	85	60.7 Å²	60.7	46%	0.455	34%	0.34	S	S	.	.	S	Bend	trans	51	46	175.3	-60.5	-19.8	0	0	0	113.7	E236 I243 H262	N149-E236 PolarHBondContact ND2-O 3.39Å; N149-I243 HydrophobicContact CB-CD1 4.13Å; N149-H262 PolarHBondContact O-NE2 3.46Å; N149-H262 VanDerWaalsContact O-NE2 3.08Å
150	S	78	Confident	78.5	Confident	78 Å²	78	61.7 Å²	61.7	55%	0.545	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-63	124.6	175	-67.7	0	0	0	0	109.8	V147 P148	V147-S150 PolarHBondContact O-OG 3.4Å; V147-S150 VanDerWaalsContact O-OG 3.1Å; P148-S150 VanDerWaalsContact C-N 3.31Å; P148-S150 PolarHBondContact O-N 3.14Å
151	P	79.1	Confident	79.4	Confident	50 Å²	50	61.6 Å²	61.6	33%	0.325	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-61.3	126.6	-176.1	23.8	-32.8	0	0	0	110	D261	P151-D261 HydrophobicContact CG-CB 3.89Å
152	P	77.8	Confident	80.3	Confident	70 Å²	70	65.5 Å²	65.5	46%	0.455	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-63.2	142.6	176.1	22.5	-29.8	0	0	0	110.5	L121 Y154	L121-P152 HydrophobicContact CD1-CB 3.48Å; L121-P152 VanDerWaalsContact CD1-CB 3.48Å; P152-Y154 HydrophobicContact CB-CE2 4.02Å; P152-Y154 HydrophobicContact CG-CE2 3.68Å; P152-Y154 WeakPolarHBondContact CG-OH 3.48Å
153	E	76.4	Confident	80.8	Confident	34 Å²	34	63.5 Å²	63.5	16%	0.159	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	139.1	171.8	-74.1	171.2	-139.9	0	0	109.6	Q122 R380	Q122-E153 HydrophobicContact CB-CB 3.86Å; Q122-E153 WeakPolarHBondContact CB-O 3.34Å; Q122-E153 HydrophobicContact CG-CB 4.26Å; Q122-E153 PolarHBondContact N-O 2.85Å; Q122-E153 PolarHBondContact NE2-OE2 3.25Å; E153-R380 VanDerWaalsContact CD-NE 3.26Å; E153-R380 IonicContact OE1-CZ 3.41Å; E153-R380 IonicContact OE1-NE 2.89Å; E153-R380 PolarHBondContact OE1-NE 3.01Å; E153-R380 IonicContact OE1-NH2 3.78Å; E153-R380 PolarHBondContact OE1-NH2 2.96Å; E153-R380 IonicContact OE2-NE 2.88Å
154	Y	78.1	Confident	81.2	Confident	75 Å²	75	61.7 Å²	61.7	29%	0.294	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	149.2	175.2	-59	-81.2	0	0	0	110.1	P118 E120 L121 P152 T156 I168	P118-Y154 HydrophobicContact CB-CD1 3.83Å; P118-Y154 HydrophobicContact CB-CD2 3.71Å; P118-Y154 HydrophobicContact CB-CE1 4.41Å; P118-Y154 HydrophobicContact CB-CE2 4.29Å; P118-Y154 HydrophobicContact CB-CG 3.44Å; P118-Y154 VanDerWaalsContact CB-CG 3.44Å; E120-Y154 CarbonylContact O-C 3.49Å; E120-Y154 WeakPolarHBondContact O-CA 3.15Å; L121-Y154 HydrophobicContact CB-CD1 4.38Å; L121-Y154 HydrophobicContact CB-CE1 4.37Å; L121-Y154 HydrophobicContact CD1-CD1 4.08Å; L121-Y154 HydrophobicContact CD1-CE1 3.66Å; P152-Y154 HydrophobicContact CB-CE2 4.02Å; P152-Y154 HydrophobicContact CG-CE2 3.68Å; P152-Y154 WeakPolarHBondContact CG-OH 3.48Å; Y154-T156 PolarHBondContact O-N 3.06Å; Y154-I168 HydrophobicContact CD1-CD1 4.1Å; Y154-I168 HydrophobicContact CE1-CD1 4.15Å; Y154-I168 HydrophobicContact CE1-CG2 4.42Å
155	Y	76.6	Confident	81.6	Confident	80 Å²	80	67.8 Å²	67.8	31%	0.314	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	125.9	153.8	-70	-72.5	0	0	0	108.1	L119 E120 Q122 R807 E811	L119-Y155 WeakPolarHBondContact CB-O 3.21Å; L119-Y155 PolarHBondContact N-O 3.38Å; E120-Y155 HydrophobicContact CB-CD2 4.13Å; E120-Y155 PolarHBondContact O-N 3.19Å; Q122-Y155 HydrophobicContact CB-CE2 4.35Å; Y155-R807 PolarHBondContact OH-NH2 2.89Å; Y155-E811 HydrophobicContact CD1-CG 4.35Å; Y155-E811 HydrophobicContact CE1-CG 3.85Å; Y155-E811 WeakPolarHBondContact CE1-OE1 3.49Å
156	T	83.1	Confident	81.8	Confident	34 Å²	34	71.6 Å²	71.6	21%	0.209	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	154.6	-176.1	69.7	0	0	0	0	112.8	A117 Y154 D382	A117-T156 CarbonylContact O-C 3.59Å; A117-T156 WeakPolarHBondContact O-CA 3.35Å; A117-T156 WeakPolarHBondContact O-CB 3.13Å; Y154-T156 PolarHBondContact O-N 3.06Å; T156-D382 WeakPolarHBondContact CB-OD2 3.38Å; T156-D382 WeakPolarHBondContact CG2-OD2 3.39Å; T156-D382 PolarHBondContact OG1-OD1 3.5Å; T156-D382 PolarHBondContact OG1-OD2 3.26Å
157	C	82.7	Confident	82.1	Confident	39 Å²	39	64.1 Å²	64.1	26%	0.264	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	163.3	167.6	80.1	0	0	0	0	111.2	R116 A117 F159 F167	R116-C157 WeakPolarHBondContact CA-O 3.31Å; A117-C157 PolarHBondContact N-O 2.9Å; A117-C157 PolarHBondContact O-N 2.7Å; C157-F159 PolarHBondContact O-N 3.19Å; C157-F167 WeakPolarHBondContact SG-CE1 3.47Å
158	P	85.5	Confident	82.2	Confident	47 Å²	47	66.4 Å²	66.4	31%	0.305	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	131.8	176.3	-25	34.6	0	0	0	111.5	K160	P158-K160 PolarHBondContact O-N 2.68Å
159	F	87.9	Confident	82.3	Confident	2 Å²	2	67.3 Å²	67.3	1%	0.009	36%	0.36	C	S	.	.			trans	-65.4	132	-179.5	-179.5	-98	0	0	0	110.2	C107 A110 E111 L115 A117 C157 L164 F167 Y176 F177	C107-F159 HydrophobicContact CB-CE1 4.05Å; C107-F159 HydrophobicContact CB-CZ 4.3Å; A110-F159 HydrophobicContact CB-CD1 3.67Å; A110-F159 HydrophobicContact CB-CE1 4.05Å; A110-F159 HydrophobicContact CB-CG 4.3Å; E111-F159 HydrophobicContact CB-CD1 4.42Å; L115-F159 WeakPolarHBondContact O-CB 3.48Å; L115-F159 PolarHBondContact O-N 3.49Å; A117-F159 HydrophobicContact CB-CB 4.14Å; A117-F159 HydrophobicContact CB-CD2 3.95Å; C157-F159 PolarHBondContact O-N 3.19Å; F159-L164 HydrophobicContact CE2-CD1 3.8Å; F159-L164 HydrophobicContact CZ-CD1 4.09Å; F159-F167 HydrophobicContact CD2-CD2 4.05Å; F159-F167 AromaticContact CD2-CE2 3.8Å; F159-F167 HydrophobicContact CD2-CE2 3.8Å; F159-F167 HydrophobicContact CE2-CD2 4.16Å; F159-F167 HydrophobicContact CE2-CE2 4.19Å; F159-Y176 HydrophobicContact CD2-CE1 4.22Å; F159-Y176 AromaticContact CE2-CE1 3.8Å; F159-Y176 HydrophobicContact CE2-CE1 3.8Å; F159-F177 HydrophobicContact CE1-CZ 4.3Å; F159-F177 HydrophobicContact CE2-CZ 4.15Å; F159-F177 AromaticContact CZ-CZ 3.97Å; F159-F177 HydrophobicContact CZ-CZ 3.97Å
160	K	88.8	Confident	82.5	Confident	99 Å²	99	65.9 Å²	65.9	43%	0.43	35%	0.35	S	S	.	.			trans	-133.2	129.7	170.5	-65.7	-164.4	176.3	-162.8	0	108.7	P158 S162 K163	P158-K160 PolarHBondContact O-N 2.68Å; K160-S162 PolarHBondContact O-N 3.14Å; K160-S162 VanDerWaalsContact O-N 3.16Å; K160-K163 HydrophobicContact CB-CG 4.48Å; K160-K163 PolarHBondContact O-N 3.05Å
161	K	86.7	Confident	82.7	Confident	95 Å²	95	68.1 Å²	68.1	41%	0.413	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-58	-33.5	179.9	-169.7	174.3	-173.8	171	0	111.8	D104 C107 E111 K163 L164	D104-K161 IonicContact OD1-NZ 2.84Å; D104-K161 PolarHBondContact OD1-NZ 2.88Å; C107-K161 HydrophobicContact CB-CD 4.19Å; C107-K161 HydrophobicContact CB-CG 4.43Å; E111-K161 PolarHBondContact OE2-N 2.83Å; E111-K161 VanDerWaalsContact OE2-N 3.16Å; K161-K163 PolarHBondContact O-N 3.18Å; K161-L164 PolarHBondContact O-N 2.99Å
162	S	86.6	Confident	83	Confident	104 Å²	104	70.9 Å²	70.9	73%	0.727	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-66.7	-16.9	178	56.8	0	0	0	0	115.2	K160	K160-S162 PolarHBondContact O-N 3.14Å; K160-S162 VanDerWaalsContact O-N 3.16Å
163	K	83.9	Confident	83.4	Confident	77 Å²	77	73.6 Å²	73.6	34%	0.335	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-113	16.7	-178	-63.4	-174.5	178.3	-176.1	0	112.8	K160 K161 E165 K166 F167	K160-K163 HydrophobicContact CB-CG 4.48Å; K160-K163 PolarHBondContact O-N 3.05Å; K161-K163 PolarHBondContact O-N 3.18Å; K163-E165 VanDerWaalsContact C-N 3.26Å; K163-E165 PolarHBondContact O-N 2.92Å; K163-K166 WeakPolarHBondContact O-CB 3.18Å; K163-K166 PolarHBondContact O-N 3.04Å; K163-F167 HydrophobicContact CB-CE2 4.24Å; K163-F167 HydrophobicContact CB-CZ 4.29Å
164	L	84.5	Confident	83.6	Confident	38 Å²	38	79.4 Å²	79.4	20%	0.199	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-52.9	-41.9	-172.4	-175.9	64.4	0	0	0	113.1	W103 F159 K161 K166 F167 H170	W103-L164 HydrophobicContact CZ2-CD1 4.26Å; W103-L164 HydrophobicContact CZ2-CD2 4.09Å; F159-L164 HydrophobicContact CE2-CD1 3.8Å; F159-L164 HydrophobicContact CZ-CD1 4.09Å; K161-L164 PolarHBondContact O-N 2.99Å; L164-K166 PolarHBondContact O-N 3.34Å; L164-K166 VanDerWaalsContact O-N 3.12Å; L164-F167 PolarHBondContact O-N 3.48Å; L164-F167 VanDerWaalsContact O-N 3.1Å; L164-H170 HydrophobicContact CD1-CB 4.28Å; L164-H170 HydrophobicContact CG-CB 4.16Å; L164-H170 WeakPolarHBondContact O-CB 3.3Å
165	E	83.7	Confident	83.8	Confident	171 Å²	171	79.8 Å²	79.8	80%	0.799	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-64.1	-15	179.8	-62.3	177.5	-179.2	0	0	114	K163 H170	K163-E165 VanDerWaalsContact C-N 3.26Å; K163-E165 PolarHBondContact O-N 2.92Å; E165-H170 PolarHBondContact O-CD2 2.93Å; E165-H170 PolarHBondContact O-NE2 2.64Å
166	K	81.3	Confident	84.4	Confident	121 Å²	121	77.2 Å²	77.2	53%	0.526	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-88.2	-12.5	177.6	-59.6	-167.5	177.5	-163.1	0	113	K163 L164	K163-K166 WeakPolarHBondContact O-CB 3.18Å; K163-K166 PolarHBondContact O-N 3.04Å; L164-K166 PolarHBondContact O-N 3.34Å; L164-K166 VanDerWaalsContact O-N 3.12Å
167	F	84	Confident	84.8	Confident	4 Å²	4	76 Å²	76	2%	0.018	40%	0.395	C	S	.	.	S	Bend	trans	-90.9	141	-176.5	-60.2	-52.5	0	0	0	111.8	A117 P118 C157 F159 K163 L164 G169 H170 Y176	A117-F167 HydrophobicContact CB-CD1 3.65Å; A117-F167 HydrophobicContact CB-CD2 4.1Å; A117-F167 HydrophobicContact CB-CE1 3.65Å; A117-F167 HydrophobicContact CB-CE2 4.11Å; A117-F167 HydrophobicContact CB-CG 3.89Å; A117-F167 HydrophobicContact CB-CZ 3.89Å; P118-F167 WeakPolarHBondContact O-CA 3.2Å; C157-F167 WeakPolarHBondContact SG-CE1 3.47Å; F159-F167 HydrophobicContact CD2-CD2 4.05Å; F159-F167 AromaticContact CD2-CE2 3.8Å; F159-F167 HydrophobicContact CD2-CE2 3.8Å; F159-F167 HydrophobicContact CE2-CD2 4.16Å; F159-F167 HydrophobicContact CE2-CE2 4.19Å; K163-F167 HydrophobicContact CB-CE2 4.24Å; K163-F167 HydrophobicContact CB-CZ 4.29Å; L164-F167 PolarHBondContact O-N 3.48Å; L164-F167 VanDerWaalsContact O-N 3.1Å; F167-G169 PolarHBondContact O-N 3.32Å; F167-H170 PolarHBondContact O-CD2 3.33Å; F167-H170 VanDerWaalsContact O-CD2 3.23Å; F167-H170 PolarHBondContact O-N 3Å; F167-Y176 HydrophobicContact CB-CE2 4.05Å; F167-Y176 WeakPolarHBondContact CB-OH 3.5Å
168	I	82.8	Confident	85.1	Confident	70 Å²	70	77 Å²	77	36%	0.359	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	133.6	177.8	-65.4	173.5	0	0	0	109.5	P118 L119 Y154	P118-I168 PolarHBondContact O-N 2.89Å; L119-I168 WeakPolarHBondContact O-CD1 3.5Å; L119-I168 WeakPolarHBondContact O-CG1 3.36Å; Y154-I168 HydrophobicContact CD1-CD1 4.1Å; Y154-I168 HydrophobicContact CE1-CD1 4.15Å; Y154-I168 HydrophobicContact CE1-CG2 4.42Å
169	G	81.7	Confident	85.3	Confident	40 Å²	40	76.1 Å²	76.1	41%	0.412	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	13.4	176.1	0	0	0	0	0	114.8	F167 D171 N172	F167-G169 PolarHBondContact O-N 3.32Å; G169-D171 PolarHBondContact O-N 2.93Å; G169-D171 VanDerWaalsContact O-N 3.12Å; G169-N172 PolarHBondContact O-N 3.4Å
170	H	83	Confident	85.4	Confident	56 Å²	56	76.8 Å²	76.8	26%	0.259	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-22.2	-179.7	70.2	65.7	0	0	0	114.2	L164 E165 F167	L164-H170 HydrophobicContact CD1-CB 4.28Å; L164-H170 HydrophobicContact CG-CB 4.16Å; L164-H170 WeakPolarHBondContact O-CB 3.3Å; E165-H170 PolarHBondContact O-CD2 2.93Å; E165-H170 PolarHBondContact O-NE2 2.64Å; F167-H170 PolarHBondContact O-CD2 3.33Å; F167-H170 VanDerWaalsContact O-CD2 3.23Å; F167-H170 PolarHBondContact O-N 3Å
171	D	82.9	Confident	85.6	Confident	125 Å²	125	74 Å²	74	67%	0.668	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-37	-179	-64.3	-39.2	0	0	0	112.5	G169 K173	G169-D171 PolarHBondContact O-N 2.93Å; G169-D171 VanDerWaalsContact O-N 3.12Å; D171-K173 PolarHBondContact O-N 3.44Å
172	N	85.4	Confident	85.9	Confident	107 Å²	107	70.2 Å²	70.2	57%	0.572	37%	0.37	S	S	*	.			trans	-95.9	84.2	-175.9	-71.7	-13.3	0	0	0	111.1	G169 E174 S175 Y176	G169-N172 PolarHBondContact O-N 3.4Å; N172-E174 PolarHBondContact O-N 2.93Å; N172-E174 VanDerWaalsContact O-N 3.13Å; N172-S175 VanDerWaalsContact CB-OG 3.27Å; N172-S175 WeakPolarHBondContact CB-OG 3.47Å; N172-S175 PolarHBondContact O-N 3.03Å; N172-Y176 WeakPolarHBondContact O-CB 3.48Å; N172-Y176 PolarHBondContact O-N 3.49Å
173	K	85	Confident	86.2	Confident	127 Å²	127	65.5 Å²	65.5	55%	0.552	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-31.7	-179.4	-63.1	-178.3	-176.2	176.8	0	114.1	W103 D171	W103-K173 HydrophobicContact CD2-CB 4.05Å; W103-K173 HydrophobicContact CD2-CD 4.39Å; W103-K173 HydrophobicContact CD2-CG 4.2Å; W103-K173 HydrophobicContact CE3-CB 3.91Å; W103-K173 HydrophobicContact CE3-CG 4.46Å; W103-K173 VanDerWaalsContact CE3-O 3.23Å; W103-K173 HydrophobicContact CG-CD 4.4Å; W103-K173 HydrophobicContact CH2-CB 4.49Å; W103-K173 HydrophobicContact CZ2-CG 4.26Å; W103-K173 HydrophobicContact CZ3-CB 4.13Å; W103-K173 WeakPolarHBondContact CZ3-O 3.32Å; D171-K173 PolarHBondContact O-N 3.44Å
174	E	80.7	Confident	86.6	Confident	156 Å²	156	63.3 Å²	63.3	73%	0.729	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-35	-177.9	-64.4	-175.5	178.5	0	0	113	N172	N172-E174 PolarHBondContact O-N 2.93Å; N172-E174 VanDerWaalsContact O-N 3.13Å
175	S	83.6	Confident	87	Confident	83 Å²	83	61.5 Å²	61.5	58%	0.58	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	-8.7	-174.8	68.5	0	0	0	0	114.3	N172	N172-S175 VanDerWaalsContact CB-OG 3.27Å; N172-S175 WeakPolarHBondContact CB-OG 3.47Å; N172-S175 PolarHBondContact O-N 3.03Å
176	Y	89.2	Confident	87.5	Confident	27 Å²	27	53.7 Å²	53.7	11%	0.106	28%	0.283	C	S	.	.	S	Bend	trans	-60.1	-49.8	-176	177.2	-97.4	0	0	0	112.5	W103 A117 F159 F167 N172	W103-Y176 AromaticContact CH2-CD1 3.78Å; W103-Y176 HydrophobicContact CH2-CD1 3.78Å; W103-Y176 HydrophobicContact CH2-CG 4.09Å; W103-Y176 HydrophobicContact CZ3-CD1 4.18Å; W103-Y176 HydrophobicContact CZ3-CG 4.5Å; A117-Y176 WeakPolarHBondContact CB-OH 3.46Å; F159-Y176 HydrophobicContact CD2-CE1 4.22Å; F159-Y176 AromaticContact CE2-CE1 3.8Å; F159-Y176 HydrophobicContact CE2-CE1 3.8Å; F167-Y176 HydrophobicContact CB-CE2 4.05Å; F167-Y176 WeakPolarHBondContact CB-OH 3.5Å; N172-Y176 WeakPolarHBondContact O-CB 3.48Å; N172-Y176 PolarHBondContact O-N 3.49Å
177	F	90.1	Very high	88.1	Confident	8 Å²	8	50.8 Å²	50.8	4%	0.035	27%	0.269	C	S	.	.	S	Bend	trans	-85.1	125.5	175	-68.4	-71.3	0	0	0	110.2	W103 M106 A110 F159 R182	W103-F177 HydrophobicContact CE3-CD2 4.09Å; W103-F177 HydrophobicContact CE3-CE2 4.01Å; W103-F177 HydrophobicContact CH2-CD2 4.14Å; W103-F177 AromaticContact CH2-CE2 3.7Å; W103-F177 HydrophobicContact CH2-CE2 3.7Å; W103-F177 AromaticContact CZ3-CD2 3.47Å; W103-F177 HydrophobicContact CZ3-CD2 3.47Å; W103-F177 VanDerWaalsContact CZ3-CD2 3.47Å; W103-F177 AromaticContact CZ3-CE2 3.41Å; W103-F177 HydrophobicContact CZ3-CE2 3.41Å; W103-F177 VanDerWaalsContact CZ3-CE2 3.41Å; M106-F177 HydrophobicContact CB-CD2 4.33Å; M106-F177 HydrophobicContact CB-CE2 4.19Å; M106-F177 HydrophobicContact CE-CB 3.81Å; M106-F177 HydrophobicContact CE-CD1 3.54Å; M106-F177 HydrophobicContact CE-CD2 4.12Å; M106-F177 HydrophobicContact CE-CE1 4.1Å; M106-F177 HydrophobicContact CE-CG 3.55Å; M106-F177 HydrophobicContact CG-CB 4.47Å; M106-F177 HydrophobicContact CG-CD1 4.31Å; M106-F177 HydrophobicContact CG-CD2 3.31Å; M106-F177 HydrophobicContact CG-CE1 4.41Å; M106-F177 HydrophobicContact CG-CE2 3.44Å; M106-F177 VanDerWaalsContact CG-CE2 3.44Å; M106-F177 HydrophobicContact CG-CG 3.79Å; M106-F177 HydrophobicContact CG-CZ 4Å; M106-F177 HydrophobicContact SD-CG 4.5Å; A110-F177 HydrophobicContact CB-CE1 3.76Å; A110-F177 HydrophobicContact CB-CZ 3.88Å; F159-F177 HydrophobicContact CE1-CZ 4.3Å; F159-F177 HydrophobicContact CE2-CZ 4.15Å; F159-F177 AromaticContact CZ-CZ 3.97Å; F159-F177 HydrophobicContact CZ-CZ 3.97Å; F177-R182 HydrophobicContact CB-CG 3.95Å
178	T	89.1	Confident	88.5	Confident	61 Å²	61	51.1 Å²	51.1	37%	0.374	27%	0.271	S	S	.	.			trans	-62.2	150.5	174.8	58	0	0	0	0	110.7	T180 Q181 R182	T178-T180 PolarHBondContact O-N 3.42Å; T178-T180 PolarHBondContact OG1-OG1 3.41Å; T178-T180 VanDerWaalsContact OG1-OG1 3.14Å; T178-Q181 WeakPolarHBondContact O-CB 3.47Å; T178-Q181 PolarHBondContact O-N 3.22Å; T178-Q181 WeakPolarHBondContact OG1-CB 3.47Å; T178-Q181 WeakPolarHBondContact OG1-CG 3.03Å; T178-Q181 PolarHBondContact OG1-N 3.39Å; T178-Q181 PolarHBondContact OG1-OE1 3.29Å; T178-R182 PolarHBondContact O-N 3.27Å
179	P	89.7	Confident	89	Confident	28 Å²	28	47.9 Å²	47.9	18%	0.182	25%	0.254	C	S	.	.	H	α-helix	trans	-56	-35.4	177.3	-27.3	36.5	0	0	0	112.9	R182 H183 E222	P179-R182 PolarHBondContact O-N 3.22Å; P179-H183 PolarHBondContact O-CD2 3.26Å; P179-H183 VanDerWaalsContact O-CD2 3.23Å; P179-H183 PolarHBondContact O-N 3.1Å; P179-H183 PolarHBondContact O-ND1 3.45Å; P179-E222 WeakPolarHBondContact CB-OE1 3.33Å; P179-E222 WeakPolarHBondContact CG-OE1 3.43Å
180	T	91	Very high	89.5	Confident	16 Å²	16	46.1 Å²	46.1	10%	0.098	24%	0.236	C	C	.	.	H	α-helix	trans	-61.8	-44.1	174.9	45.1	0	0	0	0	112.8	T178 H183 Q184 S265 Y266 A684	T178-T180 PolarHBondContact O-N 3.42Å; T178-T180 PolarHBondContact OG1-OG1 3.41Å; T178-T180 VanDerWaalsContact OG1-OG1 3.14Å; T180-H183 PolarHBondContact O-N 2.8Å; T180-Q184 WeakPolarHBondContact O-CG 3.4Å; T180-Q184 PolarHBondContact O-N 2.96Å; T180-S265 WeakPolarHBondContact CG2-O 3.34Å; T180-S265 PolarHBondContact OG1-O 3.33Å; T180-Y266 WeakPolarHBondContact CG2-O 3.49Å; T180-A684 HydrophobicContact CG2-CB 4.18Å
181	Q	92.2	Very high	89.9	Confident	39 Å²	39	43.6 Å²	43.6	18%	0.182	22%	0.224	C	C	.	.	H	α-helix	trans	-63.4	-40.7	173.6	-73.2	166.7	-28.3	0	0	111.9	M106 L115 T178 Q184 V185	M106-Q181 HydrophobicContact CE-CB 4.17Å; L115-Q181 HydrophobicContact CD1-CB 4.25Å; L115-Q181 HydrophobicContact CD1-CG 4.39Å; T178-Q181 WeakPolarHBondContact O-CB 3.47Å; T178-Q181 PolarHBondContact O-N 3.22Å; T178-Q181 WeakPolarHBondContact OG1-CB 3.47Å; T178-Q181 WeakPolarHBondContact OG1-CG 3.03Å; T178-Q181 PolarHBondContact OG1-N 3.39Å; T178-Q181 PolarHBondContact OG1-OE1 3.29Å; Q181-Q184 WeakPolarHBondContact O-CB 3.25Å; Q181-Q184 PolarHBondContact O-N 3.14Å; Q181-V185 PolarHBondContact O-N 3.16Å
182	R	93.5	Very high	90.1	Very high	16 Å²	16	40.2 Å²	40.2	6%	0.06	21%	0.208	C	C	.	.	H	α-helix	trans	-62.7	-42.7	176.5	-65.6	-178.7	65.3	82.8	9.3	111.5	D43 H100 I101 M106 F177 T178 P179 V185 A186	D43-R182 VanDerWaalsContact CG-NH2 3.33Å; D43-R182 IonicContact OD1-CZ 2.73Å; D43-R182 IonicContact OD1-NE 3.59Å; D43-R182 PolarHBondContact OD1-NE 3.49Å; D43-R182 IonicContact OD1-NH2 2.71Å; D43-R182 PolarHBondContact OD1-NH2 3.33Å; D43-R182 IonicContact OD2-CZ 3.67Å; D43-R182 IonicContact OD2-NE 2.65Å; D43-R182 IonicContact OD2-NH2 3.84Å; D43-R182 PolarHBondContact OD2-NH2 3.4Å; H100-R182 PolarHBondContact CE1-NH2 3.23Å; H100-R182 PolarHBondContact ND1-NH2 2.63Å; I101-R182 WeakPolarHBondContact CD1-O 3.33Å; I101-R182 PolarHBondContact O-NH2 3.2Å; M106-R182 HydrophobicContact CE-CG 4.08Å; M106-R182 HydrophobicContact SD-CG 4.27Å; F177-R182 HydrophobicContact CB-CG 3.95Å; T178-R182 PolarHBondContact O-N 3.27Å; P179-R182 PolarHBondContact O-N 3.22Å; R182-V185 PolarHBondContact O-N 3.32Å; R182-A186 WeakPolarHBondContact O-CB 3.35Å; R182-A186 PolarHBondContact O-N 2.97Å
183	H	93.5	Very high	90.4	Very high	5 Å²	5	36.5 Å²	36.5	2%	0.023	19%	0.187	C	C	.	.	H	α-helix	trans	-64.8	-39.5	176.2	-59.7	165.5	0	0	0	112.3	D43 P179 T180 A186 Y187 A219 R681 L683	D43-H183 PolarHBondContact O-CD2 3.05Å; D43-H183 PolarHBondContact O-NE2 3.1Å; P179-H183 PolarHBondContact O-CD2 3.26Å; P179-H183 VanDerWaalsContact O-CD2 3.23Å; P179-H183 PolarHBondContact O-N 3.1Å; P179-H183 PolarHBondContact O-ND1 3.45Å; T180-H183 PolarHBondContact O-N 2.8Å; H183-A186 PolarHBondContact O-N 3.08Å; H183-Y187 WeakPolarHBondContact O-CB 3.43Å; H183-Y187 PolarHBondContact O-N 2.87Å; H183-A219 HydrophobicContact CB-CB 4.14Å; H183-R681 PolarHBondContact CE1-NH1 3.21Å; H183-R681 VanDerWaalsContact CE1-NH1 3.28Å; H183-L683 HydrophobicContact CB-CD1 4.35Å
184	Q	91.9	Very high	90.6	Very high	32 Å²	32	31 Å²	31	15%	0.15	17%	0.166	C	C	.	.	H	α-helix	trans	-58.8	-47.8	173.7	-76.4	171.9	-18.2	0	0	111.6	T180 Q181 Y187 D188 A684	T180-Q184 WeakPolarHBondContact O-CG 3.4Å; T180-Q184 PolarHBondContact O-N 2.96Å; Q181-Q184 WeakPolarHBondContact O-CB 3.25Å; Q181-Q184 PolarHBondContact O-N 3.14Å; Q184-Y187 PolarHBondContact O-N 3.39Å; Q184-D188 PolarHBondContact O-N 3.38Å; Q184-A684 HydrophobicContact CG-CB 4.26Å; Q184-A684 VanDerWaalsContact CG-O 3.24Å; Q184-A684 WeakPolarHBondContact CG-O 3.33Å; Q184-A684 PolarHBondContact NE2-O 3.49Å
185	V	93.5	Very high	91.1	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64	-41.6	176.8	171.3	0	0	0	0	111.2	I101 M106 H109 L113 L115 Q181 R182 Y187 D188 I189	I101-V185 HydrophobicContact CD1-CB 4.15Å; I101-V185 HydrophobicContact CD1-CG1 3.83Å; I101-V185 HydrophobicContact CG2-CG1 4.43Å; M106-V185 HydrophobicContact CE-CB 4.14Å; M106-V185 HydrophobicContact CE-CG2 3.56Å; M106-V185 HydrophobicContact SD-CB 3.74Å; M106-V185 HydrophobicContact SD-CG1 3.86Å; M106-V185 HydrophobicContact SD-CG2 3.67Å; H109-V185 HydrophobicContact CB-CG1 3.53Å; H109-V185 HydrophobicContact CB-CG2 4.22Å; L113-V185 HydrophobicContact CD1-CG2 3.69Å; L115-V185 HydrophobicContact CD1-CG2 4.1Å; Q181-V185 PolarHBondContact O-N 3.16Å; R182-V185 PolarHBondContact O-N 3.32Å; V185-Y187 PolarHBondContact O-N 3.37Å; V185-D188 PolarHBondContact O-N 3.41Å; V185-I189 HydrophobicContact CG1-CD1 3.81Å; V185-I189 HydrophobicContact CG1-CG1 4.46Å; V185-I189 WeakPolarHBondContact O-CG1 3.37Å; V185-I189 PolarHBondContact O-N 2.67Å
186	A	94.3	Very high	91.2	Very high	6 Å²	6	21.3 Å²	21.3	5%	0.05	12%	0.12	C	C	.	.	H	α-helix	trans	-60.4	-47.5	178.7	0	0	0	0	0	111.8	D43 Y44 I101 R182 H183 I189 L190	D43-A186 HydrophobicContact CB-CB 4.35Å; Y44-A186 HydrophobicContact CD2-CB 4.16Å; Y44-A186 HydrophobicContact CG-CB 4.33Å; I101-A186 HydrophobicContact CD1-CB 3.56Å; I101-A186 HydrophobicContact CG1-CB 4.46Å; R182-A186 WeakPolarHBondContact O-CB 3.35Å; R182-A186 PolarHBondContact O-N 2.97Å; H183-A186 PolarHBondContact O-N 3.08Å; A186-I189 PolarHBondContact O-N 3.01Å; A186-L190 WeakPolarHBondContact O-CB 3.43Å; A186-L190 VanDerWaalsContact O-CG 3.23Å; A186-L190 WeakPolarHBondContact O-CG 3.26Å; A186-L190 PolarHBondContact O-N 3.34Å
187	Y	93.6	Very high	90.9	Very high	61 Å²	61	22.3 Å²	22.3	24%	0.239	13%	0.131	C	C	.	.	H	α-helix	trans	-64	-41	177.2	-179.7	-99.6	0	0	0	111.9	H183 Q184 V185 I189 L190 A191 I205 D206 L683	H183-Y187 WeakPolarHBondContact O-CB 3.43Å; H183-Y187 PolarHBondContact O-N 2.87Å; Q184-Y187 PolarHBondContact O-N 3.39Å; V185-Y187 PolarHBondContact O-N 3.37Å; Y187-I189 VanDerWaalsContact C-N 3.34Å; Y187-I189 PolarHBondContact O-N 2.94Å; Y187-L190 PolarHBondContact O-N 2.77Å; Y187-A191 HydrophobicContact CE1-CB 4.19Å; Y187-A191 VanDerWaalsContact O-CB 3.26Å; Y187-A191 WeakPolarHBondContact O-CB 3.41Å; Y187-A191 PolarHBondContact O-N 2.86Å; Y187-I205 HydrophobicContact CE2-CG2 4.27Å; Y187-D206 PolarHBondContact OH-OD1 2.88Å; Y187-D206 PolarHBondContact OH-OD2 3.28Å; Y187-L683 HydrophobicContact CD1-CD2 3.24Å; Y187-L683 HydrophobicContact CD2-CD2 4Å; Y187-L683 HydrophobicContact CE1-CD2 3.75Å; Y187-L683 HydrophobicContact CE2-CD2 4.45Å; Y187-L683 HydrophobicContact CG-CD1 4.21Å; Y187-L683 HydrophobicContact CG-CD2 3.37Å; Y187-L683 HydrophobicContact CG-CG 4.42Å
188	D	90.8	Very high	90.4	Very high	11 Å²	11	30.9 Å²	30.9	6%	0.059	16%	0.163	C	C	.	.	H	α-helix	trans	-58.5	-46.1	176.7	-176.4	45.8	0	0	0	112.3	H109 L113 Q184 V185 L190 A191 T192 R392	H109-D188 IonicContact ND1-OD2 3.44Å; L113-D188 HydrophobicContact CD1-CB 4.37Å; L113-D188 HydrophobicContact CD2-CB 4.48Å; Q184-D188 PolarHBondContact O-N 3.38Å; V185-D188 PolarHBondContact O-N 3.41Å; D188-L190 VanDerWaalsContact C-N 3.35Å; D188-L190 PolarHBondContact O-N 3.29Å; D188-A191 PolarHBondContact O-N 3.14Å; D188-T192 WeakPolarHBondContact O-CB 3.25Å; D188-T192 VanDerWaalsContact O-CG2 3.25Å; D188-T192 WeakPolarHBondContact O-CG2 2.99Å; D188-T192 PolarHBondContact O-N 3.47Å; D188-T192 VanDerWaalsContact O-N 3.1Å; D188-T192 PolarHBondContact O-OG1 3.49Å; D188-R392 IonicContact OD1-CZ 3.02Å; D188-R392 VanDerWaalsContact OD1-CZ 3.28Å; D188-R392 IonicContact OD1-NH1 3.31Å; D188-R392 PolarHBondContact OD1-NH1 3.4Å; D188-R392 VanDerWaalsContact OD1-NH1 3.1Å; D188-R392 IonicContact OD1-NH2 2.75Å; D188-R392 PolarHBondContact OD1-NH2 3.18Å; D188-R392 IonicContact OD2-CZ 2.86Å; D188-R392 IonicContact OD2-NH1 2.64Å; D188-R392 PolarHBondContact OD2-NH1 2.94Å; D188-R392 IonicContact OD2-NH2 3.71Å; D188-R392 PolarHBondContact OD2-NH2 2.7Å
189	I	93.2	Very high	89.9	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-60.4	-48.3	176.6	-65.6	163.6	0	0	0	109.7	L75 V80 I101 L105 V185 A186 Y187 A191 T192 Q193	L75-I189 HydrophobicContact CD2-CG2 3.87Å; V80-I189 HydrophobicContact CG2-CD1 4.49Å; V80-I189 HydrophobicContact CG2-CG2 4.01Å; I101-I189 HydrophobicContact CD1-CD1 4.42Å; I101-I189 HydrophobicContact CG1-CD1 4.35Å; L105-I189 HydrophobicContact CD2-CD1 3.95Å; L105-I189 HydrophobicContact CG-CD1 4.16Å; V185-I189 HydrophobicContact CG1-CD1 3.81Å; V185-I189 HydrophobicContact CG1-CG1 4.46Å; V185-I189 WeakPolarHBondContact O-CG1 3.37Å; V185-I189 PolarHBondContact O-N 2.67Å; A186-I189 PolarHBondContact O-N 3.01Å; Y187-I189 VanDerWaalsContact C-N 3.34Å; Y187-I189 PolarHBondContact O-N 2.94Å; I189-A191 VanDerWaalsContact C-N 3.34Å; I189-A191 PolarHBondContact O-N 2.81Å; I189-T192 PolarHBondContact O-N 2.83Å; I189-T192 PolarHBondContact O-OG1 3.39Å; I189-T192 VanDerWaalsContact O-OG1 3.05Å; I189-Q193 HydrophobicContact CG2-CG 4.31Å; I189-Q193 VanDerWaalsContact O-CG 3.26Å; I189-Q193 WeakPolarHBondContact O-CG 3.38Å; I189-Q193 PolarHBondContact O-N 3.43Å; I189-Q193 VanDerWaalsContact O-N 3.16Å; I189-Q193 PolarHBondContact O-NE2 3.46Å
190	L	93.7	Very high	89.4	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.016	21%	0.208	C	C	.	.	H	α-helix	trans	-64.7	-34.6	-178.9	-71.9	171.5	0	0	0	113.6	Y44 L46 F71 L75 L99 A186 Y187 D188 G204 I205	Y44-L190 HydrophobicContact CD1-CD1 3.28Å; Y44-L190 HydrophobicContact CE1-CD1 3.62Å; Y44-L190 HydrophobicContact CG-CD1 3.9Å; L46-L190 HydrophobicContact CD1-CD2 4.26Å; L46-L190 HydrophobicContact CD2-CD1 4.12Å; L46-L190 HydrophobicContact CD2-CD2 4.4Å; F71-L190 HydrophobicContact CE1-CD2 3.83Å; F71-L190 HydrophobicContact CZ-CD2 3.86Å; L75-L190 HydrophobicContact CD1-CD2 3.91Å; L75-L190 HydrophobicContact CD2-CD2 4.02Å; L99-L190 HydrophobicContact CD1-CD1 3.93Å; L99-L190 HydrophobicContact CD1-CD2 3.77Å; L99-L190 HydrophobicContact CD1-CG 4.27Å; A186-L190 WeakPolarHBondContact O-CB 3.43Å; A186-L190 VanDerWaalsContact O-CG 3.23Å; A186-L190 WeakPolarHBondContact O-CG 3.26Å; A186-L190 PolarHBondContact O-N 3.34Å; Y187-L190 PolarHBondContact O-N 2.77Å; D188-L190 VanDerWaalsContact C-N 3.35Å; D188-L190 PolarHBondContact O-N 3.29Å; L190-G204 CarbonylContact O-C 3.59Å; L190-G204 WeakPolarHBondContact O-CA 3.22Å; L190-I205 HydrophobicContact CB-CB 4.04Å; L190-I205 HydrophobicContact CB-CG2 3.8Å; L190-I205 PolarHBondContact O-N 3.4Å
191	A	90.2	Very high	88.9	Confident	2 Å²	2	41.9 Å²	41.9	2%	0.017	21%	0.205	C	C	.	.	H	α-helix	trans	-78	-24.5	-179.6	0	0	0	0	0	112.6	Y187 D188 I189 G204 P395	Y187-A191 HydrophobicContact CE1-CB 4.19Å; Y187-A191 VanDerWaalsContact O-CB 3.26Å; Y187-A191 WeakPolarHBondContact O-CB 3.41Å; Y187-A191 PolarHBondContact O-N 2.86Å; D188-A191 PolarHBondContact O-N 3.14Å; I189-A191 VanDerWaalsContact C-N 3.34Å; I189-A191 PolarHBondContact O-N 2.81Å; A191-G204 WeakPolarHBondContact O-CA 3.37Å; A191-P395 HydrophobicContact CB-CB 4.35Å; A191-P395 HydrophobicContact CB-CG 3.91Å
192	T	87.9	Confident	88.6	Confident	54 Å²	54	41 Å²	41	33%	0.331	20%	0.201	S	C	.	.	H	α-helix	trans	-93.9	-18.6	-178.3	54.7	0	0	0	0	113.8	D188 I189 V203	D188-T192 WeakPolarHBondContact O-CB 3.25Å; D188-T192 VanDerWaalsContact O-CG2 3.25Å; D188-T192 WeakPolarHBondContact O-CG2 2.99Å; D188-T192 PolarHBondContact O-N 3.47Å; D188-T192 VanDerWaalsContact O-N 3.1Å; D188-T192 PolarHBondContact O-OG1 3.49Å; I189-T192 PolarHBondContact O-N 2.83Å; I189-T192 PolarHBondContact O-OG1 3.39Å; I189-T192 VanDerWaalsContact O-OG1 3.05Å; T192-V203 VanDerWaalsContact O-CG1 3.25Å; T192-V203 WeakPolarHBondContact O-CG1 3.43Å
193	Q	91	Very high	88.3	Confident	29 Å²	29	41.6 Å²	41.6	14%	0.136	21%	0.206	C	C	.	.			trans	-70.6	132.8	-177.4	-77.2	-25.2	-64.3	0	0	114.1	F71 L75 I78 I189 G204	F71-Q193 HydrophobicContact CD2-CB 4.07Å; F71-Q193 HydrophobicContact CE2-CB 3.49Å; F71-Q193 VanDerWaalsContact CE2-CB 3.49Å; F71-Q193 HydrophobicContact CZ-CB 4.22Å; L75-Q193 HydrophobicContact CD2-CG 3.65Å; L75-Q193 HydrophobicContact CG-CG 4.4Å; I78-Q193 HydrophobicContact CD1-CG 4.1Å; I189-Q193 HydrophobicContact CG2-CG 4.31Å; I189-Q193 VanDerWaalsContact O-CG 3.26Å; I189-Q193 WeakPolarHBondContact O-CG 3.38Å; I189-Q193 PolarHBondContact O-N 3.43Å; I189-Q193 VanDerWaalsContact O-N 3.16Å; I189-Q193 PolarHBondContact O-NE2 3.46Å; Q193-G204 PolarHBondContact O-N 3.16Å
194	A	90.3	Very high	88.1	Confident	13 Å²	13	41.6 Å²	41.6	11%	0.107	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-83.4	138.6	173	0	0	0	0	0	110.3	N74 R198 V203	N74-A194 PolarHBondContact ND2-O 3.25Å; A194-R198 HydrophobicContact CB-CG 4.38Å; A194-V203 HydrophobicContact CB-CG2 4.1Å
195	Y	90.1	Very high	88.1	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.008	20%	0.201	C	C	.	.	S	Bend	trans	-112.9	-5	171.5	63.3	-90.2	0	0	0	112.5	Y67 T70 Q202 R207 L208 E211	Y67-Y195 HydrophobicContact CD1-CD2 4.09Å; Y67-Y195 HydrophobicContact CD2-CD2 4.28Å; Y67-Y195 HydrophobicContact CD2-CE2 4.09Å; Y67-Y195 HydrophobicContact CE2-CE2 4.44Å; Y67-Y195 AromaticContact CG-CD2 3.85Å; Y67-Y195 HydrophobicContact CG-CD2 3.85Å; Y67-Y195 HydrophobicContact CG-CE2 4.14Å; T70-Y195 WeakPolarHBondContact CG2-O 3.35Å; Y195-Q202 HydrophobicContact CD1-CB 4.49Å; Y195-Q202 WeakPolarHBondContact CD1-O 3.4Å; Y195-Q202 HydrophobicContact CD2-CB 4.27Å; Y195-Q202 HydrophobicContact CE1-CB 4.06Å; Y195-Q202 HydrophobicContact CE2-CB 3.86Å; Y195-Q202 HydrophobicContact CE2-CG 4.14Å; Y195-Q202 PolarHBondContact N-O 3.42Å; Y195-Q202 VanDerWaalsContact N-O 3.13Å; Y195-R207 VanDerWaalsContact OH-CD 3.31Å; Y195-R207 WeakPolarHBondContact OH-CD 3.5Å; Y195-R207 WeakPolarHBondContact OH-CG 3.44Å; Y195-R207 PolarHBondContact OH-NE 3.23Å; Y195-L208 HydrophobicContact CD1-CD1 3.9Å; Y195-L208 HydrophobicContact CD1-CD2 3.75Å; Y195-L208 HydrophobicContact CD1-CG 3.71Å; Y195-L208 HydrophobicContact CD2-CD2 3.71Å; Y195-L208 HydrophobicContact CE1-CD1 4.4Å; Y195-L208 HydrophobicContact CE1-CD2 3.79Å; Y195-L208 HydrophobicContact CE1-CG 3.72Å; Y195-L208 HydrophobicContact CE2-CD2 3.7Å; Y195-L208 HydrophobicContact CG-CD1 4.22Å; Y195-L208 HydrophobicContact CG-CD2 3.71Å; Y195-L208 HydrophobicContact CG-CG 4.15Å; Y195-E211 PolarHBondContact OH-OE1 2.65Å; Y195-E211 PolarHBondContact OH-OE2 3.36Å
196	G	86.5	Confident	87.9	Confident	32 Å²	32	42.4 Å²	42.4	33%	0.33	21%	0.213	S	C	.	.	S	Bend	trans	-157.5	-146.6	-178.8	0	0	0	0	0	112	R198 Q202	G196-R198 PolarHBondContact O-N 3.4Å; G196-Q202 PolarHBondContact N-O 3Å
197	S	83	Confident	87.6	Confident	48 Å²	48	45 Å²	45	34%	0.336	22%	0.221	S	C	.	.			trans	-75.7	126.1	-179.7	177.1	0	0	0	0	111.4	E199 K200 Q202	S197-E199 PolarHBondContact O-N 3.08Å; S197-E199 PolarHBondContact OG-N 3.18Å; S197-K200 PolarHBondContact O-N 3.08Å; S197-K200 VanDerWaalsContact O-N 3.1Å; S197-Q202 PolarHBondContact O-N 3.1Å
198	R	79.5	Confident	87.5	Confident	188 Å²	188	42.1 Å²	42.1	71%	0.709	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-59.6	-31.4	172.7	-70	-173.5	176.5	-168	-1.2	112.2	A194 G196 K200 A201 V203	A194-R198 HydrophobicContact CB-CG 4.38Å; G196-R198 PolarHBondContact O-N 3.4Å; R198-K200 PolarHBondContact O-N 3.27Å; R198-A201 PolarHBondContact O-N 2.96Å; R198-V203 HydrophobicContact CG-CG2 4.37Å
199	E	77.3	Confident	87.6	Confident	186 Å²	186	44.2 Å²	44.2	87%	0.869	22%	0.221	S	C	*	.	G	3₁₀ helix	trans	-63.8	-29.9	177.1	-59.9	178.9	167.9	0	0	112.6	S197 A201	S197-E199 PolarHBondContact O-N 3.08Å; S197-E199 PolarHBondContact OG-N 3.18Å; E199-A201 VanDerWaalsContact C-N 3.28Å
200	K	79.7	Confident	87.4	Confident	146 Å²	146	49.8 Å²	49.8	64%	0.635	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-90.1	9.5	176	-66	-174.9	-179.1	179.1	0	112.7	S197 R198 Q202 R207	S197-K200 PolarHBondContact O-N 3.08Å; S197-K200 VanDerWaalsContact O-N 3.1Å; R198-K200 PolarHBondContact O-N 3.27Å; K200-Q202 HydrophobicContact CB-CG 3.95Å; K200-Q202 PolarHBondContact O-N 3.28Å; K200-R207 PolarHBondContact O-NH1 3Å
201	A	80.9	Confident	87.1	Confident	5 Å²	5	52.9 Å²	52.9	4%	0.041	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	57	29.1	-174.4	0	0	0	0	0	113.8	R198 E199 V203 R207 A399	R198-A201 PolarHBondContact O-N 2.96Å; E199-A201 VanDerWaalsContact C-N 3.28Å; A201-V203 PolarHBondContact O-N 2.79Å; A201-R207 WeakPolarHBondContact O-CD 3.47Å; A201-R207 PolarHBondContact O-NH1 3.31Å; A201-A399 HydrophobicContact CB-CB 3.81Å; A201-A399 VanDerWaalsContact CB-O 3.23Å; A201-A399 WeakPolarHBondContact CB-O 3.36Å
202	Q	85.1	Confident	87	Confident	21 Å²	21	60.2 Å²	60.2	10%	0.098	30%	0.295	C	S	.	.			trans	-80	67.9	-178.8	-68.7	180	-38.8	0	0	111	Y67 Y195 G196 S197 K200	Y67-Q202 PolarHBondContact OH-NE2 3.37Å; Y195-Q202 HydrophobicContact CD1-CB 4.49Å; Y195-Q202 WeakPolarHBondContact CD1-O 3.4Å; Y195-Q202 HydrophobicContact CD2-CB 4.27Å; Y195-Q202 HydrophobicContact CE1-CB 4.06Å; Y195-Q202 HydrophobicContact CE2-CB 3.86Å; Y195-Q202 HydrophobicContact CE2-CG 4.14Å; Y195-Q202 PolarHBondContact N-O 3.42Å; Y195-Q202 VanDerWaalsContact N-O 3.13Å; G196-Q202 PolarHBondContact N-O 3Å; S197-Q202 PolarHBondContact O-N 3.1Å; K200-Q202 HydrophobicContact CB-CG 3.95Å; K200-Q202 PolarHBondContact O-N 3.28Å
203	V	88	Confident	87.2	Confident	28 Å²	28	57.7 Å²	57.7	17%	0.17	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-135.4	138.4	-174.1	-176.4	0	0	0	0	109.7	T192 A194 R198 A201 A399	T192-V203 VanDerWaalsContact O-CG1 3.25Å; T192-V203 WeakPolarHBondContact O-CG1 3.43Å; A194-V203 HydrophobicContact CB-CG2 4.1Å; R198-V203 HydrophobicContact CG-CG2 4.37Å; A201-V203 PolarHBondContact O-N 2.79Å; V203-A399 HydrophobicContact CB-CB 4.2Å; V203-A399 HydrophobicContact CG2-CB 4.42Å
204	G	89.6	Confident	87.3	Confident	5 Å²	5	56.3 Å²	56.3	5%	0.052	27%	0.273	C	S	.	.	S	Bend	trans	92	149.5	168.5	0	0	0	0	0	115.6	L190 A191 Q193 D206 L208	L190-G204 CarbonylContact O-C 3.59Å; L190-G204 WeakPolarHBondContact O-CA 3.22Å; A191-G204 WeakPolarHBondContact O-CA 3.37Å; Q193-G204 PolarHBondContact O-N 3.16Å; G204-D206 PolarHBondContact O-N 2.94Å; G204-L208 PolarHBondContact O-N 3.41Å
205	I	91.9	Very high	87.3	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-64.6	-35.8	179.5	-171.4	58.4	0	0	0	113.5	L46 F71 Y187 L190 R207 L208 I209 Y214 A217	L46-I205 HydrophobicContact CD1-CD1 4.14Å; L46-I205 HydrophobicContact CD2-CD1 3.93Å; L46-I205 HydrophobicContact CD2-CG1 4.17Å; F71-I205 HydrophobicContact CE1-CD1 4.25Å; F71-I205 HydrophobicContact CZ-CB 4.41Å; F71-I205 HydrophobicContact CZ-CD1 4.47Å; Y187-I205 HydrophobicContact CE2-CG2 4.27Å; L190-I205 HydrophobicContact CB-CB 4.04Å; L190-I205 HydrophobicContact CB-CG2 3.8Å; L190-I205 PolarHBondContact O-N 3.4Å; I205-R207 VanDerWaalsContact C-N 3.25Å; I205-R207 PolarHBondContact O-N 3.12Å; I205-L208 HydrophobicContact CD1-CB 4.36Å; I205-L208 HydrophobicContact CD1-CD1 4.37Å; I205-L208 WeakPolarHBondContact O-CB 3.46Å; I205-L208 PolarHBondContact O-N 3.19Å; I205-L208 VanDerWaalsContact O-N 3.1Å; I205-I209 HydrophobicContact CG1-CD1 4.1Å; I205-I209 HydrophobicContact CG1-CG1 4.44Å; I205-I209 WeakPolarHBondContact O-CG1 3.35Å; I205-I209 PolarHBondContact O-N 3.47Å; I205-Y214 HydrophobicContact CD1-CD2 3.6Å; I205-Y214 HydrophobicContact CD1-CE2 4.1Å; I205-Y214 HydrophobicContact CD1-CG 4.32Å; I205-A217 HydrophobicContact CD1-CB 4.24Å; I205-A217 HydrophobicContact CG1-CB 3.66Å
206	D	88.7	Confident	87.4	Confident	47 Å²	47	59.3 Å²	59.3	25%	0.251	29%	0.288	S	S	.	.	H	α-helix	trans	-59.9	-38.6	-178.2	-62.9	-21.9	0	0	0	111.9	Y187 G204 I209 Q210	Y187-D206 PolarHBondContact OH-OD1 2.88Å; Y187-D206 PolarHBondContact OH-OD2 3.28Å; G204-D206 PolarHBondContact O-N 2.94Å; D206-I209 PolarHBondContact O-N 3.43Å; D206-Q210 VanDerWaalsContact O-CG 3.3Å; D206-Q210 WeakPolarHBondContact O-CG 3.39Å; D206-Q210 PolarHBondContact O-N 2.92Å
207	R	88.6	Confident	87.8	Confident	61 Å²	61	58.7 Å²	58.7	23%	0.23	28%	0.28	C	S	.	.	H	α-helix	trans	-71.5	-39	177.7	-174	175.6	171.7	164.3	-0.5	111.5	Y195 K200 A201 I205 I209 Q210 E211	Y195-R207 VanDerWaalsContact OH-CD 3.31Å; Y195-R207 WeakPolarHBondContact OH-CD 3.5Å; Y195-R207 WeakPolarHBondContact OH-CG 3.44Å; Y195-R207 PolarHBondContact OH-NE 3.23Å; K200-R207 PolarHBondContact O-NH1 3Å; A201-R207 WeakPolarHBondContact O-CD 3.47Å; A201-R207 PolarHBondContact O-NH1 3.31Å; I205-R207 VanDerWaalsContact C-N 3.25Å; I205-R207 PolarHBondContact O-N 3.12Å; R207-I209 PolarHBondContact O-N 2.78Å; R207-Q210 PolarHBondContact O-N 2.8Å; R207-E211 HydrophobicContact CG-CG 4.33Å; R207-E211 IonicContact CZ-OE1 2.76Å; R207-E211 VanDerWaalsContact CZ-OE1 3.31Å; R207-E211 IonicContact NE-OE1 3.58Å; R207-E211 PolarHBondContact NE-OE1 3.34Å; R207-E211 IonicContact NH2-OE1 2.66Å; R207-E211 PolarHBondContact NH2-OE1 2.65Å; R207-E211 WeakPolarHBondContact O-CB 3.21Å; R207-E211 WeakPolarHBondContact O-CG 3.44Å; R207-E211 PolarHBondContact O-N 2.74Å
208	L	92.1	Very high	88.3	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61.7	-32.9	174.1	-72.5	168.9	0	0	0	112.1	F71 Y195 G204 I205 E212 V213 Y214	F71-L208 HydrophobicContact CB-CD1 4.36Å; F71-L208 HydrophobicContact CD1-CD1 3.99Å; F71-L208 HydrophobicContact CD2-CD1 3.76Å; F71-L208 HydrophobicContact CE1-CD1 4.14Å; F71-L208 HydrophobicContact CE2-CD1 3.9Å; F71-L208 HydrophobicContact CG-CD1 3.78Å; F71-L208 HydrophobicContact CZ-CD1 4.1Å; Y195-L208 HydrophobicContact CD1-CD1 3.9Å; Y195-L208 HydrophobicContact CD1-CD2 3.75Å; Y195-L208 HydrophobicContact CD1-CG 3.71Å; Y195-L208 HydrophobicContact CD2-CD2 3.71Å; Y195-L208 HydrophobicContact CE1-CD1 4.4Å; Y195-L208 HydrophobicContact CE1-CD2 3.79Å; Y195-L208 HydrophobicContact CE1-CG 3.72Å; Y195-L208 HydrophobicContact CE2-CD2 3.7Å; Y195-L208 HydrophobicContact CG-CD1 4.22Å; Y195-L208 HydrophobicContact CG-CD2 3.71Å; Y195-L208 HydrophobicContact CG-CG 4.15Å; G204-L208 PolarHBondContact O-N 3.41Å; I205-L208 HydrophobicContact CD1-CB 4.36Å; I205-L208 HydrophobicContact CD1-CD1 4.37Å; I205-L208 WeakPolarHBondContact O-CB 3.46Å; I205-L208 PolarHBondContact O-N 3.19Å; I205-L208 VanDerWaalsContact O-N 3.1Å; L208-E212 PolarHBondContact O-N 3.48Å; L208-V213 HydrophobicContact CB-CB 4.29Å; L208-V213 HydrophobicContact CD2-CB 3.87Å; L208-V213 HydrophobicContact CD2-CG1 3.9Å; L208-V213 HydrophobicContact CD2-CG2 3.95Å; L208-V213 WeakPolarHBondContact O-CB 3.15Å; L208-V213 PolarHBondContact O-N 2.96Å; L208-Y214 HydrophobicContact CB-CD2 4.01Å; L208-Y214 HydrophobicContact CD1-CD2 4.2Å; L208-Y214 HydrophobicContact CD1-CE2 4.08Å; L208-Y214 PolarHBondContact O-N 3.12Å
209	I	92	Very high	88.9	Confident	56 Å²	56	47.9 Å²	47.9	29%	0.287	23%	0.232	S	C	.	.	H	α-helix	trans	-71.8	-43.5	173.2	-63.9	164.8	0	0	0	110.9	I205 D206 R207 E211 E212 Y214 A217	I205-I209 HydrophobicContact CG1-CD1 4.1Å; I205-I209 HydrophobicContact CG1-CG1 4.44Å; I205-I209 WeakPolarHBondContact O-CG1 3.35Å; I205-I209 PolarHBondContact O-N 3.47Å; D206-I209 PolarHBondContact O-N 3.43Å; R207-I209 PolarHBondContact O-N 2.78Å; I209-E211 VanDerWaalsContact C-N 3.31Å; I209-E211 PolarHBondContact O-N 3.24Å; I209-E212 PolarHBondContact O-N 3.28Å; I209-E212 VanDerWaalsContact O-N 3.09Å; I209-Y214 WeakPolarHBondContact CA-O 3.41Å; I209-A217 HydrophobicContact CD1-CB 3.71Å
210	Q	88.3	Confident	89.6	Confident	118 Å²	118	39.2 Å²	39.2	55%	0.551	19%	0.192	S	C	*	.	H	α-helix	trans	-64	-33.8	176.9	-71.8	170.3	18.6	0	0	113.1	D206 R207 E212	D206-Q210 VanDerWaalsContact O-CG 3.3Å; D206-Q210 WeakPolarHBondContact O-CG 3.39Å; D206-Q210 PolarHBondContact O-N 2.92Å; R207-Q210 PolarHBondContact O-N 2.8Å; Q210-E212 PolarHBondContact O-N 3.05Å
211	E	88	Confident	90.1	Very high	68 Å²	68	32.3 Å²	32.3	32%	0.318	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	7.2	175.1	-68.8	-179.8	174.8	0	0	112.7	Y195 R207 I209 V213	Y195-E211 PolarHBondContact OH-OE1 2.65Å; Y195-E211 PolarHBondContact OH-OE2 3.36Å; R207-E211 HydrophobicContact CG-CG 4.33Å; R207-E211 IonicContact CZ-OE1 2.76Å; R207-E211 VanDerWaalsContact CZ-OE1 3.31Å; R207-E211 IonicContact NE-OE1 3.58Å; R207-E211 PolarHBondContact NE-OE1 3.34Å; R207-E211 IonicContact NH2-OE1 2.66Å; R207-E211 PolarHBondContact NH2-OE1 2.65Å; R207-E211 WeakPolarHBondContact O-CB 3.21Å; R207-E211 WeakPolarHBondContact O-CG 3.44Å; R207-E211 PolarHBondContact O-N 2.74Å; I209-E211 VanDerWaalsContact C-N 3.31Å; I209-E211 PolarHBondContact O-N 3.24Å; E211-V213 HydrophobicContact CB-CG2 4.11Å; E211-V213 PolarHBondContact O-N 3.18Å
212	E	88.9	Confident	90.3	Very high	156 Å²	156	33.6 Å²	33.6	73%	0.729	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.8	29.4	-179.4	-57	-177.1	165.7	0	0	113.7	L208 I209 Q210	L208-E212 PolarHBondContact O-N 3.48Å; I209-E212 PolarHBondContact O-N 3.28Å; I209-E212 VanDerWaalsContact O-N 3.09Å; Q210-E212 PolarHBondContact O-N 3.05Å
213	V	91.9	Very high	90.2	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.006	16%	0.163	C	C	.	.	S	Bend	trans	-78.4	-40.8	174.1	-178.9	0	0	0	0	110.5	N64 R68 L208 E211	N64-V213 HydrophobicContact CB-CG1 4.35Å; N64-V213 HydrophobicContact CB-CG2 4.39Å; R68-V213 HydrophobicContact CG-CG1 3.4Å; R68-V213 PolarHBondContact NH1-O 3.12Å; R68-V213 VanDerWaalsContact NH1-O 3.09Å; L208-V213 HydrophobicContact CB-CB 4.29Å; L208-V213 HydrophobicContact CD2-CB 3.87Å; L208-V213 HydrophobicContact CD2-CG1 3.9Å; L208-V213 HydrophobicContact CD2-CG2 3.95Å; L208-V213 WeakPolarHBondContact O-CB 3.15Å; L208-V213 PolarHBondContact O-N 2.96Å; E211-V213 HydrophobicContact CB-CG2 4.11Å; E211-V213 PolarHBondContact O-N 3.18Å
214	Y	93.7	Very high	90.1	Very high	1 Å²	1	35 Å²	35	0%	0.004	18%	0.178	C	C	.	.	S	Bend	trans	-116.2	145.4	166.4	-71.7	-69.1	0	0	0	109.3	L46 W48 R68 F71 E72 I205 L208 I209	L46-Y214 HydrophobicContact CB-CD1 4.02Å; L46-Y214 HydrophobicContact CB-CE1 3.97Å; L46-Y214 HydrophobicContact CD1-CE1 4.2Å; L46-Y214 HydrophobicContact CD1-CE2 4.03Å; W48-Y214 HydrophobicContact CB-CD1 4.24Å; W48-Y214 HydrophobicContact CD2-CD1 4.45Å; W48-Y214 HydrophobicContact CD2-CE1 4.32Å; W48-Y214 AromaticContact CE3-CD1 3.85Å; W48-Y214 HydrophobicContact CE3-CD1 3.85Å; W48-Y214 AromaticContact CE3-CE1 3.56Å; W48-Y214 HydrophobicContact CE3-CE1 3.56Å; W48-Y214 AromaticContact CZ3-CE1 3.98Å; W48-Y214 HydrophobicContact CZ3-CE1 3.98Å; R68-Y214 HydrophobicContact CG-CE1 4.2Å; R68-Y214 HydrophobicContact CG-CE2 4.25Å; F71-Y214 HydrophobicContact CD1-CE2 4.06Å; F71-Y214 HydrophobicContact CE1-CE2 4.42Å; E72-Y214 PolarHBondContact OE1-OH 3.32Å; I205-Y214 HydrophobicContact CD1-CD2 3.6Å; I205-Y214 HydrophobicContact CD1-CE2 4.1Å; I205-Y214 HydrophobicContact CD1-CG 4.32Å; L208-Y214 HydrophobicContact CB-CD2 4.01Å; L208-Y214 HydrophobicContact CD1-CD2 4.2Å; L208-Y214 HydrophobicContact CD1-CE2 4.08Å; L208-Y214 PolarHBondContact O-N 3.12Å; I209-Y214 WeakPolarHBondContact CA-O 3.41Å
215	N	90.3	Very high	89.9	Confident	73 Å²	73	37.8 Å²	37.8	39%	0.39	19%	0.188	S	C	.	.	S	Bend	trans	-86.4	-31.3	178.5	-70.2	-2.9	0	0	0	112.1	V47 D49	V47-N215 PolarHBondContact O-N 3.19Å; D49-N215 VanDerWaalsContact CB-ND2 3.34Å; D49-N215 WeakPolarHBondContact CB-ND2 3.36Å; D49-N215 PolarHBondContact N-ND2 3.46Å; D49-N215 PolarHBondContact OD2-ND2 2.87Å
216	A	92.3	Very high	89.6	Confident	4 Å²	4	43.1 Å²	43.1	3%	0.033	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	153.4	178	0	0	0	0	0	111.6	V47 Y218 Y624	V47-A216 PolarHBondContact N-O 3.27Å; V47-A216 PolarHBondContact O-N 3.36Å; A216-Y218 HydrophobicContact CB-CD1 4.03Å; A216-Y218 HydrophobicContact CB-CE1 4.24Å; A216-Y624 HydrophobicContact CB-CD2 4.19Å; A216-Y624 HydrophobicContact CB-CE2 3.74Å
217	A	93.9	Very high	89.3	Confident	19 Å²	19	42.2 Å²	42.2	16%	0.157	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	122	168.3	0	0	0	0	0	107.6	Y44 V45 L46 I205 I209	Y44-A217 HydrophobicContact CE1-CB 3.73Å; V45-A217 WeakPolarHBondContact O-CA 3.39Å; L46-A217 HydrophobicContact CD2-CB 3.47Å; L46-A217 VanDerWaalsContact CD2-CB 3.47Å; I205-A217 HydrophobicContact CD1-CB 4.24Å; I205-A217 HydrophobicContact CG1-CB 3.66Å; I209-A217 HydrophobicContact CD1-CB 3.71Å
218	Y	93.7	Very high	89	Confident	8 Å²	8	44.4 Å²	44.4	3%	0.031	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	154.5	-173.8	57.1	-84.8	0	0	0	112.4	V45 V47 A216 F620 D623 Y624	V45-Y218 HydrophobicContact CB-CE2 4.2Å; V45-Y218 PolarHBondContact N-O 3.15Å; V45-Y218 PolarHBondContact O-N 2.96Å; V47-Y218 HydrophobicContact CG2-CE1 3.7Å; A216-Y218 HydrophobicContact CB-CD1 4.03Å; A216-Y218 HydrophobicContact CB-CE1 4.24Å; Y218-F620 PolarHBondContact OH-O 2.84Å; Y218-D623 HydrophobicContact CD2-CB 4.3Å; Y218-D623 HydrophobicContact CE2-CB 3.83Å; Y218-Y624 AromaticContact CE1-CD2 3.87Å; Y218-Y624 HydrophobicContact CE1-CD2 3.87Å
219	A	93	Very high	88.5	Confident	2 Å²	2	52 Å²	52	2%	0.017	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-82	148.2	168.5	0	0	0	0	0	110.3	Y44 H183	Y44-A219 HydrophobicContact CD2-CB 4.08Å; Y44-A219 HydrophobicContact CE2-CB 3.96Å; H183-A219 HydrophobicContact CB-CB 4.14Å
220	I	91	Very high	88	Confident	4 Å²	4	56.5 Å²	56.5	2%	0.021	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-85	147.5	-179.2	60	165.1	0	0	0	112.1	Y33 I42 V45 F620 D623 R681	Y33-I220 HydrophobicContact CD1-CD1 4.18Å; I42-I220 HydrophobicContact CB-CD1 3.89Å; I42-I220 HydrophobicContact CG2-CD1 4.17Å; I42-I220 HydrophobicContact CG2-CG2 4.36Å; I42-I220 WeakPolarHBondContact O-CD1 3.18Å; V45-I220 HydrophobicContact CG2-CG2 3.74Å; I220-F620 HydrophobicContact CG2-CB 4.15Å; I220-D623 WeakPolarHBondContact CA-OD2 3.42Å; I220-R681 WeakPolarHBondContact O-CD 3.09Å; I220-R681 PolarHBondContact O-NH1 2.87Å
221	H	90.6	Very high	87.5	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-73	145.9	168.2	-78.6	-76.6	0	0	0	111.2	G223 R241 Y266 D623 T679 R681	H221-G223 PolarHBondContact O-N 2.82Å; H221-R241 VanDerWaalsContact CB-NH1 3.27Å; H221-R241 VanDerWaalsContact CG-CZ 3.49Å; H221-Y266 AromaticContact ND1-CE1 3.99Å; H221-Y266 AromaticContact ND1-CZ 3.83Å; H221-Y266 PolarHBondContact ND1-OH 3Å; H221-D623 IonicContact CD2-OD1 3.74Å; H221-D623 PolarHBondContact CD2-OD1 3.31Å; H221-D623 IonicContact CD2-OD2 2.9Å; H221-D623 IonicContact CG-OD1 2.65Å; H221-D623 IonicContact CG-OD2 2.64Å; H221-D623 PolarHBondContact N-OD2 3.49Å; H221-T679 PolarHBondContact NE2-O 2.93Å; H221-R681 PolarHBondContact NE2-N 3.2Å
222	E	84.2	Confident	87.2	Confident	33 Å²	33	52.7 Å²	52.7	15%	0.154	27%	0.266	C	S	.	.	S	Bend	trans	-78.7	62.7	171.5	-68.9	163.8	-131	0	0	110.8	Y33 P179 N239 P240 Y266 R681	Y33-E222 VanDerWaalsContact OH-C 3.3Å; P179-E222 WeakPolarHBondContact CB-OE1 3.33Å; P179-E222 WeakPolarHBondContact CG-OE1 3.43Å; E222-N239 WeakPolarHBondContact O-CB 3.43Å; E222-N239 PolarHBondContact O-ND2 2.75Å; E222-N239 PolarHBondContact O-OD1 3.18Å; E222-P240 WeakPolarHBondContact OE2-CG 3.33Å; E222-Y266 HydrophobicContact CB-CE2 4.2Å; E222-R681 IonicContact OE1-CZ 2.66Å; E222-R681 IonicContact OE1-NH1 3.41Å; E222-R681 PolarHBondContact OE1-NH1 3.29Å; E222-R681 IonicContact OE1-NH2 3.11Å; E222-R681 PolarHBondContact OE1-NH2 2.87Å
223	G	83.5	Confident	86.8	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.01	26%	0.264	C	S	.	.	S	Bend	trans	100.4	-179.6	169.9	0	0	0	0	0	117.6	Y33 H221 R241	Y33-G223 WeakPolarHBondContact OH-CA 3.38Å; Y33-G223 PolarHBondContact OH-N 3.48Å; H221-G223 PolarHBondContact O-N 2.82Å; G223-R241 WeakPolarHBondContact O-CD 3.26Å; G223-R241 PolarHBondContact O-NH1 3.07Å
224	P	85.5	Confident	86.4	Confident	77 Å²	77	57 Å²	57	50%	0.5	29%	0.286	S	S	.	.			trans	-63.6	148.1	172	28.6	-33.6	0	0	0	109.7	N239 Q242	P224-N239 PolarHBondContact O-ND2 3.31Å; P224-Q242 WeakPolarHBondContact O-CG 3.45Å
225	Y	86.1	Confident	85.8	Confident	63 Å²	63	59 Å²	59	25%	0.247	30%	0.3	C	S	.	.	S	Bend	trans	-84.7	-16.2	173	65.3	-92.7	0	0	0	112.3	Y245	Y225-Y245 HydrophobicContact CD2-CD2 4Å; Y225-Y245 HydrophobicContact CD2-CE2 4.01Å; Y225-Y245 HydrophobicContact CD2-CG 4.26Å; Y225-Y245 HydrophobicContact CE2-CE2 4.44Å; Y225-Y245 WeakPolarHBondContact O-CD1 3.33Å
226	E	84.7	Confident	85.3	Confident	114 Å²	114	62.9 Å²	62.9	53%	0.533	32%	0.315	S	S	.	.			trans	-71	137.7	-180	-64.1	-179.7	-179.7	0	0	109.2	Q242	E226-Q242 PolarHBondContact O-NE2 3.48Å
227	V	82.3	Confident	84.9	Confident	27 Å²	27	69.2 Å²	69.2	16%	0.164	34%	0.342	C	S	.	.			trans	-109.3	119.7	-174.8	-176.1	0	0	0	0	107.5	D231 L232 M238 Q242 Y245 W246	V227-D231 HydrophobicContact CG1-CB 3.7Å; V227-L232 HydrophobicContact CG1-CD2 3.83Å; V227-L232 HydrophobicContact CG1-CG 3.9Å; V227-M238 HydrophobicContact CG1-CE 3.96Å; V227-Q242 HydrophobicContact CG2-CB 3.93Å; V227-Q242 HydrophobicContact CG2-CG 4.02Å; V227-Y245 HydrophobicContact CG2-CD1 4.37Å; V227-W246 HydrophobicContact CB-CE3 4.33Å; V227-W246 HydrophobicContact CG2-CB 4.36Å; V227-W246 HydrophobicContact CG2-CE3 4.21Å
228	D	83.4	Confident	84.4	Confident	108 Å²	108	68.7 Å²	68.7	58%	0.578	34%	0.336	S	S	*	.			trans	-83.9	164.9	178.5	-69.1	-32.8	0	0	0	111.4	E230 D231 L232	D228-E230 PolarHBondContact O-N 2.99Å; D228-D231 PolarHBondContact N-OD2 3.23Å; D228-D231 VanDerWaalsContact N-OD2 3.08Å; D228-D231 WeakPolarHBondContact O-CB 3.47Å; D228-D231 PolarHBondContact O-N 3.33Å; D228-L232 PolarHBondContact O-N 2.94Å
229	E	81.6	Confident	84.1	Confident	159 Å²	159	69.4 Å²	69.4	74%	0.743	34%	0.341	S	S	*	.	H	α-helix	trans	-61.3	-28.9	178.2	-69	-168.3	173	0	0	112.7	K233	E229-K233 PolarHBondContact O-N 2.85Å
230	E	80.3	Confident	83.8	Confident	151 Å²	151	71.8 Å²	71.8	71%	0.706	36%	0.356	S	S	*	.	H	α-helix	trans	-69.8	-40.1	176.1	-63.7	-171.1	175.6	0	0	112.1	D228 L232 K233 N234	D228-E230 PolarHBondContact O-N 2.99Å; E230-L232 VanDerWaalsContact C-N 3.28Å; E230-L232 PolarHBondContact O-N 3.49Å; E230-K233 WeakPolarHBondContact O-CB 3.37Å; E230-K233 PolarHBondContact O-N 2.87Å; E230-K233 VanDerWaalsContact O-N 3.12Å; E230-N234 PolarHBondContact O-N 2.8Å
231	D	79.2	Confident	83.8	Confident	32 Å²	32	72 Å²	72	17%	0.171	36%	0.357	C	S	.	.	H	α-helix	trans	-61.2	-40.5	175.5	-66.4	-35.3	0	0	0	110.7	V227 D228 K233 N234 M238 Q242	V227-D231 HydrophobicContact CG1-CB 3.7Å; D228-D231 PolarHBondContact N-OD2 3.23Å; D228-D231 VanDerWaalsContact N-OD2 3.08Å; D228-D231 WeakPolarHBondContact O-CB 3.47Å; D228-D231 PolarHBondContact O-N 3.33Å; D231-K233 VanDerWaalsContact C-N 3.26Å; D231-K233 PolarHBondContact O-N 2.98Å; D231-N234 CarbonylContact O-C 3.56Å; D231-N234 PolarHBondContact O-N 3.46Å; D231-N234 VanDerWaalsContact O-N 3.17Å; D231-M238 VanDerWaalsContact C-CE 3.45Å; D231-M238 HydrophobicContact CB-CE 4.2Å; D231-M238 HydrophobicContact CB-CG 4.09Å; D231-M238 WeakPolarHBondContact O-CE 3.29Å; D231-Q242 PolarHBondContact OD2-NE2 3.39Å
232	L	80.5	Confident	83.8	Confident	74 Å²	74	72.5 Å²	72.5	39%	0.387	36%	0.359	S	S	.	.	H	α-helix	trans	-63.4	-30.4	177.1	-68.2	174.3	0	0	0	113	V227 D228 E230 M238 W246	V227-L232 HydrophobicContact CG1-CD2 3.83Å; V227-L232 HydrophobicContact CG1-CG 3.9Å; D228-L232 PolarHBondContact O-N 2.94Å; E230-L232 VanDerWaalsContact C-N 3.28Å; E230-L232 PolarHBondContact O-N 3.49Å; L232-M238 HydrophobicContact CD2-CE 4Å; L232-W246 HydrophobicContact CD1-CH2 4.1Å; L232-W246 HydrophobicContact CD1-CZ2 4.41Å; L232-W246 HydrophobicContact CD2-CD2 4.18Å; L232-W246 HydrophobicContact CD2-CE3 4.48Å; L232-W246 HydrophobicContact CD2-CH2 3.78Å; L232-W246 HydrophobicContact CD2-CZ2 3.47Å; L232-W246 VanDerWaalsContact CD2-CZ2 3.47Å; L232-W246 HydrophobicContact CD2-CZ3 4.3Å
233	K	81.4	Confident	84.1	Confident	157 Å²	157	71.1 Å²	71.1	68%	0.683	35%	0.352	S	S	*	.	H	α-helix	trans	-72.8	-35.5	175	-69.3	172.7	-175.2	169.2	0	111.6	E229 E230 D231 P235	E229-K233 PolarHBondContact O-N 2.85Å; E230-K233 WeakPolarHBondContact O-CB 3.37Å; E230-K233 PolarHBondContact O-N 2.87Å; E230-K233 VanDerWaalsContact O-N 3.12Å; D231-K233 VanDerWaalsContact C-N 3.26Å; D231-K233 PolarHBondContact O-N 2.98Å; K233-P235 WeakPolarHBondContact O-CD 3.35Å
234	N	84	Confident	84.6	Confident	89 Å²	89	71.1 Å²	71.1	48%	0.476	35%	0.352	S	S	.	.			trans	-121.7	72.7	-178.2	-69.4	-30.4	0	0	0	111.4	E230 D231 E236 K237	E230-N234 PolarHBondContact O-N 2.8Å; D231-N234 CarbonylContact O-C 3.56Å; D231-N234 PolarHBondContact O-N 3.46Å; D231-N234 VanDerWaalsContact O-N 3.17Å; N234-E236 PolarHBondContact O-N 2.95Å; N234-K237 HydrophobicContact CB-CB 4.43Å; N234-K237 HydrophobicContact CB-CD 4.39Å; N234-K237 HydrophobicContact CB-CG 4.34Å; N234-K237 PolarHBondContact O-N 2.9Å
235	P	80.7	Confident	84.9	Confident	45 Å²	45	70.2 Å²	70.2	29%	0.292	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-60.7	-19.4	-176.1	24.5	-34.8	0	0	0	114.2	P148 K233 K237 M238	P148-P235 HydrophobicContact CB-CB 4.21Å; P148-P235 HydrophobicContact CG-CB 4.12Å; K233-P235 WeakPolarHBondContact O-CD 3.35Å; P235-K237 VanDerWaalsContact C-N 3.32Å; P235-M238 HydrophobicContact CB-CE 4.13Å; P235-M238 HydrophobicContact CB-SD 4.26Å; P235-M238 WeakPolarHBondContact O-CB 3.23Å
236	E	79.9	Confident	85.1	Confident	153 Å²	153	70.5 Å²	70.5	72%	0.715	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-73	-22.3	175.7	-61.7	-174.2	168.9	0	0	113.2	N149 N234	N149-E236 PolarHBondContact ND2-O 3.39Å; N234-E236 PolarHBondContact O-N 2.95Å
237	K	82.9	Confident	85.4	Confident	137 Å²	137	66.5 Å²	66.5	60%	0.596	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-90.7	-5.7	177	-64.9	-170.3	180	-175.8	0	113.4	N234 P235	N234-K237 HydrophobicContact CB-CB 4.43Å; N234-K237 HydrophobicContact CB-CD 4.39Å; N234-K237 HydrophobicContact CB-CG 4.34Å; N234-K237 PolarHBondContact O-N 2.9Å; P235-K237 VanDerWaalsContact C-N 3.32Å
238	M	83.8	Confident	85.9	Confident	8 Å²	8	65.2 Å²	65.2	4%	0.039	31%	0.312	C	S	.	.			trans	-60.8	140.2	179.9	-71.5	-180	178.7	0	0	111.4	V227 D231 L232 P235 Q242 I243 Y247	V227-M238 HydrophobicContact CG1-CE 3.96Å; D231-M238 VanDerWaalsContact C-CE 3.45Å; D231-M238 HydrophobicContact CB-CE 4.2Å; D231-M238 HydrophobicContact CB-CG 4.09Å; D231-M238 WeakPolarHBondContact O-CE 3.29Å; L232-M238 HydrophobicContact CD2-CE 4Å; P235-M238 HydrophobicContact CB-CE 4.13Å; P235-M238 HydrophobicContact CB-SD 4.26Å; P235-M238 WeakPolarHBondContact O-CB 3.23Å; M238-Q242 HydrophobicContact CB-CB 4.41Å; M238-I243 HydrophobicContact CB-CD1 4.2Å; M238-I243 HydrophobicContact CB-CG1 3.69Å; M238-I243 HydrophobicContact SD-CG1 4.4Å; M238-Y247 HydrophobicContact SD-CE2 4.38Å
239	N	86.6	Confident	86.3	Confident	24 Å²	24	60.1 Å²	60.1	13%	0.128	29%	0.285	C	S	.	.			trans	-69.1	155.4	173.7	79.1	37.7	0	0	0	110.6	E222 P224 R241 Q242 I243	E222-N239 WeakPolarHBondContact O-CB 3.43Å; E222-N239 PolarHBondContact O-ND2 2.75Å; E222-N239 PolarHBondContact O-OD1 3.18Å; P224-N239 PolarHBondContact O-ND2 3.31Å; N239-R241 PolarHBondContact O-N 3.32Å; N239-R241 VanDerWaalsContact O-N 3.15Å; N239-R241 WeakPolarHBondContact OD1-CA 3.38Å; N239-R241 WeakPolarHBondContact OD1-CB 3.44Å; N239-R241 PolarHBondContact OD1-N 3.44Å; N239-Q242 VanDerWaalsContact ND2-CD 3.28Å; N239-Q242 WeakPolarHBondContact ND2-CG 3.5Å; N239-Q242 PolarHBondContact ND2-OE1 2.96Å; N239-Q242 WeakPolarHBondContact O-CB 3.24Å; N239-Q242 PolarHBondContact O-N 2.98Å; N239-Q242 VanDerWaalsContact OD1-CB 3.31Å; N239-Q242 WeakPolarHBondContact OD1-CB 3.21Å; N239-Q242 VanDerWaalsContact OD1-CG 3.29Å; N239-Q242 WeakPolarHBondContact OD1-CG 3.49Å; N239-Q242 PolarHBondContact OD1-N 2.74Å; N239-I243 WeakPolarHBondContact O-CG1 3.45Å; N239-I243 PolarHBondContact O-N 2.81Å
240	P	88.3	Confident	86.6	Confident	51 Å²	51	57.9 Å²	57.9	33%	0.331	27%	0.27	S	S	.	.	H	α-helix	trans	-58.8	-30.2	-178.4	-29.3	38.7	0	0	0	114	E222 L244 Y266	E222-P240 WeakPolarHBondContact OE2-CG 3.33Å; P240-L244 WeakPolarHBondContact O-CG 3.23Å; P240-L244 PolarHBondContact O-N 3.47Å; P240-Y266 HydrophobicContact CB-CD2 3.85Å; P240-Y266 HydrophobicContact CB-CE2 4.16Å
241	R	90.8	Very high	87	Confident	9 Å²	9	56.4 Å²	56.4	3%	0.034	26%	0.258	C	S	.	.	H	α-helix	trans	-70.7	-40.6	178.6	-166.1	-174.2	-174.8	174.6	4.1	112.1	H221 G223 N239 L244 Y245 Y266 D623 V676	H221-R241 VanDerWaalsContact CB-NH1 3.27Å; H221-R241 VanDerWaalsContact CG-CZ 3.49Å; G223-R241 WeakPolarHBondContact O-CD 3.26Å; G223-R241 PolarHBondContact O-NH1 3.07Å; N239-R241 PolarHBondContact O-N 3.32Å; N239-R241 VanDerWaalsContact O-N 3.15Å; N239-R241 WeakPolarHBondContact OD1-CA 3.38Å; N239-R241 WeakPolarHBondContact OD1-CB 3.44Å; N239-R241 PolarHBondContact OD1-N 3.44Å; R241-L244 PolarHBondContact O-N 2.65Å; R241-Y245 WeakPolarHBondContact O-CB 3.24Å; R241-Y245 PolarHBondContact O-N 3.03Å; R241-Y266 HydrophobicContact CB-CE2 4.47Å; R241-D623 IonicContact NH1-OD1 2.93Å; R241-V676 HydrophobicContact CG-CG1 4.05Å; R241-V676 VanDerWaalsContact CZ-O 3.31Å; R241-V676 PolarHBondContact NE-O 2.78Å; R241-V676 PolarHBondContact NH2-O 2.92Å
242	Q	90.5	Very high	87.3	Confident	10 Å²	10	56.9 Å²	56.9	5%	0.047	27%	0.27	C	S	.	.	H	α-helix	trans	-65.1	-42.8	175.2	-78.7	172.2	-29	0	0	110.2	P224 E226 V227 D231 M238 N239 Y245 W246	P224-Q242 WeakPolarHBondContact O-CG 3.45Å; E226-Q242 PolarHBondContact O-NE2 3.48Å; V227-Q242 HydrophobicContact CG2-CB 3.93Å; V227-Q242 HydrophobicContact CG2-CG 4.02Å; D231-Q242 PolarHBondContact OD2-NE2 3.39Å; M238-Q242 HydrophobicContact CB-CB 4.41Å; N239-Q242 VanDerWaalsContact ND2-CD 3.28Å; N239-Q242 WeakPolarHBondContact ND2-CG 3.5Å; N239-Q242 PolarHBondContact ND2-OE1 2.96Å; N239-Q242 WeakPolarHBondContact O-CB 3.24Å; N239-Q242 PolarHBondContact O-N 2.98Å; N239-Q242 VanDerWaalsContact OD1-CB 3.31Å; N239-Q242 WeakPolarHBondContact OD1-CB 3.21Å; N239-Q242 VanDerWaalsContact OD1-CG 3.29Å; N239-Q242 WeakPolarHBondContact OD1-CG 3.49Å; N239-Q242 PolarHBondContact OD1-N 2.74Å; Q242-Y245 PolarHBondContact O-N 2.95Å; Q242-W246 WeakPolarHBondContact O-CB 3.11Å; Q242-W246 PolarHBondContact O-N 2.65Å
243	I	91.2	Very high	87.6	Confident	4 Å²	4	53.9 Å²	53.9	2%	0.021	26%	0.255	C	S	.	.	H	α-helix	trans	-59.4	-49.9	173.9	-64.6	172.4	0	0	0	109.8	V147 P148 N149 M238 N239 Y245 W246 Y247	V147-I243 HydrophobicContact CG1-CG2 3.6Å; P148-I243 HydrophobicContact CG-CD1 4.42Å; P148-I243 HydrophobicContact CG-CG1 4.4Å; N149-I243 HydrophobicContact CB-CD1 4.13Å; M238-I243 HydrophobicContact CB-CD1 4.2Å; M238-I243 HydrophobicContact CB-CG1 3.69Å; M238-I243 HydrophobicContact SD-CG1 4.4Å; N239-I243 WeakPolarHBondContact O-CG1 3.45Å; N239-I243 PolarHBondContact O-N 2.81Å; I243-Y245 VanDerWaalsContact C-N 3.32Å; I243-Y245 PolarHBondContact O-N 2.8Å; I243-W246 PolarHBondContact O-N 3.21Å; I243-Y247 HydrophobicContact CG2-CD2 4.04Å; I243-Y247 WeakPolarHBondContact O-CB 3.21Å; I243-Y247 WeakPolarHBondContact O-CD2 3.47Å; I243-Y247 PolarHBondContact O-N 3.02Å
244	L	92.8	Very high	87.7	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-62.4	-39	177.6	-73.5	171.4	0	0	0	112.4	P240 R241 W248 A249 H262 I263 Y266 F267 V676	P240-L244 WeakPolarHBondContact O-CG 3.23Å; P240-L244 PolarHBondContact O-N 3.47Å; R241-L244 PolarHBondContact O-N 2.65Å; L244-W248 HydrophobicContact CB-CE3 4.4Å; L244-W248 HydrophobicContact CD2-CE3 4.04Å; L244-W248 WeakPolarHBondContact O-CA 3.24Å; L244-W248 VanDerWaalsContact O-CB 3.3Å; L244-W248 WeakPolarHBondContact O-CB 3.49Å; L244-W248 PolarHBondContact O-N 2.92Å; L244-W248 VanDerWaalsContact O-N 3.1Å; L244-A249 PolarHBondContact O-N 3.4Å; L244-H262 HydrophobicContact CD2-CB 3.86Å; L244-I263 HydrophobicContact CD2-CG1 3.86Å; L244-Y266 HydrophobicContact CD1-CD1 3.56Å; L244-Y266 HydrophobicContact CD1-CD2 4.43Å; L244-Y266 HydrophobicContact CD1-CE1 4.34Å; L244-Y266 HydrophobicContact CD1-CG 3.61Å; L244-F267 HydrophobicContact CD1-CD2 4.39Å; L244-F267 HydrophobicContact CD1-CE2 3.93Å; L244-V676 HydrophobicContact CB-CG2 4.17Å
245	Y	92.3	Very high	87.8	Confident	58 Å²	58	53 Å²	53	23%	0.227	24%	0.242	C	C	.	.	I	π-helix	trans	-63.4	-52	177.1	-178.6	-106.1	0	0	0	111.8	Y225 V227 R241 Q242 I243 A249 R250 V676 C677	Y225-Y245 HydrophobicContact CD2-CD2 4Å; Y225-Y245 HydrophobicContact CD2-CE2 4.01Å; Y225-Y245 HydrophobicContact CD2-CG 4.26Å; Y225-Y245 HydrophobicContact CE2-CE2 4.44Å; Y225-Y245 WeakPolarHBondContact O-CD1 3.33Å; V227-Y245 HydrophobicContact CG2-CD1 4.37Å; R241-Y245 WeakPolarHBondContact O-CB 3.24Å; R241-Y245 PolarHBondContact O-N 3.03Å; Q242-Y245 PolarHBondContact O-N 2.95Å; I243-Y245 VanDerWaalsContact C-N 3.32Å; I243-Y245 PolarHBondContact O-N 2.8Å; Y245-A249 HydrophobicContact CD2-CB 4.2Å; Y245-A249 PolarHBondContact O-N 2.93Å; Y245-R250 PolarHBondContact O-N 3.41Å; Y245-V676 HydrophobicContact CD2-CG1 4.25Å; Y245-C677 VanDerWaalsContact CD2-SG 3.59Å; Y245-C677 VanDerWaalsContact CE2-SG 3.56Å
246	W	90.6	Very high	88	Confident	70 Å²	70	54.4 Å²	54.4	27%	0.265	24%	0.241	S	C	.	.	I	π-helix	trans	-72.1	-43.5	-173.1	-168.5	-102.2	0	0	0	113.1	V227 L232 Q242 I243 R250 C253	V227-W246 HydrophobicContact CB-CE3 4.33Å; V227-W246 HydrophobicContact CG2-CB 4.36Å; V227-W246 HydrophobicContact CG2-CE3 4.21Å; L232-W246 HydrophobicContact CD1-CH2 4.1Å; L232-W246 HydrophobicContact CD1-CZ2 4.41Å; L232-W246 HydrophobicContact CD2-CD2 4.18Å; L232-W246 HydrophobicContact CD2-CE3 4.48Å; L232-W246 HydrophobicContact CD2-CH2 3.78Å; L232-W246 HydrophobicContact CD2-CZ2 3.47Å; L232-W246 VanDerWaalsContact CD2-CZ2 3.47Å; L232-W246 HydrophobicContact CD2-CZ3 4.3Å; Q242-W246 WeakPolarHBondContact O-CB 3.11Å; Q242-W246 PolarHBondContact O-N 2.65Å; I243-W246 PolarHBondContact O-N 3.21Å; W246-R250 VanDerWaalsContact CZ2-NH1 3.29Å; W246-R250 VanDerWaalsContact CZ3-NH1 3.26Å; W246-C253 PolarHBondContact O-SG 2.98Å
247	Y	90.2	Very high	88.3	Confident	29 Å²	29	49.7 Å²	49.7	11%	0.114	22%	0.217	C	C	.	.	I	π-helix	trans	-89.9	-15.3	-173.4	-68.4	-99.4	0	0	0	113.2	Q145 V147 P148 M238 I243	Q145-Y247 HydrophobicContact CG-CD1 3.8Å; Q145-Y247 HydrophobicContact CG-CE1 4.15Å; Q145-Y247 VanDerWaalsContact NE2-CE1 3.33Å; Q145-Y247 PolarHBondContact OE1-O 3.03Å; V147-Y247 HydrophobicContact CB-CD1 4.29Å; V147-Y247 HydrophobicContact CG1-CD1 4.1Å; V147-Y247 HydrophobicContact CG1-CD2 4.45Å; V147-Y247 HydrophobicContact CG1-CG 4.02Å; V147-Y247 HydrophobicContact CG2-CD1 3.94Å; V147-Y247 HydrophobicContact CG2-CG 4.41Å; P148-Y247 HydrophobicContact CG-CE2 3.85Å; M238-Y247 HydrophobicContact SD-CE2 4.38Å; I243-Y247 HydrophobicContact CG2-CD2 4.04Å; I243-Y247 WeakPolarHBondContact O-CB 3.21Å; I243-Y247 WeakPolarHBondContact O-CD2 3.47Å; I243-Y247 PolarHBondContact O-N 3.02Å
248	W	92.4	Very high	88.7	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	20%	0.196	C	C	.	.	I	π-helix	trans	-133.7	-53.5	-174.5	176.1	59.2	0	0	0	114.8	L244 R250 P259 I263 F267 F275 R669 A672 V676	L244-W248 HydrophobicContact CB-CE3 4.4Å; L244-W248 HydrophobicContact CD2-CE3 4.04Å; L244-W248 WeakPolarHBondContact O-CA 3.24Å; L244-W248 VanDerWaalsContact O-CB 3.3Å; L244-W248 WeakPolarHBondContact O-CB 3.49Å; L244-W248 PolarHBondContact O-N 2.92Å; L244-W248 VanDerWaalsContact O-N 3.1Å; W248-R250 VanDerWaalsContact C-N 3.31Å; W248-R250 PolarHBondContact O-N 2.82Å; W248-P259 HydrophobicContact CB-CG 3.79Å; W248-P259 HydrophobicContact CG-CG 4.21Å; W248-I263 HydrophobicContact CD2-CD1 3.8Å; W248-I263 HydrophobicContact CD2-CG1 4.06Å; W248-I263 HydrophobicContact CE3-CD1 4.27Å; W248-I263 HydrophobicContact CE3-CG1 4.04Å; W248-I263 HydrophobicContact CG-CD1 4.31Å; W248-I263 HydrophobicContact CH2-CD1 4Å; W248-I263 HydrophobicContact CH2-CG1 4Å; W248-I263 HydrophobicContact CH2-CG2 4.29Å; W248-I263 HydrophobicContact CZ2-CD1 3.47Å; W248-I263 VanDerWaalsContact CZ2-CD1 3.47Å; W248-I263 HydrophobicContact CZ2-CG1 4Å; W248-I263 HydrophobicContact CZ3-CD1 4.38Å; W248-I263 HydrophobicContact CZ3-CG1 4.03Å; W248-F267 HydrophobicContact CZ3-CE2 4.05Å; W248-F275 HydrophobicContact CH2-CD1 4.44Å; W248-F275 AromaticContact CH2-CD2 3.85Å; W248-F275 HydrophobicContact CH2-CD2 3.85Å; W248-F275 HydrophobicContact CH2-CE1 4.07Å; W248-F275 AromaticContact CH2-CE2 3.42Å; W248-F275 HydrophobicContact CH2-CE2 3.42Å; W248-F275 VanDerWaalsContact CH2-CE2 3.42Å; W248-F275 HydrophobicContact CH2-CG 4.34Å; W248-F275 AromaticContact CH2-CZ 3.52Å; W248-F275 HydrophobicContact CH2-CZ 3.52Å; W248-F275 AromaticContact CZ2-CD1 3.57Å; W248-F275 HydrophobicContact CZ2-CD1 3.57Å; W248-F275 AromaticContact CZ2-CD2 3.64Å; W248-F275 HydrophobicContact CZ2-CD2 3.64Å; W248-F275 AromaticContact CZ2-CE1 3.44Å; W248-F275 HydrophobicContact CZ2-CE1 3.44Å; W248-F275 VanDerWaalsContact CZ2-CE1 3.44Å; W248-F275 AromaticContact CZ2-CE2 3.52Å; W248-F275 HydrophobicContact CZ2-CE2 3.52Å; W248-F275 AromaticContact CZ2-CG 3.66Å; W248-F275 HydrophobicContact CZ2-CG 3.66Å; W248-F275 AromaticContact CZ2-CZ 3.41Å; W248-F275 HydrophobicContact CZ2-CZ 3.41Å; W248-F275 VanDerWaalsContact CZ2-CZ 3.41Å; W248-R669 PolarHBondContact O-NH1 3.24Å; W248-A672 HydrophobicContact CD2-CB 3.68Å; W248-A672 VanDerWaalsContact CE2-CB 3.47Å; W248-A672 HydrophobicContact CE3-CB 3.82Å; W248-A672 HydrophobicContact CG-CB 4.43Å; W248-A672 HydrophobicContact CH2-CB 3.65Å; W248-A672 HydrophobicContact CZ2-CB 3.5Å; W248-A672 VanDerWaalsContact CZ2-CB 3.5Å; W248-A672 HydrophobicContact CZ3-CB 3.79Å; W248-V676 HydrophobicContact CE3-CG2 4.3Å; W248-V676 HydrophobicContact CZ3-CG2 4.02Å
249	A	91.5	Very high	89.1	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.008	20%	0.199	C	C	.	.	I	π-helix	trans	-76	-14.6	-173.8	0	0	0	0	0	114.6	L244 Y245 A672 K673 V676	L244-A249 PolarHBondContact O-N 3.4Å; Y245-A249 HydrophobicContact CD2-CB 4.2Å; Y245-A249 PolarHBondContact O-N 2.93Å; A249-A672 HydrophobicContact CB-CB 4.12Å; A249-K673 HydrophobicContact CB-CB 4.49Å; A249-V676 HydrophobicContact CB-CB 4.4Å; A249-V676 HydrophobicContact CB-CG2 4.32Å
250	R	89.7	Confident	89.3	Confident	112 Å²	112	45.1 Å²	45.1	42%	0.423	20%	0.199	S	C	.	.	S	Bend	trans	-72.9	134.3	179.1	-169.1	176.7	173.9	-177.2	-1.3	111.8	Y245 W246 W248 G252 C253	Y245-R250 PolarHBondContact O-N 3.41Å; W246-R250 VanDerWaalsContact CZ2-NH1 3.29Å; W246-R250 VanDerWaalsContact CZ3-NH1 3.26Å; W248-R250 VanDerWaalsContact C-N 3.31Å; W248-R250 PolarHBondContact O-N 2.82Å; R250-G252 PolarHBondContact O-N 2.96Å; R250-G252 VanDerWaalsContact O-N 3.13Å; R250-C253 WeakPolarHBondContact O-CB 3.2Å; R250-C253 PolarHBondContact O-N 3.32Å
251	W	87.4	Confident	89.4	Confident	121 Å²	121	44.7 Å²	44.7	46%	0.458	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-53.6	-34.1	175.9	-70	97.3	0	0	0	114	C253 W254 I666 R669 L670	W251-C253 PolarHBondContact O-N 2.86Å; W251-W254 WeakPolarHBondContact O-CB 3.43Å; W251-W254 VanDerWaalsContact O-CD1 3.28Å; W251-W254 PolarHBondContact O-N 2.96Å; W251-I666 HydrophobicContact CH2-CG2 4.11Å; W251-I666 HydrophobicContact CZ3-CG2 4.35Å; W251-R669 HydrophobicContact CE3-CB 4.45Å; W251-R669 HydrophobicContact CZ3-CB 4.48Å; W251-L670 HydrophobicContact CH2-CD2 3.63Å; W251-L670 HydrophobicContact CH2-CG 4Å; W251-L670 HydrophobicContact CZ2-CD2 3.51Å; W251-L670 HydrophobicContact CZ2-CG 4.35Å
252	G	86.4	Confident	89.4	Confident	41 Å²	41	45.1 Å²	45.1	42%	0.423	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-65.5	-15.9	177.6	0	0	0	0	0	114.7	R250 W254 Y255	R250-G252 PolarHBondContact O-N 2.96Å; R250-G252 VanDerWaalsContact O-N 3.13Å; G252-W254 VanDerWaalsContact C-N 3.34Å; G252-Y255 VanDerWaalsContact O-CE1 3.25Å; G252-Y255 WeakPolarHBondContact O-CE1 3.49Å
253	C	85.8	Confident	89.6	Confident	11 Å²	11	44.6 Å²	44.6	7%	0.074	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-92	9.7	179.8	-65.1	0	0	0	0	112.9	W246 R250 W251 Y255 R256 R669	W246-C253 PolarHBondContact O-SG 2.98Å; R250-C253 WeakPolarHBondContact O-CB 3.2Å; R250-C253 PolarHBondContact O-N 3.32Å; W251-C253 PolarHBondContact O-N 2.86Å; C253-Y255 VanDerWaalsContact C-N 3.26Å; C253-Y255 PolarHBondContact O-N 3.41Å; C253-Y255 VanDerWaalsContact O-N 3.12Å; C253-R256 WeakPolarHBondContact O-CB 3.27Å; C253-R256 PolarHBondContact O-N 3.44Å; C253-R669 PolarHBondContact O-NH1 3.4Å; C253-R669 PolarHBondContact O-NH2 3.18Å
254	W	84.5	Confident	89.6	Confident	141 Å²	141	47.1 Å²	47.1	53%	0.534	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-38.4	-173.8	69.1	-88.4	0	0	0	114.6	W251 G252 R669	W251-W254 WeakPolarHBondContact O-CB 3.43Å; W251-W254 VanDerWaalsContact O-CD1 3.28Å; W251-W254 PolarHBondContact O-N 2.96Å; G252-W254 VanDerWaalsContact C-N 3.34Å; W254-R669 PolarHBondContact O-NH2 3.27Å
255	Y	84.9	Confident	89.5	Confident	88 Å²	88	49.7 Å²	49.7	35%	0.345	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-5.3	-179.4	64.2	-91.3	0	0	0	114.6	I142 M143 G252 C253	I142-Y255 HydrophobicContact CG2-CD2 4.25Å; I142-Y255 HydrophobicContact CG2-CE2 4.35Å; M143-Y255 WeakPolarHBondContact CG-O 3.42Å; G252-Y255 VanDerWaalsContact O-CE1 3.25Å; G252-Y255 WeakPolarHBondContact O-CE1 3.49Å; C253-Y255 VanDerWaalsContact C-N 3.26Å; C253-Y255 PolarHBondContact O-N 3.41Å; C253-Y255 VanDerWaalsContact O-N 3.12Å
256	R	86.2	Confident	89.6	Confident	74 Å²	74	47.1 Å²	47.1	28%	0.279	21%	0.211	S	C	.	.	S	Bend	trans	-92.9	151.7	-175.1	-58.2	-171.2	177.3	-138.3	-9.1	112	M143 C253 R669	M143-R256 WeakPolarHBondContact O-CA 3.01Å; C253-R256 WeakPolarHBondContact O-CB 3.27Å; C253-R256 PolarHBondContact O-N 3.44Å; R256-R669 PolarHBondContact O-NH2 2.93Å; R256-R669 VanDerWaalsContact O-NH2 3.11Å
257	Y	86.3	Confident	89.8	Confident	54 Å²	54	43.8 Å²	43.8	21%	0.212	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-61	148.9	173.1	-67.4	-50.8	0	0	0	111.9	N128 S130 M143	N128-Y257 HydrophobicContact CB-CE2 4.49Å; N128-Y257 WeakPolarHBondContact ND2-CD2 3.26Å; S130-Y257 VanDerWaalsContact CB-OH 3.22Å; S130-Y257 WeakPolarHBondContact CB-OH 3.45Å; S130-Y257 PolarHBondContact OG-OH 2.95Å; M143-Y257 HydrophobicContact CB-CD1 4.32Å; M143-Y257 HydrophobicContact CB-CD2 3.88Å; M143-Y257 HydrophobicContact CB-CE1 3.91Å; M143-Y257 HydrophobicContact CB-CE2 3.46Å; M143-Y257 VanDerWaalsContact CB-CE2 3.46Å; M143-Y257 HydrophobicContact CB-CG 4.26Å; M143-Y257 VanDerWaalsContact CB-CZ 3.42Å; M143-Y257 HydrophobicContact CG-CE1 4.49Å; M143-Y257 VanDerWaalsContact O-CD2 3.29Å; M143-Y257 WeakPolarHBondContact O-CD2 3.23Å; M143-Y257 PolarHBondContact O-N 3.42Å; M143-Y257 HydrophobicContact SD-CE1 3.75Å; M143-Y257 PolarHBondContact SD-OH 3.26Å
258	Q	90.5	Very high	89.9	Confident	33 Å²	33	42.5 Å²	42.5	15%	0.154	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-78.7	132.8	177.8	-59.5	-174.9	70.3	0	0	110.5	L260 I263 F275 I668	Q258-L260 VanDerWaalsContact C-N 3.26Å; Q258-L260 HydrophobicContact CB-CD2 4.25Å; Q258-L260 PolarHBondContact O-N 3.47Å; Q258-I263 HydrophobicContact CB-CD1 4.49Å; Q258-F275 PolarHBondContact NE2-O 2.95Å; Q258-I668 HydrophobicContact CG-CG2 4.36Å
259	P	91.4	Very high	89.9	Confident	15 Å²	15	43.5 Å²	43.5	10%	0.097	20%	0.199	C	C	.	.			trans	-79.3	73.2	176.5	33.4	-34.7	0	0	0	110.9	V147 W248 D261 H262 I263	V147-P259 HydrophobicContact CG2-CB 4.26Å; W248-P259 HydrophobicContact CB-CG 3.79Å; W248-P259 HydrophobicContact CG-CG 4.21Å; P259-D261 PolarHBondContact O-N 2.87Å; P259-D261 VanDerWaalsContact O-N 3.16Å; P259-H262 HydrophobicContact CB-CB 4.27Å; P259-H262 PolarHBondContact O-N 2.92Å; P259-I263 WeakPolarHBondContact O-CG1 3.29Å; P259-I263 PolarHBondContact O-N 2.96Å
260	L	91.3	Very high	90.1	Very high	24 Å²	24	45.9 Å²	45.9	13%	0.126	21%	0.209	C	C	.	.	H	α-helix	trans	-56	-34.1	-174.1	-64.9	177.2	0	0	0	113.4	Q258 I263 R264 F275 A276 W381	Q258-L260 VanDerWaalsContact C-N 3.26Å; Q258-L260 HydrophobicContact CB-CD2 4.25Å; Q258-L260 PolarHBondContact O-N 3.47Å; L260-I263 HydrophobicContact CD2-CD1 4.49Å; L260-I263 PolarHBondContact O-N 3.21Å; L260-R264 WeakPolarHBondContact O-CB 3.47Å; L260-R264 PolarHBondContact O-N 3.02Å; L260-F275 HydrophobicContact CD2-CB 4.24Å; L260-A276 HydrophobicContact CD1-CB 3.93Å; L260-A276 HydrophobicContact CD2-CB 4.01Å; L260-W381 HydrophobicContact CB-CZ2 4.35Å
261	D	89.8	Confident	90.3	Very high	43 Å²	43	40.7 Å²	40.7	23%	0.23	19%	0.19	C	C	.	.	H	α-helix	trans	-71.8	-38.9	-178.2	-60	-41.2	0	0	0	112	P151 P259 S265 R380	P151-D261 HydrophobicContact CG-CB 3.89Å; P259-D261 PolarHBondContact O-N 2.87Å; P259-D261 VanDerWaalsContact O-N 3.16Å; D261-S265 WeakPolarHBondContact O-CB 3.25Å; D261-S265 PolarHBondContact O-N 3.13Å; D261-S265 PolarHBondContact O-OG 2.92Å; D261-R380 VanDerWaalsContact CG-NH1 3.28Å; D261-R380 IonicContact OD1-CZ 3.52Å; D261-R380 VanDerWaalsContact OD1-CZ 3.31Å; D261-R380 IonicContact OD1-NH1 2.76Å; D261-R380 PolarHBondContact OD1-NH1 3.4Å; D261-R380 IonicContact OD1-NH2 2.89Å; D261-R380 IonicContact OD2-CZ 2.57Å; D261-R380 VanDerWaalsContact OD2-CZ 3.23Å; D261-R380 IonicContact OD2-NH1 3.26Å; D261-R380 PolarHBondContact OD2-NH1 3.32Å; D261-R380 IonicContact OD2-NH2 3.8Å; D261-R380 PolarHBondContact OD2-NH2 3Å
262	H	91.7	Very high	90.7	Very high	17 Å²	17	35 Å²	35	8%	0.079	17%	0.168	C	C	.	.	H	α-helix	trans	-68.6	-38.1	172.7	-64.9	82.1	0	0	0	112.4	V147 P148 N149 L244 P259 S265 Y266	V147-H262 VanDerWaalsContact CG1-CE1 3.48Å; V147-H262 WeakPolarHBondContact CG1-CE1 3.47Å; P148-H262 PolarHBondContact O-NE2 2.74Å; P148-H262 VanDerWaalsContact O-NE2 3.08Å; N149-H262 PolarHBondContact O-NE2 3.46Å; N149-H262 VanDerWaalsContact O-NE2 3.08Å; L244-H262 HydrophobicContact CD2-CB 3.86Å; P259-H262 HydrophobicContact CB-CB 4.27Å; P259-H262 PolarHBondContact O-N 2.92Å; H262-S265 WeakPolarHBondContact CA-OG 3.2Å; H262-S265 PolarHBondContact O-N 3.1Å; H262-S265 PolarHBondContact O-OG 3.47Å; H262-Y266 WeakPolarHBondContact O-CB 3.45Å; H262-Y266 PolarHBondContact O-N 3.13Å; H262-Y266 VanDerWaalsContact O-N 3.12Å
263	I	93.7	Very high	91.1	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.1	-48.9	176.4	-65.1	163.5	0	0	0	109.2	L244 W248 Q258 P259 L260 Y266 F267 I271 F275	L244-I263 HydrophobicContact CD2-CG1 3.86Å; W248-I263 HydrophobicContact CD2-CD1 3.8Å; W248-I263 HydrophobicContact CD2-CG1 4.06Å; W248-I263 HydrophobicContact CE3-CD1 4.27Å; W248-I263 HydrophobicContact CE3-CG1 4.04Å; W248-I263 HydrophobicContact CG-CD1 4.31Å; W248-I263 HydrophobicContact CH2-CD1 4Å; W248-I263 HydrophobicContact CH2-CG1 4Å; W248-I263 HydrophobicContact CH2-CG2 4.29Å; W248-I263 HydrophobicContact CZ2-CD1 3.47Å; W248-I263 VanDerWaalsContact CZ2-CD1 3.47Å; W248-I263 HydrophobicContact CZ2-CG1 4Å; W248-I263 HydrophobicContact CZ3-CD1 4.38Å; W248-I263 HydrophobicContact CZ3-CG1 4.03Å; Q258-I263 HydrophobicContact CB-CD1 4.49Å; P259-I263 WeakPolarHBondContact O-CG1 3.29Å; P259-I263 PolarHBondContact O-N 2.96Å; L260-I263 HydrophobicContact CD2-CD1 4.49Å; L260-I263 PolarHBondContact O-N 3.21Å; I263-Y266 PolarHBondContact O-N 3.38Å; I263-F267 HydrophobicContact CG2-CD2 4.27Å; I263-F267 WeakPolarHBondContact O-CB 3.17Å; I263-F267 PolarHBondContact O-N 3.26Å; I263-I271 HydrophobicContact CG2-CG2 4.08Å; I263-F275 HydrophobicContact CD1-CB 4.45Å; I263-F275 HydrophobicContact CG2-CD2 4.03Å
264	R	93.1	Very high	91.6	Very high	57 Å²	57	32.5 Å²	32.5	22%	0.215	14%	0.144	C	C	.	.	H	α-helix	trans	-58.6	-50.7	175.2	177	-160.4	170.7	-164.2	0.8	111.4	L260 Y266 G268 E269 R380 W381	L260-R264 WeakPolarHBondContact O-CB 3.47Å; L260-R264 PolarHBondContact O-N 3.02Å; R264-Y266 PolarHBondContact O-N 3.13Å; R264-G268 VanDerWaalsContact O-CA 3.23Å; R264-G268 WeakPolarHBondContact O-CA 3.4Å; R264-G268 PolarHBondContact O-N 3.09Å; R264-E269 HydrophobicContact CG-CG 4.12Å; R264-E269 IonicContact CZ-OE1 3.31Å; R264-E269 IonicContact NE-OE1 2.73Å; R264-E269 PolarHBondContact NE-OE1 3.47Å; R264-E269 IonicContact NH2-OE1 2.79Å; R264-E269 PolarHBondContact NH2-OE1 3.24Å; R264-R380 PolarHBondContact NH1-O 3.35Å; R264-W381 HydrophobicContact CB-CZ2 4.31Å; R264-W381 VanDerWaalsContact CD-CD1 3.41Å; R264-W381 VanDerWaalsContact CD-CG 3.46Å; R264-W381 HydrophobicContact CG-CD2 4.32Å; R264-W381 VanDerWaalsContact CZ-CB 3.43Å; R264-W381 VanDerWaalsContact NH1-CA 3.34Å; R264-W381 VanDerWaalsContact NH2-C 3.35Å; R264-W381 PolarHBondContact NH2-O 3.43Å
265	S	90.8	Very high	92.2	Very high	54 Å²	54	25.8 Å²	25.8	38%	0.378	12%	0.119	S	C	.	.	H	α-helix	trans	-62.1	-29.5	-174.3	64.8	0	0	0	0	112.5	T180 D261 H262	T180-S265 WeakPolarHBondContact CG2-O 3.34Å; T180-S265 PolarHBondContact OG1-O 3.33Å; D261-S265 WeakPolarHBondContact O-CB 3.25Å; D261-S265 PolarHBondContact O-N 3.13Å; D261-S265 PolarHBondContact O-OG 2.92Å; H262-S265 WeakPolarHBondContact CA-OG 3.2Å; H262-S265 PolarHBondContact O-N 3.1Å; H262-S265 PolarHBondContact O-OG 3.47Å
266	Y	93.4	Very high	92.6	Very high	4 Å²	4	21.7 Å²	21.7	2%	0.016	10%	0.103	C	C	.	.	H	α-helix	trans	-91.8	-42.7	-177.8	-168.5	-104.5	0	0	0	114.2	T180 H221 E222 P240 R241 L244 H262 I263 R264 R681	T180-Y266 WeakPolarHBondContact CG2-O 3.49Å; H221-Y266 AromaticContact ND1-CE1 3.99Å; H221-Y266 AromaticContact ND1-CZ 3.83Å; H221-Y266 PolarHBondContact ND1-OH 3Å; E222-Y266 HydrophobicContact CB-CE2 4.2Å; P240-Y266 HydrophobicContact CB-CD2 3.85Å; P240-Y266 HydrophobicContact CB-CE2 4.16Å; R241-Y266 HydrophobicContact CB-CE2 4.47Å; L244-Y266 HydrophobicContact CD1-CD1 3.56Å; L244-Y266 HydrophobicContact CD1-CD2 4.43Å; L244-Y266 HydrophobicContact CD1-CE1 4.34Å; L244-Y266 HydrophobicContact CD1-CG 3.61Å; H262-Y266 WeakPolarHBondContact O-CB 3.45Å; H262-Y266 PolarHBondContact O-N 3.13Å; H262-Y266 VanDerWaalsContact O-N 3.12Å; I263-Y266 PolarHBondContact O-N 3.38Å; R264-Y266 PolarHBondContact O-N 3.13Å; Y266-R681 PolarHBondContact O-NE 3.39Å; Y266-R681 PolarHBondContact O-NH2 3.37Å; Y266-R681 VanDerWaalsContact O-NH2 3.12Å
267	F	94.1	Very high	93.1	Very high	1 Å²	1	18.2 Å²	18.2	0%	0.004	9%	0.09	C	C	.	.	H	α-helix	trans	-108.3	-12.3	-172.3	-67.6	-59.1	0	0	0	114.6	L244 W248 I263 I271 L675 V676 P682 A684	L244-F267 HydrophobicContact CD1-CD2 4.39Å; L244-F267 HydrophobicContact CD1-CE2 3.93Å; W248-F267 HydrophobicContact CZ3-CE2 4.05Å; I263-F267 HydrophobicContact CG2-CD2 4.27Å; I263-F267 WeakPolarHBondContact O-CB 3.17Å; I263-F267 PolarHBondContact O-N 3.26Å; F267-I271 HydrophobicContact CB-CB 3.98Å; F267-I271 HydrophobicContact CB-CD1 3.78Å; F267-I271 HydrophobicContact CB-CG1 4.47Å; F267-I271 HydrophobicContact CB-CG2 3.9Å; F267-I271 HydrophobicContact CD2-CG2 4.43Å; F267-I271 HydrophobicContact CG-CD1 4.36Å; F267-I271 HydrophobicContact CG-CG2 4.38Å; F267-L675 HydrophobicContact CE1-CB 4.45Å; F267-L675 HydrophobicContact CE2-CB 4.43Å; F267-L675 HydrophobicContact CZ-CB 4.01Å; F267-V676 HydrophobicContact CE2-CG2 4.17Å; F267-V676 HydrophobicContact CZ-CG2 4.02Å; F267-P682 HydrophobicContact CB-CG 4.5Å; F267-P682 HydrophobicContact CD1-CG 3.49Å; F267-P682 VanDerWaalsContact CD1-CG 3.49Å; F267-P682 HydrophobicContact CE1-CG 4.07Å; F267-P682 HydrophobicContact CG-CG 4.37Å; F267-A684 WeakPolarHBondContact O-CA 3.4Å
268	G	92.9	Very high	93.5	Very high	2 Å²	2	15.6 Å²	15.6	2%	0.021	8%	0.08	C	C	.	.			trans	96.5	170.6	-178	0	0	0	0	0	114.6	R264 G272	R264-G268 VanDerWaalsContact O-CA 3.23Å; R264-G268 WeakPolarHBondContact O-CA 3.4Å; R264-G268 PolarHBondContact O-N 3.09Å; G268-G272 PolarHBondContact O-N 3.15Å; G268-G272 VanDerWaalsContact O-N 3.08Å
269	E	93.3	Very high	93.7	Very high	21 Å²	21	15 Å²	15	10%	0.098	8%	0.082	C	C	.	.	H	α-helix	trans	-66.3	-38.6	-174.4	-70	76.1	-166.6	0	0	113	R264 I271 G272 F273 W381 V383 E685	R264-E269 HydrophobicContact CG-CG 4.12Å; R264-E269 IonicContact CZ-OE1 3.31Å; R264-E269 IonicContact NE-OE1 2.73Å; R264-E269 PolarHBondContact NE-OE1 3.47Å; R264-E269 IonicContact NH2-OE1 2.79Å; R264-E269 PolarHBondContact NH2-OE1 3.24Å; E269-I271 PolarHBondContact O-N 3.26Å; E269-G272 CarbonylContact O-C 3.46Å; E269-G272 WeakPolarHBondContact O-CA 3.38Å; E269-G272 PolarHBondContact O-N 3.13Å; E269-G272 VanDerWaalsContact O-N 3.08Å; E269-F273 HydrophobicContact CB-CD2 4.42Å; E269-F273 HydrophobicContact CB-CE2 4.34Å; E269-F273 WeakPolarHBondContact O-CD2 3.4Å; E269-F273 PolarHBondContact O-N 3.17Å; E269-W381 HydrophobicContact CB-CE3 4.35Å; E269-W381 HydrophobicContact CG-CB 4.17Å; E269-W381 HydrophobicContact CG-CE3 4.25Å; E269-V383 HydrophobicContact CB-CG1 4.47Å; E269-V383 HydrophobicContact CG-CG1 3.89Å; E269-E685 PolarHBondContact N-O 3.3Å
270	K	93.8	Very high	93.8	Very high	51 Å²	51	14.8 Å²	14.8	22%	0.222	8%	0.08	C	C	.	.	H	α-helix	trans	-58.5	-45.9	-179	-168.5	174.9	-177.3	167.2	0	112.5	F273 Y274 D511 L632 E685 A687	K270-F273 PolarHBondContact O-N 3.21Å; K270-Y274 PolarHBondContact O-N 3.36Å; K270-D511 IonicContact NZ-OD2 3.19Å; K270-D511 PolarHBondContact NZ-OD2 3.1Å; K270-L632 HydrophobicContact CG-CD1 4.2Å; K270-E685 HydrophobicContact CB-CB 4.14Å; K270-E685 WeakPolarHBondContact CB-O 3.46Å; K270-E685 HydrophobicContact CD-CB 3.97Å; K270-E685 WeakPolarHBondContact CD-OE2 3.46Å; K270-E685 WeakPolarHBondContact CE-OE2 3.34Å; K270-E685 PolarHBondContact N-O 3.44Å; K270-E685 VanDerWaalsContact N-O 3.07Å; K270-E685 IonicContact NZ-OE2 2.68Å; K270-E685 PolarHBondContact NZ-OE2 3.31Å; K270-A687 HydrophobicContact CB-CB 3.99Å; K270-A687 HydrophobicContact CG-CB 4.21Å
271	I	95.1	Very high	94	Very high	3 Å²	3	13.6 Å²	13.6	2%	0.015	7%	0.074	C	C	.	.	H	α-helix	trans	-70.4	-36.9	174.2	-68.9	166.5	0	0	0	110.8	I263 F267 E269 F273 Y274 F275 L632 L675 P682	I263-I271 HydrophobicContact CG2-CG2 4.08Å; F267-I271 HydrophobicContact CB-CB 3.98Å; F267-I271 HydrophobicContact CB-CD1 3.78Å; F267-I271 HydrophobicContact CB-CG1 4.47Å; F267-I271 HydrophobicContact CB-CG2 3.9Å; F267-I271 HydrophobicContact CD2-CG2 4.43Å; F267-I271 HydrophobicContact CG-CD1 4.36Å; F267-I271 HydrophobicContact CG-CG2 4.38Å; E269-I271 PolarHBondContact O-N 3.26Å; I271-F273 VanDerWaalsContact C-N 3.35Å; I271-F273 PolarHBondContact O-N 3.34Å; I271-Y274 WeakPolarHBondContact O-CB 3.48Å; I271-Y274 PolarHBondContact O-N 3.4Å; I271-F275 HydrophobicContact CG2-CD2 3.8Å; I271-F275 HydrophobicContact CG2-CE2 3.73Å; I271-F275 WeakPolarHBondContact O-CD2 3.39Å; I271-F275 PolarHBondContact O-N 3.22Å; I271-L632 HydrophobicContact CB-CD1 4.48Å; I271-L632 HydrophobicContact CG1-CD1 3.78Å; I271-L632 HydrophobicContact CG1-CG 4.41Å; I271-L675 HydrophobicContact CG2-CD1 4.06Å; I271-P682 HydrophobicContact CD1-CB 3.79Å; I271-P682 HydrophobicContact CD1-CG 3.36Å
272	G	95.2	Very high	94.2	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-55	-46.9	171.8	0	0	0	0	0	112.9	G268 E269 Y274 A276 W381	G268-G272 PolarHBondContact O-N 3.15Å; G268-G272 VanDerWaalsContact O-N 3.08Å; E269-G272 CarbonylContact O-C 3.46Å; E269-G272 WeakPolarHBondContact O-CA 3.38Å; E269-G272 PolarHBondContact O-N 3.13Å; E269-G272 VanDerWaalsContact O-N 3.08Å; G272-Y274 VanDerWaalsContact C-N 3.35Å; G272-Y274 PolarHBondContact O-N 3.22Å; G272-A276 WeakPolarHBondContact O-CB 3.23Å; G272-A276 PolarHBondContact O-N 2.87Å; G272-W381 VanDerWaalsContact C-CH2 3.4Å
273	F	95.6	Very high	94.2	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-64.7	-37.8	179.2	-83.8	-69.3	0	0	0	112.4	E269 K270 I271 A276 W277 W370 N374 L377 A378 W381 V383 A687 Q688 I690	E269-F273 HydrophobicContact CB-CD2 4.42Å; E269-F273 HydrophobicContact CB-CE2 4.34Å; E269-F273 WeakPolarHBondContact O-CD2 3.4Å; E269-F273 PolarHBondContact O-N 3.17Å; K270-F273 PolarHBondContact O-N 3.21Å; I271-F273 VanDerWaalsContact C-N 3.35Å; I271-F273 PolarHBondContact O-N 3.34Å; F273-A276 PolarHBondContact O-N 3.19Å; F273-W277 WeakPolarHBondContact O-CB 3.45Å; F273-W277 PolarHBondContact O-N 3.12Å; F273-W370 HydrophobicContact CD1-CH2 4.36Å; F273-W370 HydrophobicContact CD1-CZ2 4.5Å; F273-N374 WeakPolarHBondContact CD1-OD1 3.47Å; F273-N374 VanDerWaalsContact CE1-OD1 3.23Å; F273-N374 WeakPolarHBondContact CE1-OD1 3.48Å; F273-L377 HydrophobicContact CE1-CB 3.9Å; F273-L377 HydrophobicContact CZ-CB 4.35Å; F273-A378 HydrophobicContact CZ-CB 4.12Å; F273-W381 HydrophobicContact CB-CZ3 4.48Å; F273-W381 AromaticContact CD1-CZ3 4Å; F273-W381 HydrophobicContact CD1-CZ3 4Å; F273-W381 AromaticContact CD2-CE3 3.97Å; F273-W381 HydrophobicContact CD2-CE3 3.97Å; F273-W381 AromaticContact CD2-CZ3 3.69Å; F273-W381 HydrophobicContact CD2-CZ3 3.69Å; F273-W381 HydrophobicContact CE1-CE3 4.24Å; F273-W381 HydrophobicContact CE1-CZ3 4.08Å; F273-W381 AromaticContact CE2-CE3 3.54Å; F273-W381 HydrophobicContact CE2-CE3 3.54Å; F273-W381 AromaticContact CE2-CZ3 3.74Å; F273-W381 HydrophobicContact CE2-CZ3 3.74Å; F273-W381 HydrophobicContact CG-CE3 4.45Å; F273-W381 AromaticContact CG-CZ3 3.8Å; F273-W381 HydrophobicContact CG-CZ3 3.8Å; F273-W381 AromaticContact CZ-CE3 3.71Å; F273-W381 HydrophobicContact CZ-CE3 3.71Å; F273-W381 AromaticContact CZ-CZ3 3.95Å; F273-W381 HydrophobicContact CZ-CZ3 3.95Å; F273-V383 HydrophobicContact CE2-CG2 4.01Å; F273-V383 HydrophobicContact CZ-CG2 4.18Å; F273-A687 HydrophobicContact CD2-CB 4.48Å; F273-A687 WeakPolarHBondContact CE2-O 3.22Å; F273-Q688 WeakPolarHBondContact CZ-O 3.48Å; F273-I690 HydrophobicContact CB-CG2 4.46Å
274	Y	96	Very high	94.2	Very high	1 Å²	1	16.6 Å²	16.6	0%	0.004	9%	0.094	C	C	.	.	H	α-helix	trans	-57.8	-56.2	175.9	172.6	-107.5	0	0	0	111.6	K270 I271 G272 A276 W277 L278 L632 E635 Y636 D671	K270-Y274 PolarHBondContact O-N 3.36Å; I271-Y274 WeakPolarHBondContact O-CB 3.48Å; I271-Y274 PolarHBondContact O-N 3.4Å; G272-Y274 VanDerWaalsContact C-N 3.35Å; G272-Y274 PolarHBondContact O-N 3.22Å; Y274-A276 VanDerWaalsContact C-N 3.3Å; Y274-A276 PolarHBondContact O-N 3.04Å; Y274-W277 PolarHBondContact O-N 2.87Å; Y274-L278 HydrophobicContact CE1-CD2 4.11Å; Y274-L278 WeakPolarHBondContact O-CB 3.18Å; Y274-L278 PolarHBondContact O-N 3.43Å; Y274-L632 HydrophobicContact CD1-CD2 3.78Å; Y274-L632 HydrophobicContact CD2-CD2 4.23Å; Y274-L632 HydrophobicContact CE1-CD2 4.24Å; Y274-L632 HydrophobicContact CG-CD1 4.48Å; Y274-L632 HydrophobicContact CG-CD2 3.78Å; Y274-E635 HydrophobicContact CE2-CB 3.84Å; Y274-Y636 WeakPolarHBondContact CA-OH 3.47Å; Y274-Y636 WeakPolarHBondContact CB-OH 3.29Å; Y274-Y636 AromaticContact CD2-CD1 3.93Å; Y274-Y636 HydrophobicContact CD2-CD1 3.93Å; Y274-Y636 HydrophobicContact CD2-CD2 4.14Å; Y274-Y636 AromaticContact CD2-CE1 3.67Å; Y274-Y636 HydrophobicContact CD2-CE1 3.67Å; Y274-Y636 AromaticContact CD2-CE2 3.88Å; Y274-Y636 HydrophobicContact CD2-CE2 3.88Å; Y274-Y636 HydrophobicContact CD2-CG 4.16Å; Y274-Y636 AromaticContact CD2-CZ 3.64Å; Y274-Y636 HydrophobicContact CE2-CD1 4.37Å; Y274-Y636 HydrophobicContact CG-CE2 4.44Å; Y274-Y636 PolarHBondContact N-OH 3.18Å; Y274-D671 HydrophobicContact CE1-CB 4.45Å; Y274-D671 WeakPolarHBondContact CE1-OD2 3.34Å; Y274-D671 PolarHBondContact OH-OD2 3.28Å
275	F	95.9	Very high	94.4	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-68.5	-30	179.9	-75.2	-69.4	0	0	0	113.1	W248 Q258 L260 I263 I271 G279 D671 L675	W248-F275 HydrophobicContact CH2-CD1 4.44Å; W248-F275 AromaticContact CH2-CD2 3.85Å; W248-F275 HydrophobicContact CH2-CD2 3.85Å; W248-F275 HydrophobicContact CH2-CE1 4.07Å; W248-F275 AromaticContact CH2-CE2 3.42Å; W248-F275 HydrophobicContact CH2-CE2 3.42Å; W248-F275 VanDerWaalsContact CH2-CE2 3.42Å; W248-F275 HydrophobicContact CH2-CG 4.34Å; W248-F275 AromaticContact CH2-CZ 3.52Å; W248-F275 HydrophobicContact CH2-CZ 3.52Å; W248-F275 AromaticContact CZ2-CD1 3.57Å; W248-F275 HydrophobicContact CZ2-CD1 3.57Å; W248-F275 AromaticContact CZ2-CD2 3.64Å; W248-F275 HydrophobicContact CZ2-CD2 3.64Å; W248-F275 AromaticContact CZ2-CE1 3.44Å; W248-F275 HydrophobicContact CZ2-CE1 3.44Å; W248-F275 VanDerWaalsContact CZ2-CE1 3.44Å; W248-F275 AromaticContact CZ2-CE2 3.52Å; W248-F275 HydrophobicContact CZ2-CE2 3.52Å; W248-F275 AromaticContact CZ2-CG 3.66Å; W248-F275 HydrophobicContact CZ2-CG 3.66Å; W248-F275 AromaticContact CZ2-CZ 3.41Å; W248-F275 HydrophobicContact CZ2-CZ 3.41Å; W248-F275 VanDerWaalsContact CZ2-CZ 3.41Å; Q258-F275 PolarHBondContact NE2-O 2.95Å; L260-F275 HydrophobicContact CD2-CB 4.24Å; I263-F275 HydrophobicContact CD1-CB 4.45Å; I263-F275 HydrophobicContact CG2-CD2 4.03Å; I271-F275 HydrophobicContact CG2-CD2 3.8Å; I271-F275 HydrophobicContact CG2-CE2 3.73Å; I271-F275 WeakPolarHBondContact O-CD2 3.39Å; I271-F275 PolarHBondContact O-N 3.22Å; F275-G279 PolarHBondContact O-N 3.44Å; F275-D671 HydrophobicContact CE1-CB 3.81Å; F275-D671 HydrophobicContact CZ-CB 3.75Å; F275-L675 HydrophobicContact CE2-CD1 3.51Å; F275-L675 HydrophobicContact CZ-CD1 3.77Å
276	A	95.1	Very high	94.5	Very high	1 Å²	1	15.1 Å²	15.1	1%	0.008	9%	0.086	C	C	.	.	H	α-helix	trans	-66.7	-38.3	174	0	0	0	0	0	112.8	L260 G272 F273 Y274 L280 W370 K373 L377 W381	L260-A276 HydrophobicContact CD1-CB 3.93Å; L260-A276 HydrophobicContact CD2-CB 4.01Å; G272-A276 WeakPolarHBondContact O-CB 3.23Å; G272-A276 PolarHBondContact O-N 2.87Å; F273-A276 PolarHBondContact O-N 3.19Å; Y274-A276 VanDerWaalsContact C-N 3.3Å; Y274-A276 PolarHBondContact O-N 3.04Å; A276-L280 WeakPolarHBondContact O-CB 3.44Å; A276-L280 PolarHBondContact O-N 3.43Å; A276-W370 HydrophobicContact CB-CH2 4.41Å; A276-W370 HydrophobicContact CB-CZ3 4.47Å; A276-K373 PolarHBondContact O-NZ 2.97Å; A276-L377 HydrophobicContact CB-CD1 3.54Å; A276-W381 HydrophobicContact CB-CH2 4.42Å
277	W	96.2	Very high	94.5	Very high	1 Å²	1	17.5 Å²	17.5	0%	0.004	10%	0.102	C	C	.	.	H	α-helix	trans	-71.2	-52.9	174.4	177.8	79.9	0	0	0	110.9	F273 Y274 G279 L280 Y281 F366 W370 Y636 M639 I690 L697	F273-W277 WeakPolarHBondContact O-CB 3.45Å; F273-W277 PolarHBondContact O-N 3.12Å; Y274-W277 PolarHBondContact O-N 2.87Å; W277-G279 VanDerWaalsContact C-N 3.31Å; W277-G279 PolarHBondContact O-N 3.47Å; W277-L280 CarbonylContact O-C 3.59Å; W277-L280 WeakPolarHBondContact O-CA 3.06Å; W277-L280 WeakPolarHBondContact O-CB 3.38Å; W277-L280 PolarHBondContact O-N 2.92Å; W277-Y281 HydrophobicContact CH2-CD1 4.04Å; W277-Y281 HydrophobicContact CH2-CE1 4.47Å; W277-Y281 HydrophobicContact CZ2-CD1 4.42Å; W277-Y281 HydrophobicContact CZ3-CD1 4.37Å; W277-Y281 WeakPolarHBondContact O-CB 3.46Å; W277-Y281 PolarHBondContact O-N 2.92Å; W277-F366 AromaticContact NE1-CZ 3.98Å; W277-W370 HydrophobicContact CB-CE3 4.32Å; W277-W370 HydrophobicContact CB-CH2 3.46Å; W277-W370 VanDerWaalsContact CB-CH2 3.46Å; W277-W370 HydrophobicContact CB-CZ2 3.82Å; W277-W370 HydrophobicContact CB-CZ3 3.75Å; W277-W370 AromaticContact CD1-CD2 3.62Å; W277-W370 AromaticContact CD1-CE2 3.61Å; W277-W370 AromaticContact CD1-CE3 3.97Å; W277-W370 AromaticContact CD1-CZ2 3.95Å; W277-W370 AromaticContact CD1-NE1 3.99Å; W277-W370 HydrophobicContact CG-CH2 4.28Å; W277-W370 HydrophobicContact CG-CZ2 4.26Å; W277-W370 HydrophobicContact CG-CZ3 4.43Å; W277-Y636 HydrophobicContact CE3-CD1 4.32Å; W277-Y636 HydrophobicContact CE3-CE1 4.2Å; W277-Y636 HydrophobicContact CZ3-CD1 4.42Å; W277-M639 HydrophobicContact CH2-CB 3.51Å; W277-M639 HydrophobicContact CZ3-CB 3.43Å; W277-M639 VanDerWaalsContact CZ3-CB 3.43Å; W277-M639 HydrophobicContact CZ3-CG 4Å; W277-I690 HydrophobicContact CB-CG2 4.33Å; W277-L697 HydrophobicContact CZ2-CD1 3.93Å; W277-L697 HydrophobicContact CZ2-CD2 4.42Å
278	L	94.9	Very high	94.6	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-57.9	-44.7	179.8	-176.9	61	0	0	0	111.1	Y274 L280 Y281 T282 M639 I668	Y274-L278 HydrophobicContact CE1-CD2 4.11Å; Y274-L278 WeakPolarHBondContact O-CB 3.18Å; Y274-L278 PolarHBondContact O-N 3.43Å; L278-L280 VanDerWaalsContact C-N 3.32Å; L278-L280 PolarHBondContact O-N 2.74Å; L278-Y281 HydrophobicContact CD1-CD1 4.44Å; L278-Y281 PolarHBondContact O-N 2.81Å; L278-T282 PolarHBondContact O-N 3.08Å; L278-T282 PolarHBondContact O-OG1 2.83Å; L278-M639 HydrophobicContact CD1-CG 3.99Å; L278-M639 HydrophobicContact CD1-SD 3.68Å; L278-I668 HydrophobicContact CD2-CB 4.36Å; L278-I668 HydrophobicContact CD2-CG1 3.43Å; L278-I668 VanDerWaalsContact CD2-CG1 3.43Å; L278-I668 HydrophobicContact CG-CD1 4.17Å; L278-I668 HydrophobicContact CG-CG1 3.56Å
279	G	93.3	Very high	94.8	Very high	19 Å²	19	17.5 Å²	17.5	20%	0.196	10%	0.102	C	C	.	.	H	α-helix	trans	-62.6	-35.7	174.9	0	0	0	0	0	113.9	F275 W277 A283	F275-G279 PolarHBondContact O-N 3.44Å; W277-G279 VanDerWaalsContact C-N 3.31Å; W277-G279 PolarHBondContact O-N 3.47Å; G279-A283 WeakPolarHBondContact O-CB 3.48Å; G279-A283 PolarHBondContact O-N 2.97Å
280	L	93.7	Very high	94.9	Very high	11 Å²	11	20.5 Å²	20.5	6%	0.058	12%	0.118	C	C	.	.	H	α-helix	trans	-70.1	-46.4	174	-177.9	69.8	0	0	0	111.1	A276 W277 L278 T282 A283 W284 F366 Y369 W370 K373	A276-L280 WeakPolarHBondContact O-CB 3.44Å; A276-L280 PolarHBondContact O-N 3.43Å; W277-L280 CarbonylContact O-C 3.59Å; W277-L280 WeakPolarHBondContact O-CA 3.06Å; W277-L280 WeakPolarHBondContact O-CB 3.38Å; W277-L280 PolarHBondContact O-N 2.92Å; L278-L280 VanDerWaalsContact C-N 3.32Å; L278-L280 PolarHBondContact O-N 2.74Å; L280-T282 VanDerWaalsContact C-N 3.34Å; L280-T282 PolarHBondContact O-N 3.03Å; L280-A283 WeakPolarHBondContact O-CB 3.16Å; L280-A283 PolarHBondContact O-N 3.45Å; L280-A283 VanDerWaalsContact O-N 3.13Å; L280-W284 VanDerWaalsContact CD1-CD1 3.47Å; L280-W284 PolarHBondContact O-N 3.23Å; L280-F366 HydrophobicContact CD2-CE2 4.08Å; L280-F366 HydrophobicContact CG-CE2 4.14Å; L280-Y369 HydrophobicContact CD1-CD1 3.61Å; L280-Y369 HydrophobicContact CD1-CE1 3.49Å; L280-Y369 VanDerWaalsContact CD1-CE1 3.49Å; L280-Y369 HydrophobicContact CD2-CD1 3.84Å; L280-Y369 HydrophobicContact CD2-CE1 4.43Å; L280-Y369 HydrophobicContact CG-CD1 4.32Å; L280-W370 HydrophobicContact CB-CE3 4.45Å; L280-W370 HydrophobicContact CD2-CB 3.91Å; L280-W370 HydrophobicContact CD2-CD2 4.39Å; L280-W370 HydrophobicContact CD2-CE3 3.62Å; L280-K373 HydrophobicContact CB-CD 4.25Å; L280-K373 HydrophobicContact CD1-CD 4.12Å; L280-K373 HydrophobicContact CD2-CD 4.09Å; L280-K373 HydrophobicContact CG-CD 4.37Å
281	Y	95.9	Very high	95	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-57.5	-47.3	-179.7	175.4	-140.9	0	0	0	111	W277 L278 A283 W284 L285 W362 F366 F643 I646 N664	W277-Y281 HydrophobicContact CH2-CD1 4.04Å; W277-Y281 HydrophobicContact CH2-CE1 4.47Å; W277-Y281 HydrophobicContact CZ2-CD1 4.42Å; W277-Y281 HydrophobicContact CZ3-CD1 4.37Å; W277-Y281 WeakPolarHBondContact O-CB 3.46Å; W277-Y281 PolarHBondContact O-N 2.92Å; L278-Y281 HydrophobicContact CD1-CD1 4.44Å; L278-Y281 PolarHBondContact O-N 2.81Å; Y281-A283 VanDerWaalsContact C-N 3.34Å; Y281-A283 PolarHBondContact O-N 2.8Å; Y281-W284 CarbonylContact O-C 3.41Å; Y281-W284 PolarHBondContact O-N 3.01Å; Y281-W284 VanDerWaalsContact O-N 3.17Å; Y281-L285 HydrophobicContact CD1-CD1 4.5Å; Y281-L285 HydrophobicContact CD2-CD1 4.2Å; Y281-L285 HydrophobicContact CD2-CG 4.02Å; Y281-L285 HydrophobicContact CE1-CD1 4.15Å; Y281-L285 HydrophobicContact CE2-CD1 3.8Å; Y281-L285 HydrophobicContact CE2-CD2 3.82Å; Y281-L285 HydrophobicContact CE2-CG 3.69Å; Y281-L285 WeakPolarHBondContact O-CG 3.36Å; Y281-L285 PolarHBondContact O-N 2.99Å; Y281-W362 HydrophobicContact CE2-CH2 4.15Å; Y281-F366 HydrophobicContact CD2-CE1 4.39Å; Y281-F366 HydrophobicContact CD2-CE2 4.36Å; Y281-F366 AromaticContact CD2-CZ 3.95Å; Y281-F366 HydrophobicContact CD2-CZ 3.95Å; Y281-F366 HydrophobicContact CG-CZ 4.27Å; Y281-F643 HydrophobicContact CD2-CD2 4.43Å; Y281-F643 AromaticContact CE2-CD2 3.75Å; Y281-F643 HydrophobicContact CE2-CD2 3.75Å; Y281-F643 HydrophobicContact CE2-CE2 4.5Å; Y281-F643 WeakPolarHBondContact OH-CA 3.4Å; Y281-I646 HydrophobicContact CE2-CD1 4.06Å; Y281-I646 WeakPolarHBondContact OH-CD1 3.39Å; Y281-N664 WeakPolarHBondContact CD1-ND2 3.38Å; Y281-N664 VanDerWaalsContact CE1-ND2 3.31Å; Y281-N664 WeakPolarHBondContact CE1-ND2 3.33Å
282	T	94.3	Very high	94.9	Very high	8 Å²	8	19.6 Å²	19.6	5%	0.049	12%	0.117	C	C	.	.	H	α-helix	trans	-60.4	-40.6	174.7	-52	0	0	0	0	112.5	L278 L280 L285 L661 N664 W665 I668	L278-T282 PolarHBondContact O-N 3.08Å; L278-T282 PolarHBondContact O-OG1 2.83Å; L280-T282 VanDerWaalsContact C-N 3.34Å; L280-T282 PolarHBondContact O-N 3.03Å; T282-L285 PolarHBondContact O-N 3.47Å; T282-L661 HydrophobicContact CG2-CD1 3.86Å; T282-L661 VanDerWaalsContact O-CD1 3.28Å; T282-L661 WeakPolarHBondContact O-CD1 3.23Å; T282-N664 HydrophobicContact CG2-CB 3.94Å; T282-N664 VanDerWaalsContact OG1-CB 3.26Å; T282-N664 WeakPolarHBondContact OG1-CB 3.39Å; T282-N664 PolarHBondContact OG1-ND2 2.81Å; T282-W665 HydrophobicContact CG2-CG 4.48Å; T282-I668 HydrophobicContact CG2-CD1 4.23Å; T282-I668 WeakPolarHBondContact OG1-CD1 3.35Å
283	A	92.3	Very high	94.9	Very high	58 Å²	58	22.1 Å²	22.1	48%	0.479	13%	0.13	S	C	.	.	H	α-helix	trans	-65.8	-37.6	176.4	0	0	0	0	0	112.4	G279 L280 Y281 L286 P287	G279-A283 WeakPolarHBondContact O-CB 3.48Å; G279-A283 PolarHBondContact O-N 2.97Å; L280-A283 WeakPolarHBondContact O-CB 3.16Å; L280-A283 PolarHBondContact O-N 3.45Å; L280-A283 VanDerWaalsContact O-N 3.13Å; Y281-A283 VanDerWaalsContact C-N 3.34Å; Y281-A283 PolarHBondContact O-N 2.8Å; A283-L286 WeakPolarHBondContact O-CB 3.29Å; A283-L286 PolarHBondContact O-N 3.42Å; A283-P287 WeakPolarHBondContact O-CD 3.33Å
284	W	94.3	Very high	94.8	Very high	57 Å²	57	28.7 Å²	28.7	22%	0.216	16%	0.159	C	C	.	.	H	α-helix	trans	-77.1	-24.6	176.8	-85.6	78.7	0	0	0	113.2	L280 Y281 L286 P287 W362 T365 F366 Y369	L280-W284 VanDerWaalsContact CD1-CD1 3.47Å; L280-W284 PolarHBondContact O-N 3.23Å; Y281-W284 CarbonylContact O-C 3.41Å; Y281-W284 PolarHBondContact O-N 3.01Å; Y281-W284 VanDerWaalsContact O-N 3.17Å; W284-L286 PolarHBondContact O-N 3.42Å; W284-P287 WeakPolarHBondContact O-CD 3.32Å; W284-P287 WeakPolarHBondContact O-CG 3.45Å; W284-W362 HydrophobicContact CB-CZ2 4.14Å; W284-W362 AromaticContact CE3-CD1 3.96Å; W284-W362 AromaticContact CE3-NE1 3.81Å; W284-W362 PolarHBondContact O-NE1 3.39Å; W284-T365 WeakPolarHBondContact CZ3-OG1 3.43Å; W284-F366 HydrophobicContact CB-CD2 3.71Å; W284-F366 HydrophobicContact CB-CE2 4.28Å; W284-F366 HydrophobicContact CD2-CB 4.16Å; W284-F366 HydrophobicContact CD2-CD2 4.07Å; W284-F366 HydrophobicContact CE3-CB 3.91Å; W284-F366 AromaticContact CG-CD2 3.64Å; W284-F366 HydrophobicContact CG-CD2 3.64Å; W284-F366 HydrophobicContact CG-CE2 4.41Å; W284-F366 HydrophobicContact CZ3-CB 4.41Å; W284-Y369 HydrophobicContact CZ2-CD1 4.19Å; W284-Y369 HydrophobicContact CZ2-CD2 4.08Å; W284-Y369 AromaticContact CZ2-CG 3.7Å; W284-Y369 HydrophobicContact CZ2-CG 3.7Å; W284-Y369 AromaticContact NE1-CD1 3.54Å; W284-Y369 AromaticContact NE1-CG 3.97Å
285	L	95.5	Very high	94.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.9	-25.4	170.8	-77.7	172.9	0	0	0	112.7	Y281 T282 A288 A289 W362 I646 P657 A660 L661 N664	Y281-L285 HydrophobicContact CD1-CD1 4.5Å; Y281-L285 HydrophobicContact CD2-CD1 4.2Å; Y281-L285 HydrophobicContact CD2-CG 4.02Å; Y281-L285 HydrophobicContact CE1-CD1 4.15Å; Y281-L285 HydrophobicContact CE2-CD1 3.8Å; Y281-L285 HydrophobicContact CE2-CD2 3.82Å; Y281-L285 HydrophobicContact CE2-CG 3.69Å; Y281-L285 WeakPolarHBondContact O-CG 3.36Å; Y281-L285 PolarHBondContact O-N 2.99Å; T282-L285 PolarHBondContact O-N 3.47Å; L285-A288 PolarHBondContact O-N 3.04Å; L285-A289 WeakPolarHBondContact O-CB 3.48Å; L285-A289 PolarHBondContact O-N 2.98Å; L285-W362 HydrophobicContact CD2-CH2 4.22Å; L285-W362 HydrophobicContact CD2-CZ2 4.16Å; L285-I646 HydrophobicContact CD2-CD1 3.55Å; L285-P657 HydrophobicContact CD2-CB 4.25Å; L285-A660 HydrophobicContact CD1-CB 4.05Å; L285-A660 HydrophobicContact CD2-CB 4.28Å; L285-L661 HydrophobicContact CB-CB 4.21Å; L285-L661 HydrophobicContact CB-CD1 3.93Å; L285-N664 WeakPolarHBondContact CD1-ND2 3.36Å
286	L	93.7	Very high	94.5	Very high	80 Å²	80	31.2 Å²	31.2	42%	0.419	17%	0.171	S	C	.	.	H	α-helix	trans	-57.9	-55.8	179.5	-176.1	66.6	0	0	0	113.4	A283 W284 A288 A289 L290 L661	A283-L286 WeakPolarHBondContact O-CB 3.29Å; A283-L286 PolarHBondContact O-N 3.42Å; W284-L286 PolarHBondContact O-N 3.42Å; L286-A288 VanDerWaalsContact C-N 3.28Å; L286-A288 PolarHBondContact O-N 3.38Å; L286-A289 PolarHBondContact O-N 3.49Å; L286-L290 HydrophobicContact CD1-CD1 4.41Å; L286-L290 HydrophobicContact CD1-CG 4.4Å; L286-L290 HydrophobicContact CG-CD1 4.21Å; L286-L290 VanDerWaalsContact O-CG 3.32Å; L286-L290 WeakPolarHBondContact O-CG 3.43Å; L286-L290 PolarHBondContact O-N 3.15Å; L286-L661 HydrophobicContact CD1-CD2 4.03Å
287	P	94.4	Very high	94.4	Very high	53 Å²	53	35 Å²	35	34%	0.344	19%	0.19	S	C	.	.	H	α-helix	trans	-60.9	-35.8	176.4	22.6	-34.1	0	0	0	112.7	A283 W284 L290 V291	A283-P287 WeakPolarHBondContact O-CD 3.33Å; W284-P287 WeakPolarHBondContact O-CD 3.32Å; W284-P287 WeakPolarHBondContact O-CG 3.45Å; P287-L290 PolarHBondContact O-N 2.94Å; P287-V291 WeakPolarHBondContact O-CG2 3.4Å; P287-V291 PolarHBondContact O-N 2.87Å
288	A	96	Very high	94.2	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63	-48.5	175.5	0	0	0	0	0	112	L285 L286 L290 V291 G292 Y355 M359 W362 P657	L285-A288 PolarHBondContact O-N 3.04Å; L286-A288 VanDerWaalsContact C-N 3.28Å; L286-A288 PolarHBondContact O-N 3.38Å; A288-L290 PolarHBondContact O-N 2.84Å; A288-V291 PolarHBondContact O-N 3.35Å; A288-G292 PolarHBondContact O-N 2.66Å; A288-Y355 PolarHBondContact O-OH 3.18Å; A288-M359 HydrophobicContact CB-CE 4.24Å; A288-M359 HydrophobicContact CB-SD 3.74Å; A288-W362 HydrophobicContact CB-CD2 4.44Å; A288-P657 HydrophobicContact CB-CB 3.9Å; A288-P657 HydrophobicContact CB-CG 4.3Å
289	A	96.2	Very high	94.1	Very high	3 Å²	3	41 Å²	41	3%	0.025	21%	0.214	C	C	.	.	H	α-helix	trans	-61.9	-41.6	177.1	0	0	0	0	0	112.2	L285 L286 G292 I293 L658 L661	L285-A289 WeakPolarHBondContact O-CB 3.48Å; L285-A289 PolarHBondContact O-N 2.98Å; L286-A289 PolarHBondContact O-N 3.49Å; A289-G292 PolarHBondContact O-N 2.94Å; A289-I293 WeakPolarHBondContact O-CB 3.31Å; A289-I293 VanDerWaalsContact O-CG1 3.24Å; A289-I293 WeakPolarHBondContact O-CG1 3.47Å; A289-I293 PolarHBondContact O-N 3.05Å; A289-L658 HydrophobicContact CB-CB 4.25Å; A289-L658 HydrophobicContact CB-CD1 4.37Å; A289-L661 HydrophobicContact CB-CD2 4.03Å
290	L	96	Very high	94	Very high	85 Å²	85	44.1 Å²	44.1	45%	0.445	23%	0.225	S	C	.	.	H	α-helix	trans	-62.3	-50	177.8	-71.6	174.7	0	0	0	111.7	L286 P287 A288 G292 I293 F294	L286-L290 HydrophobicContact CD1-CD1 4.41Å; L286-L290 HydrophobicContact CD1-CG 4.4Å; L286-L290 HydrophobicContact CG-CD1 4.21Å; L286-L290 VanDerWaalsContact O-CG 3.32Å; L286-L290 WeakPolarHBondContact O-CG 3.43Å; L286-L290 PolarHBondContact O-N 3.15Å; P287-L290 PolarHBondContact O-N 2.94Å; A288-L290 PolarHBondContact O-N 2.84Å; L290-G292 VanDerWaalsContact C-N 3.32Å; L290-G292 PolarHBondContact O-N 3.07Å; L290-I293 PolarHBondContact O-N 3.38Å; L290-F294 HydrophobicContact CB-CE2 4.49Å; L290-F294 WeakPolarHBondContact O-CD2 3.33Å; L290-F294 PolarHBondContact O-N 2.92Å
291	V	95.4	Very high	94	Very high	33 Å²	33	48.6 Å²	48.6	20%	0.2	25%	0.253	C	S	.	.	H	α-helix	trans	-62.8	-41	177.1	179.2	0	0	0	0	110.6	P287 A288 I293 F294 V295 F354 Y355 F358	P287-V291 WeakPolarHBondContact O-CG2 3.4Å; P287-V291 PolarHBondContact O-N 2.87Å; A288-V291 PolarHBondContact O-N 3.35Å; V291-I293 PolarHBondContact O-N 2.88Å; V291-F294 PolarHBondContact O-N 3.25Å; V291-V295 HydrophobicContact CG1-CG2 4.37Å; V291-V295 VanDerWaalsContact O-CG2 3.26Å; V291-V295 WeakPolarHBondContact O-CG2 3.29Å; V291-V295 PolarHBondContact O-N 2.91Å; V291-F354 HydrophobicContact CG1-CE1 4.23Å; V291-Y355 HydrophobicContact CB-CD2 4.43Å; V291-Y355 HydrophobicContact CB-CE2 4.13Å; V291-Y355 HydrophobicContact CG1-CD2 3.78Å; V291-Y355 HydrophobicContact CG1-CE2 3.98Å; V291-F358 HydrophobicContact CB-CD1 4.38Å; V291-F358 HydrophobicContact CB-CE1 4.06Å; V291-F358 HydrophobicContact CB-CZ 4.28Å; V291-F358 HydrophobicContact CG1-CD1 4.16Å; V291-F358 HydrophobicContact CG1-CE1 4.33Å; V291-F358 HydrophobicContact CG1-CG 4.37Å; V291-F358 HydrophobicContact CG2-CE1 4.12Å; V291-F358 HydrophobicContact CG2-CE2 4.13Å; V291-F358 HydrophobicContact CG2-CZ 3.81Å
292	G	94.1	Very high	93.8	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-60.7	-40.5	175.7	0	0	0	0	0	113.5	A288 A289 L290 V295 F296	A288-G292 PolarHBondContact O-N 2.66Å; A289-G292 PolarHBondContact O-N 2.94Å; L290-G292 VanDerWaalsContact C-N 3.32Å; L290-G292 PolarHBondContact O-N 3.07Å; G292-V295 PolarHBondContact O-N 3.49Å; G292-F296 WeakPolarHBondContact O-CB 3.43Å; G292-F296 PolarHBondContact O-N 3.16Å
293	I	94.2	Very high	93.6	Very high	53 Å²	53	50.6 Å²	50.6	27%	0.272	26%	0.264	S	S	.	.	H	α-helix	trans	-63.8	-44.9	173.6	-71.2	164.1	0	0	0	110.6	A289 L290 V291 V295 F296 I297 L655 L658	A289-I293 WeakPolarHBondContact O-CB 3.31Å; A289-I293 VanDerWaalsContact O-CG1 3.24Å; A289-I293 WeakPolarHBondContact O-CG1 3.47Å; A289-I293 PolarHBondContact O-N 3.05Å; L290-I293 PolarHBondContact O-N 3.38Å; V291-I293 PolarHBondContact O-N 2.88Å; I293-V295 VanDerWaalsContact C-N 3.33Å; I293-V295 PolarHBondContact O-N 2.88Å; I293-F296 PolarHBondContact O-N 3.42Å; I293-I297 HydrophobicContact CG2-CD1 3.59Å; I293-I297 HydrophobicContact CG2-CG1 4.18Å; I293-I297 WeakPolarHBondContact O-CB 3.38Å; I293-I297 VanDerWaalsContact O-CG1 3.29Å; I293-I297 WeakPolarHBondContact O-CG1 3.34Å; I293-I297 PolarHBondContact O-N 2.95Å; I293-L655 HydrophobicContact CG1-CD2 4.38Å; I293-L658 HydrophobicContact CD1-CD1 4.06Å; I293-L658 HydrophobicContact CD1-CD2 4.08Å; I293-L658 HydrophobicContact CG1-CD2 4.11Å
294	F	94.1	Very high	93.4	Very high	139 Å²	139	52.8 Å²	52.8	61%	0.61	27%	0.268	S	S	*	.	H	α-helix	trans	-61.2	-41.9	177.8	-72.8	-58.7	0	0	0	112.2	L290 V291 I297 Y298	L290-F294 HydrophobicContact CB-CE2 4.49Å; L290-F294 WeakPolarHBondContact O-CD2 3.33Å; L290-F294 PolarHBondContact O-N 2.92Å; V291-F294 PolarHBondContact O-N 3.25Å; F294-I297 PolarHBondContact O-N 2.98Å; F294-Y298 WeakPolarHBondContact O-CB 2.73Å; F294-Y298 PolarHBondContact O-N 3.3Å
295	V	93.3	Very high	93.1	Very high	11 Å²	11	55.8 Å²	55.8	7%	0.067	29%	0.288	C	S	.	.	H	α-helix	trans	-62.4	-44.2	175.7	171.6	0	0	0	0	110.5	V291 G292 I293 Y298 G299 H349 Y355 P654	V291-V295 HydrophobicContact CG1-CG2 4.37Å; V291-V295 VanDerWaalsContact O-CG2 3.26Å; V291-V295 WeakPolarHBondContact O-CG2 3.29Å; V291-V295 PolarHBondContact O-N 2.91Å; G292-V295 PolarHBondContact O-N 3.49Å; I293-V295 VanDerWaalsContact C-N 3.33Å; I293-V295 PolarHBondContact O-N 2.88Å; V295-Y298 WeakPolarHBondContact O-CB 3.04Å; V295-Y298 PolarHBondContact O-N 3.27Å; V295-G299 PolarHBondContact O-N 3.46Å; V295-G299 VanDerWaalsContact O-N 3.08Å; V295-H349 WeakPolarHBondContact CG1-CE1 3.41Å; V295-H349 PolarHBondContact O-CE1 2.79Å; V295-H349 PolarHBondContact O-NE2 3.24Å; V295-Y355 HydrophobicContact CG2-CD2 4.3Å; V295-Y355 HydrophobicContact CG2-CG 4.41Å; V295-P654 HydrophobicContact CG1-CB 4.29Å; V295-P654 HydrophobicContact CG1-CG 4.34Å
296	F	91.9	Very high	92.8	Very high	42 Å²	42	57.2 Å²	57.2	18%	0.184	29%	0.293	C	S	.	.	H	α-helix	trans	-65.8	-42.4	177.4	-174.4	-101.4	0	0	0	113	G292 I293 Y298 G299 L300 L346 F347 L655	G292-F296 WeakPolarHBondContact O-CB 3.43Å; G292-F296 PolarHBondContact O-N 3.16Å; I293-F296 PolarHBondContact O-N 3.42Å; F296-Y298 VanDerWaalsContact C-N 3.32Å; F296-Y298 PolarHBondContact O-N 2.88Å; F296-G299 PolarHBondContact O-N 2.81Å; F296-L300 HydrophobicContact CD1-CD1 3.91Å; F296-L300 HydrophobicContact CD1-CG 4.36Å; F296-L300 HydrophobicContact CE1-CD1 3.63Å; F296-L300 HydrophobicContact CE1-CD2 4.46Å; F296-L300 HydrophobicContact CE1-CG 4.06Å; F296-L300 HydrophobicContact CZ-CD1 4.48Å; F296-L300 PolarHBondContact O-N 3.38Å; F296-L346 HydrophobicContact CE2-CB 4.11Å; F296-L346 HydrophobicContact CE2-CD1 4.42Å; F296-L346 HydrophobicContact CZ-CD1 4.38Å; F296-F347 HydrophobicContact CD2-CE1 4.43Å; F296-F347 AromaticContact CE2-CE1 3.98Å; F296-F347 HydrophobicContact CE2-CE1 3.98Å; F296-L655 HydrophobicContact CB-CD2 3.84Å; F296-L655 HydrophobicContact CB-CG 4.2Å; F296-L655 HydrophobicContact CD1-CD1 4.06Å; F296-L655 HydrophobicContact CD1-CD2 4.22Å; F296-L655 HydrophobicContact CD1-CG 4.47Å; F296-L655 HydrophobicContact CD2-CD1 3.69Å; F296-L655 HydrophobicContact CD2-CD2 4.39Å; F296-L655 HydrophobicContact CD2-CG 3.91Å; F296-L655 HydrophobicContact CE1-CD1 4.06Å; F296-L655 HydrophobicContact CE2-CD1 3.7Å; F296-L655 HydrophobicContact CE2-CG 4.41Å; F296-L655 HydrophobicContact CG-CD1 3.87Å; F296-L655 HydrophobicContact CG-CD2 3.9Å; F296-L655 HydrophobicContact CG-CG 3.94Å; F296-L655 HydrophobicContact CZ-CD1 3.89Å
297	I	92.7	Very high	92.7	Very high	82 Å²	82	54.7 Å²	54.7	42%	0.421	28%	0.281	S	S	.	.	H	α-helix	trans	-62.3	-41.4	175	-69.7	170.4	0	0	0	110.5	I293 F294 G299 L300 V301	I293-I297 HydrophobicContact CG2-CD1 3.59Å; I293-I297 HydrophobicContact CG2-CG1 4.18Å; I293-I297 WeakPolarHBondContact O-CB 3.38Å; I293-I297 VanDerWaalsContact O-CG1 3.29Å; I293-I297 WeakPolarHBondContact O-CG1 3.34Å; I293-I297 PolarHBondContact O-N 2.95Å; F294-I297 PolarHBondContact O-N 2.98Å; I297-G299 VanDerWaalsContact C-N 3.31Å; I297-G299 PolarHBondContact O-N 3.37Å; I297-L300 WeakPolarHBondContact O-CB 3.45Å; I297-L300 PolarHBondContact O-N 3.48Å; I297-L300 VanDerWaalsContact O-N 3.15Å; I297-V301 HydrophobicContact CG2-CG2 4.43Å; I297-V301 WeakPolarHBondContact O-CG2 3.33Å; I297-V301 PolarHBondContact O-N 3.18Å
298	Y	92.9	Very high	92.4	Very high	127 Å²	127	52.6 Å²	52.6	50%	0.498	27%	0.268	S	S	.	.	H	α-helix	trans	-56.8	-46.6	174	176.2	-89.6	0	0	0	111.1	F294 V295 F296 L300 V301 T302 H349	F294-Y298 WeakPolarHBondContact O-CB 2.73Å; F294-Y298 PolarHBondContact O-N 3.3Å; V295-Y298 WeakPolarHBondContact O-CB 3.04Å; V295-Y298 PolarHBondContact O-N 3.27Å; F296-Y298 VanDerWaalsContact C-N 3.32Å; F296-Y298 PolarHBondContact O-N 2.88Å; Y298-L300 VanDerWaalsContact C-N 3.33Å; Y298-L300 PolarHBondContact O-N 3.08Å; Y298-V301 PolarHBondContact O-N 3.08Å; Y298-T302 HydrophobicContact CD2-CG2 4.46Å; Y298-T302 HydrophobicContact CE1-CG2 4.08Å; Y298-T302 HydrophobicContact CE2-CG2 4.03Å; Y298-T302 PolarHBondContact O-N 3.21Å; Y298-T302 PolarHBondContact O-OG1 3.48Å; Y298-T302 VanDerWaalsContact O-OG1 3.13Å; Y298-H349 AromaticContact CD1-CE1 3.84Å; Y298-H349 AromaticContact CD1-ND1 3.6Å; Y298-H349 AromaticContact CE1-ND1 3.94Å
299	G	91.5	Very high	92.1	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.2	-39.5	174.9	0	0	0	0	0	113.6	V295 F296 I297 I303	V295-G299 PolarHBondContact O-N 3.46Å; V295-G299 VanDerWaalsContact O-N 3.08Å; F296-G299 PolarHBondContact O-N 2.81Å; I297-G299 VanDerWaalsContact C-N 3.31Å; I297-G299 PolarHBondContact O-N 3.37Å; G299-I303 WeakPolarHBondContact O-CB 3.41Å; G299-I303 PolarHBondContact O-N 3.42Å
300	L	91.7	Very high	91.9	Very high	83 Å²	83	58 Å²	58	44%	0.435	29%	0.289	S	S	.	.	H	α-helix	trans	-64.4	-38.5	175.7	-74.2	171.2	0	0	0	112.7	F296 I297 Y298 I303 L346	F296-L300 HydrophobicContact CD1-CD1 3.91Å; F296-L300 HydrophobicContact CD1-CG 4.36Å; F296-L300 HydrophobicContact CE1-CD1 3.63Å; F296-L300 HydrophobicContact CE1-CD2 4.46Å; F296-L300 HydrophobicContact CE1-CG 4.06Å; F296-L300 HydrophobicContact CZ-CD1 4.48Å; F296-L300 PolarHBondContact O-N 3.38Å; I297-L300 WeakPolarHBondContact O-CB 3.45Å; I297-L300 PolarHBondContact O-N 3.48Å; I297-L300 VanDerWaalsContact O-N 3.15Å; Y298-L300 VanDerWaalsContact C-N 3.33Å; Y298-L300 PolarHBondContact O-N 3.08Å; L300-I303 VanDerWaalsContact O-CG2 3.24Å; L300-I303 WeakPolarHBondContact O-CG2 3.2Å; L300-L346 HydrophobicContact CB-CD2 4.42Å; L300-L346 HydrophobicContact CD2-CD1 3.93Å; L300-L346 HydrophobicContact CD2-CD2 3.67Å; L300-L346 HydrophobicContact CD2-CG 4.49Å; L300-L346 HydrophobicContact CG-CD2 3.98Å
301	V	92.9	Very high	91.6	Very high	106 Å²	106	54.5 Å²	54.5	64%	0.642	27%	0.27	S	S	*	.	H	α-helix	trans	-71.7	-40.2	-179.6	173.7	0	0	0	0	111	I297 Y298	I297-V301 HydrophobicContact CG2-CG2 4.43Å; I297-V301 WeakPolarHBondContact O-CG2 3.33Å; I297-V301 PolarHBondContact O-N 3.18Å; Y298-V301 PolarHBondContact O-N 3.08Å
302	T	92	Very high	91.3	Very high	23 Å²	23	53.1 Å²	53.1	14%	0.141	26%	0.262	C	S	.	.	H	α-helix	trans	-88.9	-2.8	-174.5	60.6	0	0	0	0	114.7	Y298 N304 D305 Y306 Y345	Y298-T302 HydrophobicContact CD2-CG2 4.46Å; Y298-T302 HydrophobicContact CE1-CG2 4.08Å; Y298-T302 HydrophobicContact CE2-CG2 4.03Å; Y298-T302 PolarHBondContact O-N 3.21Å; Y298-T302 PolarHBondContact O-OG1 3.48Å; Y298-T302 VanDerWaalsContact O-OG1 3.13Å; T302-N304 VanDerWaalsContact C-N 3.31Å; T302-N304 PolarHBondContact O-N 2.88Å; T302-D305 PolarHBondContact O-N 2.79Å; T302-Y306 PolarHBondContact O-N 3.3Å; T302-Y345 WeakPolarHBondContact CB-OH 3.19Å; T302-Y345 WeakPolarHBondContact OG1-CE1 3.49Å; T302-Y345 PolarHBondContact OG1-OH 2.96Å
303	I	90.7	Very high	91.1	Very high	26 Å²	26	54.1 Å²	54.1	13%	0.133	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-36.5	-173.2	-162.9	178.9	0	0	0	114.2	G299 L300 K342 Y345 L346	G299-I303 WeakPolarHBondContact O-CB 3.41Å; G299-I303 PolarHBondContact O-N 3.42Å; L300-I303 VanDerWaalsContact O-CG2 3.24Å; L300-I303 WeakPolarHBondContact O-CG2 3.2Å; I303-K342 HydrophobicContact CD1-CB 3.75Å; I303-K342 HydrophobicContact CD1-CG 4.1Å; I303-K342 WeakPolarHBondContact CD1-O 3.31Å; I303-K342 HydrophobicContact CG1-CB 4.31Å; I303-K342 HydrophobicContact CG1-CG 4.27Å; I303-Y345 HydrophobicContact CB-CD1 4.13Å; I303-Y345 HydrophobicContact CB-CE1 4.4Å; I303-Y345 HydrophobicContact CG1-CD1 4Å; I303-L346 HydrophobicContact CD1-CD2 3.97Å; I303-L346 HydrophobicContact CD1-CG 4.15Å
304	N	87.3	Confident	90.9	Very high	105 Å²	105	57.3 Å²	57.3	56%	0.561	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-22	-176.7	-68.4	-39	0	0	0	112.5	T302	T302-N304 VanDerWaalsContact C-N 3.31Å; T302-N304 PolarHBondContact O-N 2.88Å
305	D	88.3	Confident	90.3	Very high	120 Å²	120	55.6 Å²	55.6	64%	0.642	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-13.7	-178.6	-63.9	-32.5	0	0	0	112.4	T302 V307	T302-D305 PolarHBondContact O-N 2.79Å; D305-V307 PolarHBondContact O-N 3.48Å; D305-V307 VanDerWaalsContact O-N 3.15Å
306	Y	89.9	Confident	90	Very high	29 Å²	29	59.8 Å²	59.8	11%	0.114	29%	0.294	C	S	.	.			trans	-73	109	-176.4	-176.7	-114.8	0	0	0	112.3	T302 P308 V309 R310 Y345 E721 L732	T302-Y306 PolarHBondContact O-N 3.3Å; Y306-P308 HydrophobicContact CD1-CB 4.41Å; Y306-P308 HydrophobicContact CE1-CB 3.7Å; Y306-P308 HydrophobicContact CE1-CG 3.84Å; Y306-P308 HydrophobicContact CE2-CG 3.93Å; Y306-V309 HydrophobicContact CD1-CB 3.8Å; Y306-V309 HydrophobicContact CD1-CG2 3.43Å; Y306-V309 VanDerWaalsContact CD1-CG2 3.43Å; Y306-V309 HydrophobicContact CE1-CB 4.43Å; Y306-V309 HydrophobicContact CE1-CG2 3.74Å; Y306-V309 PolarHBondContact O-N 3.45Å; Y306-R310 PolarHBondContact O-N 3.39Å; Y306-Y345 AromaticContact CD1-CD2 3.32Å; Y306-Y345 HydrophobicContact CD1-CD2 3.32Å; Y306-Y345 AromaticContact CD1-CE2 3.61Å; Y306-Y345 HydrophobicContact CD1-CE2 3.61Å; Y306-Y345 AromaticContact CD1-CG 3.96Å; Y306-Y345 HydrophobicContact CD1-CG 3.96Å; Y306-Y345 AromaticContact CD2-CD2 3.94Å; Y306-Y345 HydrophobicContact CD2-CD2 3.94Å; Y306-Y345 AromaticContact CD2-CE2 3.32Å; Y306-Y345 HydrophobicContact CD2-CE2 3.32Å; Y306-Y345 AromaticContact CE1-CD2 3.56Å; Y306-Y345 HydrophobicContact CE1-CD2 3.56Å; Y306-Y345 AromaticContact CE1-CE2 3.99Å; Y306-Y345 HydrophobicContact CE1-CE2 3.99Å; Y306-Y345 HydrophobicContact CE1-CG 4.43Å; Y306-Y345 HydrophobicContact CE2-CD2 4.13Å; Y306-Y345 AromaticContact CE2-CE2 3.72Å; Y306-Y345 HydrophobicContact CE2-CE2 3.72Å; Y306-Y345 AromaticContact CG-CD2 3.54Å; Y306-Y345 HydrophobicContact CG-CD2 3.54Å; Y306-Y345 AromaticContact CG-CE2 3.26Å; Y306-Y345 HydrophobicContact CG-CE2 3.26Å; Y306-Y345 HydrophobicContact CG-CG 4.28Å; Y306-Y345 AromaticContact CG-CZ 3.82Å; Y306-Y345 AromaticContact CZ-CD2 3.94Å; Y306-E721 PolarHBondContact OH-OE1 3.24Å; Y306-E721 PolarHBondContact OH-OE2 3.3Å; Y306-L732 HydrophobicContact CE2-CD1 4.06Å
307	V	91.2	Very high	89.8	Confident	27 Å²	27	59.1 Å²	59.1	16%	0.164	29%	0.293	C	S	.	.	H	α-helix	trans	-55.6	-47.5	-171	179.6	0	0	0	0	113.5	D305 V309 R310 E311 L732 V733	D305-V307 PolarHBondContact O-N 3.48Å; D305-V307 VanDerWaalsContact O-N 3.15Å; V307-V309 PolarHBondContact O-N 2.97Å; V307-R310 PolarHBondContact O-N 3.36Å; V307-E311 HydrophobicContact CG1-CG 4.14Å; V307-E311 WeakPolarHBondContact O-CG 2.94Å; V307-E311 PolarHBondContact O-N 3.47Å; V307-L732 HydrophobicContact CB-CB 4.26Å; V307-V733 HydrophobicContact CG1-CB 4.49Å; V307-V733 HydrophobicContact CG1-CG2 3.98Å
308	P	88.6	Confident	89.8	Confident	9 Å²	9	57.7 Å²	57.7	6%	0.058	29%	0.288	C	S	.	.	H	α-helix	trans	-62	-38.2	-178.3	-27.8	38.7	0	0	0	114.4	Y306 A312 L732 F735 T736	Y306-P308 HydrophobicContact CD1-CB 4.41Å; Y306-P308 HydrophobicContact CE1-CB 3.7Å; Y306-P308 HydrophobicContact CE1-CG 3.84Å; Y306-P308 HydrophobicContact CE2-CG 3.93Å; P308-A312 WeakPolarHBondContact O-CB 3.28Å; P308-A312 PolarHBondContact O-N 3Å; P308-A312 VanDerWaalsContact O-N 3.11Å; P308-L732 HydrophobicContact CG-CB 4.17Å; P308-L732 HydrophobicContact CG-CD1 4.28Å; P308-F735 HydrophobicContact CB-CD1 3.99Å; P308-F735 HydrophobicContact CG-CB 4.46Å; P308-F735 HydrophobicContact CG-CD1 3.87Å; P308-T736 HydrophobicContact CB-CG2 4.08Å; P308-T736 WeakPolarHBondContact O-CG2 3.48Å
309	V	89.4	Confident	89.6	Confident	9 Å²	9	52.3 Å²	52.3	6%	0.055	27%	0.268	C	S	.	.	H	α-helix	trans	-67.8	-43.5	175.8	167.7	0	0	0	0	110.2	Y306 V307 E311 A312 C313 L341 K342	Y306-V309 HydrophobicContact CD1-CB 3.8Å; Y306-V309 HydrophobicContact CD1-CG2 3.43Å; Y306-V309 VanDerWaalsContact CD1-CG2 3.43Å; Y306-V309 HydrophobicContact CE1-CB 4.43Å; Y306-V309 HydrophobicContact CE1-CG2 3.74Å; Y306-V309 PolarHBondContact O-N 3.45Å; V307-V309 PolarHBondContact O-N 2.97Å; V309-E311 PolarHBondContact O-N 3.07Å; V309-A312 PolarHBondContact O-N 2.93Å; V309-C313 WeakPolarHBondContact O-CB 3.48Å; V309-C313 PolarHBondContact O-N 3.16Å; V309-C313 PolarHBondContact O-SG 2.89Å; V309-L341 HydrophobicContact CG2-CB 4.2Å; V309-K342 HydrophobicContact CG1-CG 3.54Å
310	R	91.7	Very high	89.5	Confident	108 Å²	108	52.8 Å²	52.8	41%	0.408	27%	0.271	S	S	.	.	H	α-helix	trans	-58.4	-48.3	177.1	-174.3	175.5	67.4	-150.1	0.4	111.8	Y306 V307 A312 C313 E314	Y306-R310 PolarHBondContact O-N 3.39Å; V307-R310 PolarHBondContact O-N 3.36Å; R310-A312 VanDerWaalsContact C-N 3.33Å; R310-A312 PolarHBondContact O-N 3.41Å; R310-C313 PolarHBondContact O-N 2.81Å; R310-E314 HydrophobicContact CG-CG 4.41Å; R310-E314 WeakPolarHBondContact CG-OE1 3.22Å; R310-E314 WeakPolarHBondContact O-CG 3.42Å; R310-E314 PolarHBondContact O-N 3.36Å
311	E	90.5	Very high	89.2	Confident	11 Å²	11	49.3 Å²	49.3	5%	0.051	25%	0.253	C	S	.	.	H	α-helix	trans	-61.4	-39.6	178.3	-72.8	-175.8	167.4	0	0	113.2	V307 V309 C313 E314 R315 V733 G734 T736	V307-E311 HydrophobicContact CG1-CG 4.14Å; V307-E311 WeakPolarHBondContact O-CG 2.94Å; V307-E311 PolarHBondContact O-N 3.47Å; V309-E311 PolarHBondContact O-N 3.07Å; E311-C313 VanDerWaalsContact C-N 3.34Å; E311-E314 PolarHBondContact O-N 2.7Å; E311-R315 WeakPolarHBondContact O-CG 3.33Å; E311-R315 PolarHBondContact O-N 3.29Å; E311-V733 WeakPolarHBondContact OE1-CA 3.43Å; E311-G734 PolarHBondContact OE1-N 3.47Å; E311-G734 PolarHBondContact OE2-N 3.25Å; E311-T736 HydrophobicContact CB-CG2 3.75Å; E311-T736 WeakPolarHBondContact CB-OG1 3.47Å; E311-T736 PolarHBondContact OE2-N 2.97Å; E311-T736 PolarHBondContact OE2-OG1 2.76Å
312	A	88.1	Confident	88.4	Confident	4 Å²	4	46.2 Å²	46.2	3%	0.033	24%	0.235	C	C	.	.	H	α-helix	trans	-70	-31.1	178.1	0	0	0	0	0	112.7	P308 V309 R310 L334 L341 T736	P308-A312 WeakPolarHBondContact O-CB 3.28Å; P308-A312 PolarHBondContact O-N 3Å; P308-A312 VanDerWaalsContact O-N 3.11Å; V309-A312 PolarHBondContact O-N 2.93Å; R310-A312 VanDerWaalsContact C-N 3.33Å; R310-A312 PolarHBondContact O-N 3.41Å; A312-L334 HydrophobicContact CB-CD2 3.82Å; A312-L334 HydrophobicContact CB-CG 4.06Å; A312-L341 HydrophobicContact CB-CD1 3.37Å; A312-T736 HydrophobicContact CB-CG2 4.22Å
313	C	90.4	Very high	87.7	Confident	22 Å²	22	46.3 Å²	46.3	15%	0.149	24%	0.236	C	C	.	.	H	α-helix	trans	-78.2	-26.3	175.9	-66.2	0	0	0	0	113.3	V309 R310 E311 C338	V309-C313 WeakPolarHBondContact O-CB 3.48Å; V309-C313 PolarHBondContact O-N 3.16Å; V309-C313 PolarHBondContact O-SG 2.89Å; R310-C313 PolarHBondContact O-N 2.81Å; E311-C313 VanDerWaalsContact C-N 3.34Å; C313-C338 HydrophobicContact CB-CB 3.87Å; C313-C338 WeakPolarHBondContact CB-SG 3.39Å; C313-C338 VanDerWaalsContact SG-CA 3.51Å; C313-C338 WeakPolarHBondContact SG-CB 3.32Å; C313-C338 CovalentContact SG-SG 2.03Å; C313-C338 PolarHBondContact SG-SG 2.78Å
314	E	89.7	Confident	87.2	Confident	121 Å²	121	48 Å²	48	57%	0.565	25%	0.245	S	C	*	.	H	α-helix	trans	-87.9	-30.4	-176.8	-74.8	172.5	-179.3	0	0	113.6	R310 E311 R335	R310-E314 HydrophobicContact CG-CG 4.41Å; R310-E314 WeakPolarHBondContact CG-OE1 3.22Å; R310-E314 WeakPolarHBondContact O-CG 3.42Å; R310-E314 PolarHBondContact O-N 3.36Å; E311-E314 PolarHBondContact O-N 2.7Å; E314-R335 PolarHBondContact O-NH2 2.92Å
315	R	82.4	Confident	86.7	Confident	103 Å²	103	47.4 Å²	47.4	39%	0.389	24%	0.241	S	C	.	.			trans	-96.6	137.3	-172.9	-65.5	-176.7	-178.4	-172.7	3.4	113.5	E311 T317	E311-R315 WeakPolarHBondContact O-CG 3.33Å; E311-R315 PolarHBondContact O-N 3.29Å; R315-T317 VanDerWaalsContact C-N 3.35Å; R315-T317 HydrophobicContact CB-CG2 4.28Å; R315-T317 PolarHBondContact O-N 3Å
316	D	86	Confident	86	Confident	99 Å²	99	46.4 Å²	46.4	53%	0.529	24%	0.244	S	C	.	.			trans	-90.7	63	173.9	-64.2	-39.3	0	0	0	111.9	R335	D316-R335 VanDerWaalsContact CG-NH2 3.28Å; D316-R335 IonicContact OD1-CZ 2.81Å; D316-R335 VanDerWaalsContact OD1-CZ 3.28Å; D316-R335 IonicContact OD1-NE 3.67Å; D316-R335 PolarHBondContact OD1-NE 3.41Å; D316-R335 IonicContact OD1-NH2 3.03Å; D316-R335 PolarHBondContact OD1-NH2 3.07Å; D316-R335 IonicContact OD2-CZ 3.41Å; D316-R335 IonicContact OD2-NE 2.7Å; D316-R335 IonicContact OD2-NH2 2.8Å; D316-R335 PolarHBondContact OD2-NH2 2.86Å
317	T	88.8	Confident	85.2	Confident	27 Å²	27	47.6 Å²	47.6	17%	0.166	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-82.9	123.7	174.3	55.6	0	0	0	0	111	R315 L334	R315-T317 VanDerWaalsContact C-N 3.35Å; R315-T317 HydrophobicContact CB-CG2 4.28Å; R315-T317 PolarHBondContact O-N 3Å; T317-L334 PolarHBondContact O-N 2.76Å; T317-L334 WeakPolarHBondContact OG1-CB 3.35Å; T317-L334 WeakPolarHBondContact OG1-CD2 3.26Å
318	V	91.7	Very high	84.4	Confident	53 Å²	53	47.4 Å²	47.4	32%	0.321	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	123.7	177.6	-177.5	0	0	0	0	110.8	Y331 R753	V318-Y331 HydrophobicContact CG1-CD1 4.28Å; V318-Y331 HydrophobicContact CG1-CG 4.49Å; V318-R753 PolarHBondContact O-N 3.2Å
319	M	89.6	Confident	83.9	Confident	13 Å²	13	47.3 Å²	47.3	6%	0.064	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	150.4	-177.9	-59.8	-72	-92.3	0	0	111.5	Y331 W332 L334 L740 R753	M319-Y331 WeakPolarHBondContact O-CD1 3.48Å; M319-W332 HydrophobicContact CB-CD2 3.66Å; M319-W332 HydrophobicContact CB-CE3 4.01Å; M319-W332 HydrophobicContact CB-CG 4.26Å; M319-W332 HydrophobicContact CB-CH2 3.88Å; M319-W332 HydrophobicContact CB-CZ2 3.49Å; M319-W332 VanDerWaalsContact CB-CZ2 3.49Å; M319-W332 HydrophobicContact CB-CZ3 4.11Å; M319-W332 WeakPolarHBondContact CB-O 3.47Å; M319-W332 HydrophobicContact CE-CH2 3.67Å; M319-W332 HydrophobicContact CE-CZ2 4.08Å; M319-W332 HydrophobicContact CE-CZ3 4.4Å; M319-W332 HydrophobicContact CG-CD2 4.23Å; M319-W332 HydrophobicContact CG-CE3 4.05Å; M319-W332 HydrophobicContact CG-CH2 3.76Å; M319-W332 HydrophobicContact CG-CZ2 3.92Å; M319-W332 HydrophobicContact CG-CZ3 3.81Å; M319-W332 PolarHBondContact N-O 2.8Å; M319-L334 HydrophobicContact CE-CD1 4.02Å; M319-L334 HydrophobicContact CG-CB 4.25Å; M319-L740 HydrophobicContact CE-CD2 3.66Å; M319-L740 HydrophobicContact SD-CD1 4.38Å; M319-L740 HydrophobicContact SD-CD2 3.95Å; M319-R753 CarbonylContact C-O 3.41Å; M319-R753 VanDerWaalsContact CA-O 3.31Å; M319-R753 WeakPolarHBondContact CA-O 3.49Å; M319-R753 HydrophobicContact SD-CB 4.21Å
320	C	89	Confident	83.6	Confident	10 Å²	10	55.7 Å²	55.7	7%	0.068	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-70.4	148.1	179.4	-56.9	0	0	0	0	111.8	W332 P544 C752 R753	C320-W332 PolarHBondContact O-NE1 3.31Å; C320-P544 HydrophobicContact CB-CG 4.2Å; C320-C752 WeakPolarHBondContact CA-SG 3.45Å; C320-C752 HydrophobicContact CB-CB 3.97Å; C320-C752 WeakPolarHBondContact CB-SG 3.34Å; C320-C752 WeakPolarHBondContact SG-CB 3.43Å; C320-C752 CovalentContact SG-SG 2.04Å; C320-C752 PolarHBondContact SG-SG 2.9Å; C320-R753 PolarHBondContact N-O 3.38Å; C320-R753 PolarHBondContact SG-O 3.47Å; C320-R753 VanDerWaalsContact SG-O 3.39Å
321	P	85.5	Confident	83.4	Confident	10 Å²	10	52.6 Å²	52.6	7%	0.065	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-66.6	138.5	179.7	28.1	-35.4	0	0	0	112	I325 C329 Y331 R554	P321-I325 HydrophobicContact CG-CG1 4.11Å; P321-C329 HydrophobicContact CB-CB 3.9Å; P321-Y331 HydrophobicContact CG-CE1 4.45Å; P321-R554 PolarHBondContact O-NH2 3.19Å
322	T	76	Confident	83.2	Confident	42 Å²	42	53.6 Å²	53.6	26%	0.258	28%	0.276	S	S	.	.	S	Bend	trans	-75.7	-26.3	-178.8	49.9	0	0	0	0	113.3	R554 N560	T322-R554 PolarHBondContact O-NH2 3.45Å; T322-R554 VanDerWaalsContact O-NH2 3.14Å; T322-N560 WeakPolarHBondContact CG2-OD1 3.19Å
323	C	77.1	Confident	83.3	Confident	25 Å²	25	56.1 Å²	56.1	17%	0.169	29%	0.289	C	S	.	.	S	Bend	trans	-120.1	169.8	171.2	84.3	0	0	0	0	111.1	C329	C323-C329 HydrophobicContact CB-CB 4.09Å; C323-C329 WeakPolarHBondContact CB-SG 3.37Å; C323-C329 PolarHBondContact N-SG 3.41Å; C323-C329 VanDerWaalsContact N-SG 3.44Å; C323-C329 WeakPolarHBondContact O-CB 3.49Å; C323-C329 WeakPolarHBondContact SG-CB 2.98Å; C323-C329 CovalentContact SG-SG 2.01Å; C323-C329 PolarHBondContact SG-SG 3.02Å
324	D	79.1	Confident	83.2	Confident	60 Å²	60	55.8 Å²	55.8	32%	0.321	29%	0.285	S	S	.	.			trans	-67.3	143.4	-179.6	-58.6	-25.6	0	0	0	110.8	S326 H327 R554	D324-S326 PolarHBondContact O-N 2.99Å; D324-S326 VanDerWaalsContact O-N 3.16Å; D324-H327 PolarHBondContact O-N 3.19Å; D324-R554 IonicContact OD1-NH1 3.59Å; D324-R554 PolarHBondContact OD1-NH1 2.97Å
325	I	77.2	Confident	83.1	Confident	94 Å²	94	55.7 Å²	55.7	48%	0.482	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-61.6	-28.3	-175.7	-59.2	167.7	0	0	0	110.7	P321 H327 G328 Y331	P321-I325 HydrophobicContact CG-CG1 4.11Å; I325-H327 PolarHBondContact O-N 3.37Å; I325-G328 PolarHBondContact O-N 2.92Å; I325-Y331 HydrophobicContact CD1-CE2 4.25Å
326	S	74.2	Confident	83.3	Confident	99 Å²	99	56.7 Å²	56.7	69%	0.692	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-58.4	-31.9	173.8	53.6	0	0	0	0	113.5	D324 G328	D324-S326 PolarHBondContact O-N 2.99Å; D324-S326 VanDerWaalsContact O-N 3.16Å; S326-G328 PolarHBondContact O-N 3.43Å
327	H	73.1	Confident	83.2	Confident	53 Å²	53	52.4 Å²	52.4	25%	0.245	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-85.9	3.4	177.5	-59.3	120.3	0	0	0	112.9	D324 I325	D324-H327 PolarHBondContact O-N 3.19Å; I325-H327 PolarHBondContact O-N 3.37Å
328	G	73.5	Confident	83.2	Confident	23 Å²	23	52.3 Å²	52.3	24%	0.237	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.9	17.4	178.9	0	0	0	0	0	114.5	I325 S326 R465	I325-G328 PolarHBondContact O-N 2.92Å; S326-G328 PolarHBondContact O-N 3.43Å; G328-R465 PolarHBondContact O-NH2 3.43Å
329	C	78.5	Confident	83	Confident	8 Å²	8	55 Å²	55	5%	0.054	28%	0.283	C	S	.	.			trans	-71.6	141.4	167.9	-82.1	0	0	0	0	111.5	P321 C323	P321-C329 HydrophobicContact CB-CB 3.9Å; C323-C329 HydrophobicContact CB-CB 4.09Å; C323-C329 WeakPolarHBondContact CB-SG 3.37Å; C323-C329 PolarHBondContact N-SG 3.41Å; C323-C329 VanDerWaalsContact N-SG 3.44Å; C323-C329 WeakPolarHBondContact O-CB 3.49Å; C323-C329 WeakPolarHBondContact SG-CB 2.98Å; C323-C329 CovalentContact SG-SG 2.01Å; C323-C329 PolarHBondContact SG-SG 3.02Å
330	R	83.6	Confident	82.7	Confident	184 Å²	184	58.8 Å²	58.8	69%	0.694	30%	0.297	S	S	*	.			trans	-113.3	160.4	173.5	-75.4	177	179.3	177.8	0.3	109.7
331	Y	87.5	Confident	82.6	Confident	43 Å²	43	60.1 Å²	60.1	17%	0.169	30%	0.303	C	S	.	.			trans	-65.1	144.3	164.7	-60.3	-99.4	0	0	0	109.1	V318 M319 P321 I325 S749 Q750 C752	V318-Y331 HydrophobicContact CG1-CD1 4.28Å; V318-Y331 HydrophobicContact CG1-CG 4.49Å; M319-Y331 WeakPolarHBondContact O-CD1 3.48Å; P321-Y331 HydrophobicContact CG-CE1 4.45Å; I325-Y331 HydrophobicContact CD1-CE2 4.25Å; Y331-S749 WeakPolarHBondContact CE2-OG 3.36Å; Y331-S749 PolarHBondContact OH-N 3.38Å; Y331-S749 VanDerWaalsContact OH-N 3.14Å; Y331-S749 PolarHBondContact OH-OG 2.81Å; Y331-Q750 HydrophobicContact CD1-CG 3.85Å; Y331-Q750 HydrophobicContact CD2-CG 3.91Å; Y331-Q750 HydrophobicContact CE1-CG 3.53Å; Y331-Q750 HydrophobicContact CE2-CG 3.59Å; Y331-Q750 HydrophobicContact CG-CG 4.05Å; Y331-Q750 PolarHBondContact OH-N 3.17Å; Y331-C752 HydrophobicContact CD1-CB 3.77Å; Y331-C752 HydrophobicContact CE1-CB 3.71Å
332	W	87.1	Confident	82.7	Confident	33 Å²	33	63.1 Å²	63.1	13%	0.125	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	152.3	-173	55.4	-81.4	0	0	0	109.4	M319 C320 L334 L337 N560	M319-W332 HydrophobicContact CB-CD2 3.66Å; M319-W332 HydrophobicContact CB-CE3 4.01Å; M319-W332 HydrophobicContact CB-CG 4.26Å; M319-W332 HydrophobicContact CB-CH2 3.88Å; M319-W332 HydrophobicContact CB-CZ2 3.49Å; M319-W332 VanDerWaalsContact CB-CZ2 3.49Å; M319-W332 HydrophobicContact CB-CZ3 4.11Å; M319-W332 WeakPolarHBondContact CB-O 3.47Å; M319-W332 HydrophobicContact CE-CH2 3.67Å; M319-W332 HydrophobicContact CE-CZ2 4.08Å; M319-W332 HydrophobicContact CE-CZ3 4.4Å; M319-W332 HydrophobicContact CG-CD2 4.23Å; M319-W332 HydrophobicContact CG-CE3 4.05Å; M319-W332 HydrophobicContact CG-CH2 3.76Å; M319-W332 HydrophobicContact CG-CZ2 3.92Å; M319-W332 HydrophobicContact CG-CZ3 3.81Å; M319-W332 PolarHBondContact N-O 2.8Å; C320-W332 PolarHBondContact O-NE1 3.31Å; W332-L334 HydrophobicContact CZ3-CD1 4.46Å; W332-L337 HydrophobicContact CH2-CD2 4.45Å; W332-L337 HydrophobicContact CZ3-CB 4.32Å; W332-L337 HydrophobicContact CZ3-CD2 4.37Å; W332-N560 HydrophobicContact CH2-CB 3.9Å; W332-N560 HydrophobicContact CZ2-CB 4.2Å; W332-N560 VanDerWaalsContact CZ2-OD1 3.23Å; W332-N560 WeakPolarHBondContact CZ2-OD1 3.42Å; W332-N560 HydrophobicContact CZ3-CB 4.27Å
333	N	89.6	Confident	83.2	Confident	57 Å²	57	64.5 Å²	64.5	31%	0.305	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	141.2	178.7	-68.7	-52.5	0	0	0	110.7	R335 E336	N333-R335 PolarHBondContact O-N 2.7Å; N333-R335 VanDerWaalsContact O-N 3.16Å; N333-E336 HydrophobicContact CB-CG 4.42Å; N333-E336 PolarHBondContact N-OE1 2.91Å; N333-E336 WeakPolarHBondContact O-CB 3.49Å; N333-E336 PolarHBondContact O-N 3.09Å
334	L	87.6	Confident	83.7	Confident	14 Å²	14	64.1 Å²	64.1	7%	0.073	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-57	-33.1	178.6	-177.1	62.8	0	0	0	113.1	A312 T317 M319 W332 E336 L337 L341 L740	A312-L334 HydrophobicContact CB-CD2 3.82Å; A312-L334 HydrophobicContact CB-CG 4.06Å; T317-L334 PolarHBondContact O-N 2.76Å; T317-L334 WeakPolarHBondContact OG1-CB 3.35Å; T317-L334 WeakPolarHBondContact OG1-CD2 3.26Å; M319-L334 HydrophobicContact CE-CD1 4.02Å; M319-L334 HydrophobicContact CG-CB 4.25Å; W332-L334 HydrophobicContact CZ3-CD1 4.46Å; L334-E336 PolarHBondContact O-N 3.25Å; L334-L337 HydrophobicContact CD1-CD2 4.35Å; L334-L337 WeakPolarHBondContact O-CB 3.34Å; L334-L337 PolarHBondContact O-N 3.03Å; L334-L341 HydrophobicContact CD1-CD1 4.39Å; L334-L740 HydrophobicContact CD2-CD1 4.2Å
335	R	88.7	Confident	84.1	Confident	119 Å²	119	62 Å²	62	45%	0.449	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-53.6	-35.3	175.5	-175.7	-171.4	-60.6	-127.7	6.3	113.1	E314 D316 N333 L337 C338	E314-R335 PolarHBondContact O-NH2 2.92Å; D316-R335 VanDerWaalsContact CG-NH2 3.28Å; D316-R335 IonicContact OD1-CZ 2.81Å; D316-R335 VanDerWaalsContact OD1-CZ 3.28Å; D316-R335 IonicContact OD1-NE 3.67Å; D316-R335 PolarHBondContact OD1-NE 3.41Å; D316-R335 IonicContact OD1-NH2 3.03Å; D316-R335 PolarHBondContact OD1-NH2 3.07Å; D316-R335 IonicContact OD2-CZ 3.41Å; D316-R335 IonicContact OD2-NE 2.7Å; D316-R335 IonicContact OD2-NH2 2.8Å; D316-R335 PolarHBondContact OD2-NH2 2.86Å; N333-R335 PolarHBondContact O-N 2.7Å; N333-R335 VanDerWaalsContact O-N 3.16Å; R335-L337 PolarHBondContact O-N 2.92Å; R335-L337 VanDerWaalsContact O-N 3.11Å; R335-C338 WeakPolarHBondContact O-CB 3.45Å; R335-C338 PolarHBondContact O-N 3.29Å
336	E	85.6	Confident	84.6	Confident	124 Å²	124	58.3 Å²	58.3	58%	0.579	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-61.1	-22.4	179.3	-64.6	171.1	-148.8	0	0	111.8	N333 L334	N333-E336 HydrophobicContact CB-CG 4.42Å; N333-E336 PolarHBondContact N-OE1 2.91Å; N333-E336 WeakPolarHBondContact O-CB 3.49Å; N333-E336 PolarHBondContact O-N 3.09Å; L334-E336 PolarHBondContact O-N 3.25Å
337	L	84.4	Confident	85	Confident	10 Å²	10	54.5 Å²	54.5	5%	0.052	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-87.6	-2.3	179.3	-157.3	66.7	0	0	0	114.2	W332 L334 R335 V339 Y340 L341 N560	W332-L337 HydrophobicContact CH2-CD2 4.45Å; W332-L337 HydrophobicContact CZ3-CB 4.32Å; W332-L337 HydrophobicContact CZ3-CD2 4.37Å; L334-L337 HydrophobicContact CD1-CD2 4.35Å; L334-L337 WeakPolarHBondContact O-CB 3.34Å; L334-L337 PolarHBondContact O-N 3.03Å; R335-L337 PolarHBondContact O-N 2.92Å; R335-L337 VanDerWaalsContact O-N 3.11Å; L337-V339 PolarHBondContact O-N 3.26Å; L337-V339 VanDerWaalsContact O-N 3.11Å; L337-Y340 HydrophobicContact CD1-CD2 3.8Å; L337-Y340 HydrophobicContact CD1-CG 4.09Å; L337-Y340 PolarHBondContact O-N 3.49Å; L337-L341 HydrophobicContact CB-CD1 4.32Å; L337-L341 HydrophobicContact CB-CG 4.33Å; L337-L341 HydrophobicContact CD2-CD1 4.13Å; L337-L341 HydrophobicContact CD2-CD2 3.87Å; L337-L341 HydrophobicContact CD2-CG 3.8Å; L337-L341 HydrophobicContact CG-CD1 4.39Å; L337-L341 HydrophobicContact CG-CD2 4.47Å; L337-L341 HydrophobicContact CG-CG 3.94Å; L337-L341 PolarHBondContact O-N 3.1Å; L337-N560 HydrophobicContact CD1-CB 3.34Å; L337-N560 VanDerWaalsContact CD2-C 3.45Å; L337-N560 HydrophobicContact CD2-CB 4.24Å; L337-N560 WeakPolarHBondContact CD2-O 3.43Å; L337-N560 HydrophobicContact CG-CB 4.37Å
338	C	89	Confident	85.6	Confident	25 Å²	25	52.8 Å²	52.8	17%	0.169	25%	0.25	C	S	.	.	H	α-helix	trans	-52.4	-41.2	-172.5	-179.2	0	0	0	0	113.2	C313 R335 L341 K342	C313-C338 HydrophobicContact CB-CB 3.87Å; C313-C338 WeakPolarHBondContact CB-SG 3.39Å; C313-C338 VanDerWaalsContact SG-CA 3.51Å; C313-C338 WeakPolarHBondContact SG-CB 3.32Å; C313-C338 CovalentContact SG-SG 2.03Å; C313-C338 PolarHBondContact SG-SG 2.78Å; R335-C338 WeakPolarHBondContact O-CB 3.45Å; R335-C338 PolarHBondContact O-N 3.29Å; C338-L341 PolarHBondContact O-N 3.31Å; C338-K342 WeakPolarHBondContact O-CB 3.39Å; C338-K342 WeakPolarHBondContact O-CG 3.02Å; C338-K342 PolarHBondContact O-N 2.97Å
339	V	86.4	Confident	86.2	Confident	110 Å²	110	51.9 Å²	51.9	67%	0.667	24%	0.24	S	C	*	.	H	α-helix	trans	-64.2	-44.8	177.8	178.6	0	0	0	0	111.4	L337 K342 L343	L337-V339 PolarHBondContact O-N 3.26Å; L337-V339 VanDerWaalsContact O-N 3.11Å; V339-K342 PolarHBondContact O-N 2.89Å; V339-L343 WeakPolarHBondContact O-CB 3.38Å; V339-L343 PolarHBondContact O-N 3.31Å
340	Y	83.5	Confident	86.6	Confident	92 Å²	92	55 Å²	55	36%	0.361	26%	0.26	S	S	.	.	H	α-helix	trans	-68.7	-39.5	179.1	-64.6	-80.3	0	0	0	111.6	L337 L343 S344 I565	L337-Y340 HydrophobicContact CD1-CD2 3.8Å; L337-Y340 HydrophobicContact CD1-CG 4.09Å; L337-Y340 PolarHBondContact O-N 3.49Å; Y340-L343 CarbonylContact O-C 3.46Å; Y340-L343 PolarHBondContact O-N 3.5Å; Y340-S344 WeakPolarHBondContact O-CB 3.44Å; Y340-S344 PolarHBondContact O-N 3.12Å; Y340-I565 WeakPolarHBondContact O-CD1 3.33Å
341	L	86.9	Confident	86.8	Confident	37 Å²	37	46.9 Å²	46.9	19%	0.194	23%	0.234	C	C	.	.	H	α-helix	trans	-64.2	-41.4	176	-69.6	174.5	0	0	0	112	V309 A312 L334 L337 C338 S344 Y345	V309-L341 HydrophobicContact CG2-CB 4.2Å; A312-L341 HydrophobicContact CB-CD1 3.37Å; L334-L341 HydrophobicContact CD1-CD1 4.39Å; L337-L341 HydrophobicContact CB-CD1 4.32Å; L337-L341 HydrophobicContact CB-CG 4.33Å; L337-L341 HydrophobicContact CD2-CD1 4.13Å; L337-L341 HydrophobicContact CD2-CD2 3.87Å; L337-L341 HydrophobicContact CD2-CG 3.8Å; L337-L341 HydrophobicContact CG-CD1 4.39Å; L337-L341 HydrophobicContact CG-CD2 4.47Å; L337-L341 HydrophobicContact CG-CG 3.94Å; L337-L341 PolarHBondContact O-N 3.1Å; C338-L341 PolarHBondContact O-N 3.31Å; L341-S344 VanDerWaalsContact O-CB 3.31Å; L341-S344 WeakPolarHBondContact O-CB 3.2Å; L341-S344 PolarHBondContact O-N 3.5Å; L341-Y345 PolarHBondContact O-N 3.46Å
342	K	89.1	Confident	86.8	Confident	74 Å²	74	45 Å²	45	32%	0.322	23%	0.227	S	C	.	.	H	α-helix	trans	-57.9	-47.6	171.3	-82.1	-175.9	179.1	-167.3	0	111.4	I303 V309 C338 V339 S344 Y345 L346	I303-K342 HydrophobicContact CD1-CB 3.75Å; I303-K342 HydrophobicContact CD1-CG 4.1Å; I303-K342 WeakPolarHBondContact CD1-O 3.31Å; I303-K342 HydrophobicContact CG1-CB 4.31Å; I303-K342 HydrophobicContact CG1-CG 4.27Å; V309-K342 HydrophobicContact CG1-CG 3.54Å; C338-K342 WeakPolarHBondContact O-CB 3.39Å; C338-K342 WeakPolarHBondContact O-CG 3.02Å; C338-K342 PolarHBondContact O-N 2.97Å; V339-K342 PolarHBondContact O-N 2.89Å; K342-S344 VanDerWaalsContact C-N 3.34Å; K342-S344 PolarHBondContact O-N 3.47Å; K342-Y345 PolarHBondContact O-N 3.22Å; K342-L346 PolarHBondContact O-N 3.11Å
343	L	86.2	Confident	86.9	Confident	70 Å²	70	44.1 Å²	44.1	37%	0.366	23%	0.225	S	C	.	.	H	α-helix	trans	-64.5	-38	176.7	-175.4	61.1	0	0	0	112.3	V339 Y340 Y345 L346 F347 I565	V339-L343 WeakPolarHBondContact O-CB 3.38Å; V339-L343 PolarHBondContact O-N 3.31Å; Y340-L343 CarbonylContact O-C 3.46Å; Y340-L343 PolarHBondContact O-N 3.5Å; L343-Y345 VanDerWaalsContact C-N 3.32Å; L343-Y345 PolarHBondContact O-N 2.77Å; L343-L346 HydrophobicContact CD1-CD1 4.09Å; L343-L346 WeakPolarHBondContact O-CB 3.39Å; L343-L346 PolarHBondContact O-N 2.87Å; L343-F347 HydrophobicContact CD1-CE2 3.75Å; L343-F347 HydrophobicContact CD1-CZ 4.23Å; L343-F347 HydrophobicContact CG-CE2 3.96Å; L343-F347 VanDerWaalsContact O-CD2 3.26Å; L343-F347 WeakPolarHBondContact O-CD2 3.21Å; L343-I565 HydrophobicContact CD2-CG2 4.37Å
344	S	86.6	Confident	87	Confident	17 Å²	17	47.4 Å²	47.4	12%	0.119	24%	0.237	C	C	.	.	H	α-helix	trans	-57.1	-46.8	175.2	-142.7	0	0	0	0	111.1	Y340 L341 K342 L346 F347 D348 G561	Y340-S344 WeakPolarHBondContact O-CB 3.44Å; Y340-S344 PolarHBondContact O-N 3.12Å; L341-S344 VanDerWaalsContact O-CB 3.31Å; L341-S344 WeakPolarHBondContact O-CB 3.2Å; L341-S344 PolarHBondContact O-N 3.5Å; K342-S344 VanDerWaalsContact C-N 3.34Å; K342-S344 PolarHBondContact O-N 3.47Å; S344-L346 VanDerWaalsContact C-N 3.26Å; S344-L346 PolarHBondContact O-N 3.09Å; S344-F347 PolarHBondContact O-N 3.33Å; S344-D348 PolarHBondContact O-N 3.32Å; S344-G561 PolarHBondContact OG-O 2.99Å
345	Y	88.7	Confident	87.2	Confident	17 Å²	17	46.7 Å²	46.7	7%	0.067	23%	0.233	C	C	.	.	H	α-helix	trans	-62.8	-29.9	-179.6	-179.8	-99.4	0	0	0	113.4	T302 I303 Y306 L341 K342 L343 F347 D348 H349	T302-Y345 WeakPolarHBondContact CB-OH 3.19Å; T302-Y345 WeakPolarHBondContact OG1-CE1 3.49Å; T302-Y345 PolarHBondContact OG1-OH 2.96Å; I303-Y345 HydrophobicContact CB-CD1 4.13Å; I303-Y345 HydrophobicContact CB-CE1 4.4Å; I303-Y345 HydrophobicContact CG1-CD1 4Å; Y306-Y345 AromaticContact CD1-CD2 3.32Å; Y306-Y345 HydrophobicContact CD1-CD2 3.32Å; Y306-Y345 AromaticContact CD1-CE2 3.61Å; Y306-Y345 HydrophobicContact CD1-CE2 3.61Å; Y306-Y345 AromaticContact CD1-CG 3.96Å; Y306-Y345 HydrophobicContact CD1-CG 3.96Å; Y306-Y345 AromaticContact CD2-CD2 3.94Å; Y306-Y345 HydrophobicContact CD2-CD2 3.94Å; Y306-Y345 AromaticContact CD2-CE2 3.32Å; Y306-Y345 HydrophobicContact CD2-CE2 3.32Å; Y306-Y345 AromaticContact CE1-CD2 3.56Å; Y306-Y345 HydrophobicContact CE1-CD2 3.56Å; Y306-Y345 AromaticContact CE1-CE2 3.99Å; Y306-Y345 HydrophobicContact CE1-CE2 3.99Å; Y306-Y345 HydrophobicContact CE1-CG 4.43Å; Y306-Y345 HydrophobicContact CE2-CD2 4.13Å; Y306-Y345 AromaticContact CE2-CE2 3.72Å; Y306-Y345 HydrophobicContact CE2-CE2 3.72Å; Y306-Y345 AromaticContact CG-CD2 3.54Å; Y306-Y345 HydrophobicContact CG-CD2 3.54Å; Y306-Y345 AromaticContact CG-CE2 3.26Å; Y306-Y345 HydrophobicContact CG-CE2 3.26Å; Y306-Y345 HydrophobicContact CG-CG 4.28Å; Y306-Y345 AromaticContact CG-CZ 3.82Å; Y306-Y345 AromaticContact CZ-CD2 3.94Å; L341-Y345 PolarHBondContact O-N 3.46Å; K342-Y345 PolarHBondContact O-N 3.22Å; L343-Y345 VanDerWaalsContact C-N 3.32Å; L343-Y345 PolarHBondContact O-N 2.77Å; Y345-F347 PolarHBondContact O-N 2.94Å; Y345-D348 CarbonylContact O-C 3.59Å; Y345-D348 PolarHBondContact O-N 3.1Å; Y345-H349 HydrophobicContact CD2-CB 4.39Å; Y345-H349 HydrophobicContact CE2-CB 3.93Å; Y345-H349 PolarHBondContact O-CD2 2.73Å
346	L	86.2	Confident	87.3	Confident	16 Å²	16	41 Å²	41	8%	0.084	21%	0.212	C	C	.	.	H	α-helix	trans	-62.6	-23.6	174.6	-64.4	-179.6	0	0	0	113	F296 L300 I303 K342 L343 S344	F296-L346 HydrophobicContact CE2-CB 4.11Å; F296-L346 HydrophobicContact CE2-CD1 4.42Å; F296-L346 HydrophobicContact CZ-CD1 4.38Å; L300-L346 HydrophobicContact CB-CD2 4.42Å; L300-L346 HydrophobicContact CD2-CD1 3.93Å; L300-L346 HydrophobicContact CD2-CD2 3.67Å; L300-L346 HydrophobicContact CD2-CG 4.49Å; L300-L346 HydrophobicContact CG-CD2 3.98Å; I303-L346 HydrophobicContact CD1-CD2 3.97Å; I303-L346 HydrophobicContact CD1-CG 4.15Å; K342-L346 PolarHBondContact O-N 3.11Å; L343-L346 HydrophobicContact CD1-CD1 4.09Å; L343-L346 WeakPolarHBondContact O-CB 3.39Å; L343-L346 PolarHBondContact O-N 2.87Å; S344-L346 VanDerWaalsContact C-N 3.26Å; S344-L346 PolarHBondContact O-N 3.09Å
347	F	83.4	Confident	87.5	Confident	19 Å²	19	38.6 Å²	38.6	8%	0.083	20%	0.202	C	C	.	.	H	α-helix	trans	-106	-30.1	178.1	-55.4	-57	0	0	0	112.3	F296 L343 S344 Y345 S352 F653	F296-F347 HydrophobicContact CD2-CE1 4.43Å; F296-F347 AromaticContact CE2-CE1 3.98Å; F296-F347 HydrophobicContact CE2-CE1 3.98Å; L343-F347 HydrophobicContact CD1-CE2 3.75Å; L343-F347 HydrophobicContact CD1-CZ 4.23Å; L343-F347 HydrophobicContact CG-CE2 3.96Å; L343-F347 VanDerWaalsContact O-CD2 3.26Å; L343-F347 WeakPolarHBondContact O-CD2 3.21Å; S344-F347 PolarHBondContact O-N 3.33Å; Y345-F347 PolarHBondContact O-N 2.94Å; F347-S352 WeakPolarHBondContact O-CB 3.32Å; F347-S352 PolarHBondContact O-OG 3.13Å; F347-F653 AromaticContact CD1-CD2 3.95Å; F347-F653 HydrophobicContact CD1-CD2 3.95Å; F347-F653 AromaticContact CE1-CD2 3.53Å; F347-F653 HydrophobicContact CE1-CD2 3.53Å; F347-F653 AromaticContact CE1-CE2 3.66Å; F347-F653 HydrophobicContact CE1-CE2 3.66Å; F347-F653 HydrophobicContact CZ-CD2 4.2Å; F347-F653 HydrophobicContact CZ-CE2 4.13Å
348	D	85.2	Confident	87.9	Confident	16 Å²	16	40.6 Å²	40.6	9%	0.086	21%	0.211	C	C	.	.	S	Bend	trans	-111.3	82.3	-179.4	-160.5	10.9	0	0	0	111.8	S344 Y345 L564 S716 S717	S344-D348 PolarHBondContact O-N 3.32Å; Y345-D348 CarbonylContact O-C 3.59Å; Y345-D348 PolarHBondContact O-N 3.1Å; D348-L564 HydrophobicContact CB-CD2 3.62Å; D348-S716 VanDerWaalsContact OD1-CB 3.23Å; D348-S716 WeakPolarHBondContact OD1-CB 3.44Å; D348-S716 PolarHBondContact OD1-OG 3.1Å; D348-S716 VanDerWaalsContact OD2-CA 3.22Å; D348-S716 WeakPolarHBondContact OD2-CA 3.43Å; D348-S716 PolarHBondContact OD2-OG 3.09Å; D348-S717 PolarHBondContact OD2-N 3.12Å; D348-S717 PolarHBondContact OD2-OG 3.26Å
349	H	86.8	Confident	88.1	Confident	5 Å²	5	39.7 Å²	39.7	2%	0.023	20%	0.204	C	C	.	.	S	Bend	trans	-137.7	162.8	172.7	64.1	96.9	0	0	0	109.3	V295 Y298 Y345 G351 S352	V295-H349 WeakPolarHBondContact CG1-CE1 3.41Å; V295-H349 PolarHBondContact O-CE1 2.79Å; V295-H349 PolarHBondContact O-NE2 3.24Å; Y298-H349 AromaticContact CD1-CE1 3.84Å; Y298-H349 AromaticContact CD1-ND1 3.6Å; Y298-H349 AromaticContact CE1-ND1 3.94Å; Y345-H349 HydrophobicContact CD2-CB 4.39Å; Y345-H349 HydrophobicContact CE2-CB 3.93Å; Y345-H349 PolarHBondContact O-CD2 2.73Å; H349-G351 WeakPolarHBondContact ND1-CA 3.32Å; H349-G351 PolarHBondContact ND1-N 3.49Å; H349-G351 VanDerWaalsContact ND1-N 3.19Å; H349-G351 PolarHBondContact O-N 3.28Å; H349-S352 PolarHBondContact O-N 3.15Å; H349-S352 PolarHBondContact O-OG 3.41Å
350	P	86.5	Confident	88.3	Confident	72 Å²	72	34.9 Å²	34.9	47%	0.468	18%	0.175	S	C	.	.	H	α-helix	trans	-54.2	-22.9	-177.1	-29	36.1	0	0	0	115.3	V353 F718	P350-V353 PolarHBondContact O-N 2.76Å; P350-F718 HydrophobicContact CB-CE2 4.46Å
351	G	88.2	Confident	88.7	Confident	15 Å²	15	33.5 Å²	33.5	16%	0.155	17%	0.173	C	C	.	.	H	α-helix	trans	-69.6	-26.4	174.8	0	0	0	0	0	114.4	H349 V353 F354 Y355	H349-G351 WeakPolarHBondContact ND1-CA 3.32Å; H349-G351 PolarHBondContact ND1-N 3.49Å; H349-G351 VanDerWaalsContact ND1-N 3.19Å; H349-G351 PolarHBondContact O-N 3.28Å; G351-V353 VanDerWaalsContact C-N 3.33Å; G351-F354 PolarHBondContact O-N 2.81Å; G351-Y355 WeakPolarHBondContact O-CB 3.48Å; G351-Y355 PolarHBondContact O-N 3.15Å
352	S	87.6	Confident	89	Confident	3 Å²	3	32 Å²	32	2%	0.021	17%	0.165	C	C	.	.	H	α-helix	trans	-69.2	-32.2	175.9	69.6	0	0	0	0	112	F347 H349 Y355 A356	F347-S352 WeakPolarHBondContact O-CB 3.32Å; F347-S352 PolarHBondContact O-OG 3.13Å; H349-S352 PolarHBondContact O-N 3.15Å; H349-S352 PolarHBondContact O-OG 3.41Å; S352-Y355 PolarHBondContact O-N 3.24Å; S352-A356 PolarHBondContact O-N 3.17Å
353	V	88.5	Confident	89.2	Confident	15 Å²	15	28.6 Å²	28.6	9%	0.091	15%	0.15	C	C	.	.	H	α-helix	trans	-65.2	-45.9	173.1	-179.2	0	0	0	0	110.8	P350 G351 Y355 A356 I357 I712 F718	P350-V353 PolarHBondContact O-N 2.76Å; G351-V353 VanDerWaalsContact C-N 3.33Å; V353-Y355 VanDerWaalsContact C-N 3.29Å; V353-Y355 PolarHBondContact O-N 3.48Å; V353-A356 PolarHBondContact O-N 2.63Å; V353-I357 PolarHBondContact O-N 2.96Å; V353-I712 HydrophobicContact CG1-CD1 4.4Å; V353-I712 HydrophobicContact CG2-CG2 4.01Å; V353-F718 HydrophobicContact CG2-CB 4.48Å; V353-F718 HydrophobicContact CG2-CD1 4.12Å; V353-F718 HydrophobicContact CG2-CD2 4.17Å; V353-F718 HydrophobicContact CG2-CE1 4.42Å; V353-F718 HydrophobicContact CG2-CE2 4.46Å; V353-F718 HydrophobicContact CG2-CG 4Å
354	F	90.9	Very high	89.5	Confident	125 Å²	125	26 Å²	26	55%	0.548	14%	0.137	S	C	.	.	H	α-helix	trans	-58	-45.2	172.5	165.8	-98	0	0	0	111	V291 G351 A356 I357 F358	V291-F354 HydrophobicContact CG1-CE1 4.23Å; G351-F354 PolarHBondContact O-N 2.81Å; F354-A356 VanDerWaalsContact C-N 3.34Å; F354-A356 PolarHBondContact O-N 3.41Å; F354-I357 PolarHBondContact O-N 3.48Å; F354-F358 PolarHBondContact O-N 3.05Å
355	Y	92.9	Very high	89.8	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.8	-39.1	179.8	-170.8	-121.8	0	0	0	112.8	A288 V291 V295 G351 S352 V353 I357 F358 M359 V650 P654 P657	A288-Y355 PolarHBondContact O-OH 3.18Å; V291-Y355 HydrophobicContact CB-CD2 4.43Å; V291-Y355 HydrophobicContact CB-CE2 4.13Å; V291-Y355 HydrophobicContact CG1-CD2 3.78Å; V291-Y355 HydrophobicContact CG1-CE2 3.98Å; V295-Y355 HydrophobicContact CG2-CD2 4.3Å; V295-Y355 HydrophobicContact CG2-CG 4.41Å; G351-Y355 WeakPolarHBondContact O-CB 3.48Å; G351-Y355 PolarHBondContact O-N 3.15Å; S352-Y355 PolarHBondContact O-N 3.24Å; V353-Y355 VanDerWaalsContact C-N 3.29Å; V353-Y355 PolarHBondContact O-N 3.48Å; Y355-I357 VanDerWaalsContact C-N 3.34Å; Y355-I357 PolarHBondContact O-N 3.1Å; Y355-F358 HydrophobicContact CD2-CD1 4.06Å; Y355-F358 HydrophobicContact CE2-CD1 4.02Å; Y355-F358 HydrophobicContact CE2-CE1 4.4Å; Y355-F358 WeakPolarHBondContact O-CB 3.46Å; Y355-F358 PolarHBondContact O-N 3.29Å; Y355-M359 HydrophobicContact CD1-CG 4.18Å; Y355-M359 HydrophobicContact CD2-CG 4.22Å; Y355-M359 HydrophobicContact CE1-CG 3.91Å; Y355-M359 HydrophobicContact CE1-SD 4.42Å; Y355-M359 HydrophobicContact CE2-CG 3.94Å; Y355-M359 HydrophobicContact CE2-SD 4.02Å; Y355-M359 HydrophobicContact CG-CG 4.36Å; Y355-M359 WeakPolarHBondContact O-CB 3.41Å; Y355-M359 VanDerWaalsContact O-CG 3.25Å; Y355-M359 WeakPolarHBondContact O-CG 3.24Å; Y355-M359 PolarHBondContact O-N 2.98Å; Y355-V650 HydrophobicContact CD1-CG2 3.93Å; Y355-V650 HydrophobicContact CE1-CG2 3.43Å; Y355-V650 VanDerWaalsContact CE1-CG2 3.43Å; Y355-P654 HydrophobicContact CD1-CB 3.8Å; Y355-P654 HydrophobicContact CD1-CG 4.35Å; Y355-P654 HydrophobicContact CE1-CB 3.83Å; Y355-P654 WeakPolarHBondContact CE1-O 3.31Å; Y355-P654 PolarHBondContact OH-O 2.76Å; Y355-P654 VanDerWaalsContact OH-O 3.09Å; Y355-P657 VanDerWaalsContact OH-CG 3.29Å; Y355-P657 WeakPolarHBondContact OH-CG 3.48Å
356	A	91.5	Very high	90	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.3	-42.6	175.6	0	0	0	0	0	112.2	S352 V353 F354 M359 V360 V650 A651 N708 I712	S352-A356 PolarHBondContact O-N 3.17Å; V353-A356 PolarHBondContact O-N 2.63Å; F354-A356 VanDerWaalsContact C-N 3.34Å; F354-A356 PolarHBondContact O-N 3.41Å; A356-M359 PolarHBondContact O-N 3.1Å; A356-V360 WeakPolarHBondContact O-CG2 3.46Å; A356-V360 PolarHBondContact O-N 3.11Å; A356-V360 VanDerWaalsContact O-N 3.12Å; A356-V650 HydrophobicContact CB-CG1 4.49Å; A356-A651 HydrophobicContact CB-CB 4.26Å; A356-N708 HydrophobicContact CB-CB 4.47Å; A356-I712 HydrophobicContact CB-CD1 3.8Å
357	I	89.3	Confident	90.4	Very high	73 Å²	73	25 Å²	25	37%	0.374	13%	0.133	S	C	.	.	H	α-helix	trans	-65.1	-45.3	175.6	-62.6	170.7	0	0	0	110.7	V353 F354 Y355 M359 V360 I361 F782	V353-I357 PolarHBondContact O-N 2.96Å; F354-I357 PolarHBondContact O-N 3.48Å; Y355-I357 VanDerWaalsContact C-N 3.34Å; Y355-I357 PolarHBondContact O-N 3.1Å; I357-M359 VanDerWaalsContact C-N 3.27Å; I357-M359 PolarHBondContact O-N 3.27Å; I357-V360 PolarHBondContact O-N 2.87Å; I357-I361 HydrophobicContact CG2-CD1 4.26Å; I357-I361 PolarHBondContact O-N 2.98Å; I357-I361 VanDerWaalsContact O-N 3.15Å; I357-F782 HydrophobicContact CD1-CE2 4.24Å; I357-F782 HydrophobicContact CG1-CD2 4.46Å; I357-F782 HydrophobicContact CG1-CE2 3.56Å; I357-F782 HydrophobicContact CG1-CZ 4.09Å
358	F	92.9	Very high	90.8	Very high	52 Å²	52	24.6 Å²	24.6	23%	0.228	13%	0.131	C	C	.	.	H	α-helix	trans	-56.8	-43.1	176	169.3	-92.5	0	0	0	111.5	V291 F354 Y355 V360 I361 W362	V291-F358 HydrophobicContact CB-CD1 4.38Å; V291-F358 HydrophobicContact CB-CE1 4.06Å; V291-F358 HydrophobicContact CB-CZ 4.28Å; V291-F358 HydrophobicContact CG1-CD1 4.16Å; V291-F358 HydrophobicContact CG1-CE1 4.33Å; V291-F358 HydrophobicContact CG1-CG 4.37Å; V291-F358 HydrophobicContact CG2-CE1 4.12Å; V291-F358 HydrophobicContact CG2-CE2 4.13Å; V291-F358 HydrophobicContact CG2-CZ 3.81Å; F354-F358 PolarHBondContact O-N 3.05Å; Y355-F358 HydrophobicContact CD2-CD1 4.06Å; Y355-F358 HydrophobicContact CE2-CD1 4.02Å; Y355-F358 HydrophobicContact CE2-CE1 4.4Å; Y355-F358 WeakPolarHBondContact O-CB 3.46Å; Y355-F358 PolarHBondContact O-N 3.29Å; F358-V360 VanDerWaalsContact C-N 3.35Å; F358-V360 PolarHBondContact O-N 3.28Å; F358-I361 PolarHBondContact O-N 2.85Å; F358-W362 HydrophobicContact CE1-CB 4.35Å; F358-W362 VanDerWaalsContact O-CB 3.31Å; F358-W362 WeakPolarHBondContact O-CB 3.48Å; F358-W362 PolarHBondContact O-N 2.97Å
359	M	93.5	Very high	91.2	Very high	5 Å²	5	27.7 Å²	27.7	3%	0.025	14%	0.142	C	C	.	.	H	α-helix	trans	-69.1	-30.2	-179.2	-73.5	-63.8	-56.4	0	0	113.4	A288 Y355 A356 I357 W362 G363 V650 P657	A288-M359 HydrophobicContact CB-CE 4.24Å; A288-M359 HydrophobicContact CB-SD 3.74Å; Y355-M359 HydrophobicContact CD1-CG 4.18Å; Y355-M359 HydrophobicContact CD2-CG 4.22Å; Y355-M359 HydrophobicContact CE1-CG 3.91Å; Y355-M359 HydrophobicContact CE1-SD 4.42Å; Y355-M359 HydrophobicContact CE2-CG 3.94Å; Y355-M359 HydrophobicContact CE2-SD 4.02Å; Y355-M359 HydrophobicContact CG-CG 4.36Å; Y355-M359 WeakPolarHBondContact O-CB 3.41Å; Y355-M359 VanDerWaalsContact O-CG 3.25Å; Y355-M359 WeakPolarHBondContact O-CG 3.24Å; Y355-M359 PolarHBondContact O-N 2.98Å; A356-M359 PolarHBondContact O-N 3.1Å; I357-M359 VanDerWaalsContact C-N 3.27Å; I357-M359 PolarHBondContact O-N 3.27Å; M359-W362 HydrophobicContact CE-CD2 4.18Å; M359-W362 HydrophobicContact CE-CE3 3.69Å; M359-W362 HydrophobicContact CE-CZ3 4.06Å; M359-G363 PolarHBondContact O-N 2.99Å; M359-V650 HydrophobicContact CB-CG1 3.82Å; M359-V650 HydrophobicContact CB-CG2 4.3Å; M359-V650 HydrophobicContact CE-CG2 4.23Å; M359-V650 HydrophobicContact CG-CB 4.45Å; M359-V650 HydrophobicContact CG-CG1 4.08Å; M359-V650 HydrophobicContact CG-CG2 3.69Å; M359-V650 HydrophobicContact SD-CG2 4.46Å; M359-P657 HydrophobicContact CE-CG 4.04Å; M359-P657 HydrophobicContact SD-CG 4.42Å
360	V	89.8	Confident	91.6	Very high	10 Å²	10	27.6 Å²	27.6	6%	0.061	14%	0.142	C	C	.	.	H	α-helix	trans	-64.6	-48.8	170.1	169	0	0	0	0	110.8	A356 I357 F358 W362 G363 V364 V705 A786	A356-V360 WeakPolarHBondContact O-CG2 3.46Å; A356-V360 PolarHBondContact O-N 3.11Å; A356-V360 VanDerWaalsContact O-N 3.12Å; I357-V360 PolarHBondContact O-N 2.87Å; F358-V360 VanDerWaalsContact C-N 3.35Å; F358-V360 PolarHBondContact O-N 3.28Å; V360-W362 VanDerWaalsContact C-N 3.32Å; V360-W362 PolarHBondContact O-N 3.38Å; V360-G363 PolarHBondContact O-N 3.24Å; V360-V364 PolarHBondContact O-N 3.25Å; V360-V705 HydrophobicContact CB-CG2 4.49Å; V360-V705 HydrophobicContact CG1-CG2 3.7Å; V360-V705 HydrophobicContact CG2-CG2 3.93Å; V360-A786 HydrophobicContact CG1-CB 4.04Å
361	I	91	Very high	91.9	Very high	62 Å²	62	26.2 Å²	26.2	32%	0.318	13%	0.128	S	C	.	.	H	α-helix	trans	-61.5	-43.9	177.5	-65.9	169.2	0	0	0	110.3	I357 F358 G363 V364 T365 L793	I357-I361 HydrophobicContact CG2-CD1 4.26Å; I357-I361 PolarHBondContact O-N 2.98Å; I357-I361 VanDerWaalsContact O-N 3.15Å; F358-I361 PolarHBondContact O-N 2.85Å; I361-G363 VanDerWaalsContact C-N 3.34Å; I361-G363 PolarHBondContact O-N 2.91Å; I361-V364 PolarHBondContact O-N 3.33Å; I361-T365 HydrophobicContact CG2-CG2 4.24Å; I361-T365 WeakPolarHBondContact O-CB 3.3Å; I361-T365 WeakPolarHBondContact O-CG2 3.41Å; I361-T365 PolarHBondContact O-N 3.29Å; I361-T365 PolarHBondContact O-OG1 3.08Å; I361-L793 HydrophobicContact CG2-CD1 4.09Å
362	W	94.9	Very high	92.1	Very high	7 Å²	7	29.5 Å²	29.5	3%	0.027	14%	0.136	C	C	.	.	H	α-helix	trans	-57.6	-44.8	175.4	175.3	90.1	0	0	0	111.8	Y281 W284 L285 A288 F358 M359 V360 V364 T365 F366 F643 I646 T647	Y281-W362 HydrophobicContact CE2-CH2 4.15Å; W284-W362 HydrophobicContact CB-CZ2 4.14Å; W284-W362 AromaticContact CE3-CD1 3.96Å; W284-W362 AromaticContact CE3-NE1 3.81Å; W284-W362 PolarHBondContact O-NE1 3.39Å; L285-W362 HydrophobicContact CD2-CH2 4.22Å; L285-W362 HydrophobicContact CD2-CZ2 4.16Å; A288-W362 HydrophobicContact CB-CD2 4.44Å; F358-W362 HydrophobicContact CE1-CB 4.35Å; F358-W362 VanDerWaalsContact O-CB 3.31Å; F358-W362 WeakPolarHBondContact O-CB 3.48Å; F358-W362 PolarHBondContact O-N 2.97Å; M359-W362 HydrophobicContact CE-CD2 4.18Å; M359-W362 HydrophobicContact CE-CE3 3.69Å; M359-W362 HydrophobicContact CE-CZ3 4.06Å; V360-W362 VanDerWaalsContact C-N 3.32Å; V360-W362 PolarHBondContact O-N 3.38Å; W362-V364 PolarHBondContact O-N 2.89Å; W362-T365 WeakPolarHBondContact CA-OG1 3.22Å; W362-T365 PolarHBondContact O-N 3.4Å; W362-T365 PolarHBondContact O-OG1 2.83Å; W362-T365 VanDerWaalsContact O-OG1 3.09Å; W362-F366 WeakPolarHBondContact O-CB 3.5Å; W362-F366 PolarHBondContact O-N 3.28Å; W362-F643 HydrophobicContact CH2-CD2 4.34Å; W362-F643 AromaticContact CH2-CE2 3.85Å; W362-F643 HydrophobicContact CH2-CE2 3.85Å; W362-F643 HydrophobicContact CZ3-CD2 4.44Å; W362-F643 AromaticContact CZ3-CE2 3.7Å; W362-F643 HydrophobicContact CZ3-CE2 3.7Å; W362-F643 HydrophobicContact CZ3-CZ 4.33Å; W362-I646 HydrophobicContact CH2-CD1 4.01Å; W362-I646 HydrophobicContact CZ3-CD1 4.27Å; W362-T647 HydrophobicContact CZ3-CG2 4.16Å
363	G	93.6	Very high	92.3	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.01	15%	0.146	C	C	.	.	H	α-helix	trans	-61	-46.9	-179.8	0	0	0	0	0	112.7	M359 V360 I361 L367	M359-G363 PolarHBondContact O-N 2.99Å; V360-G363 PolarHBondContact O-N 3.24Å; I361-G363 VanDerWaalsContact C-N 3.34Å; I361-G363 PolarHBondContact O-N 2.91Å; G363-L367 WeakPolarHBondContact O-CG 3.4Å; G363-L367 PolarHBondContact O-N 3.19Å
364	V	91.6	Very high	92.6	Very high	15 Å²	15	32.3 Å²	32.3	9%	0.091	15%	0.148	C	C	.	.	H	α-helix	trans	-66.7	-49.6	178.5	178.4	0	0	0	0	110.9	V360 I361 W362 F366 L367 E368 V701 A790 L793	V360-V364 PolarHBondContact O-N 3.25Å; I361-V364 PolarHBondContact O-N 3.33Å; W362-V364 PolarHBondContact O-N 2.89Å; V364-F366 VanDerWaalsContact C-N 3.3Å; V364-F366 PolarHBondContact O-N 3.04Å; V364-L367 PolarHBondContact O-N 3.33Å; V364-L367 VanDerWaalsContact O-N 3.14Å; V364-E368 HydrophobicContact CG1-CG 4.42Å; V364-E368 PolarHBondContact O-N 3.04Å; V364-V701 HydrophobicContact CG2-CG1 3.9Å; V364-A790 HydrophobicContact CG1-CB 4.31Å; V364-A790 HydrophobicContact CG2-CB 3.61Å; V364-L793 HydrophobicContact CB-CD1 4.49Å; V364-L793 HydrophobicContact CG1-CB 4.09Å; V364-L793 HydrophobicContact CG1-CD1 4.34Å
365	T	92.1	Very high	92.7	Very high	26 Å²	26	27 Å²	27	16%	0.16	13%	0.127	C	C	.	.	H	α-helix	trans	-62.9	-35.5	-179	51	0	0	0	0	112.9	W284 I361 W362 Y369 L793	W284-T365 WeakPolarHBondContact CZ3-OG1 3.43Å; I361-T365 HydrophobicContact CG2-CG2 4.24Å; I361-T365 WeakPolarHBondContact O-CB 3.3Å; I361-T365 WeakPolarHBondContact O-CG2 3.41Å; I361-T365 PolarHBondContact O-N 3.29Å; I361-T365 PolarHBondContact O-OG1 3.08Å; W362-T365 WeakPolarHBondContact CA-OG1 3.22Å; W362-T365 PolarHBondContact O-N 3.4Å; W362-T365 PolarHBondContact O-OG1 2.83Å; W362-T365 VanDerWaalsContact O-OG1 3.09Å; T365-Y369 VanDerWaalsContact O-CB 3.28Å; T365-Y369 WeakPolarHBondContact O-CB 3.43Å; T365-Y369 PolarHBondContact O-N 3.09Å; T365-L793 HydrophobicContact CG2-CD1 3.95Å; T365-L793 HydrophobicContact CG2-CD2 4.15Å
366	F	94.4	Very high	92.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.1	-47.2	172.5	166.1	-111.4	0	0	0	111.9	W277 L280 Y281 W284 W362 V364 Y369 W370 F643	W277-F366 AromaticContact NE1-CZ 3.98Å; L280-F366 HydrophobicContact CD2-CE2 4.08Å; L280-F366 HydrophobicContact CG-CE2 4.14Å; Y281-F366 HydrophobicContact CD2-CE1 4.39Å; Y281-F366 HydrophobicContact CD2-CE2 4.36Å; Y281-F366 AromaticContact CD2-CZ 3.95Å; Y281-F366 HydrophobicContact CD2-CZ 3.95Å; Y281-F366 HydrophobicContact CG-CZ 4.27Å; W284-F366 HydrophobicContact CB-CD2 3.71Å; W284-F366 HydrophobicContact CB-CE2 4.28Å; W284-F366 HydrophobicContact CD2-CB 4.16Å; W284-F366 HydrophobicContact CD2-CD2 4.07Å; W284-F366 HydrophobicContact CE3-CB 3.91Å; W284-F366 AromaticContact CG-CD2 3.64Å; W284-F366 HydrophobicContact CG-CD2 3.64Å; W284-F366 HydrophobicContact CG-CE2 4.41Å; W284-F366 HydrophobicContact CZ3-CB 4.41Å; W362-F366 WeakPolarHBondContact O-CB 3.5Å; W362-F366 PolarHBondContact O-N 3.28Å; V364-F366 VanDerWaalsContact C-N 3.3Å; V364-F366 PolarHBondContact O-N 3.04Å; F366-Y369 PolarHBondContact O-N 2.75Å; F366-W370 PolarHBondContact O-N 2.8Å; F366-F643 AromaticContact CD1-CE2 3.79Å; F366-F643 HydrophobicContact CD1-CE2 3.79Å; F366-F643 HydrophobicContact CD1-CZ 4.32Å; F366-F643 HydrophobicContact CE1-CD2 4.36Å; F366-F643 AromaticContact CE1-CE2 3.81Å; F366-F643 HydrophobicContact CE1-CE2 3.81Å
367	L	93.9	Very high	92.7	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.016	15%	0.146	C	C	.	.	H	α-helix	trans	-64.9	-44.1	179.6	-68.1	-178.6	0	0	0	112.2	G363 V364 Y369 W370 K371 F694 L697 D698 V701	G363-L367 WeakPolarHBondContact O-CG 3.4Å; G363-L367 PolarHBondContact O-N 3.19Å; V364-L367 PolarHBondContact O-N 3.33Å; V364-L367 VanDerWaalsContact O-N 3.14Å; L367-Y369 VanDerWaalsContact C-N 3.33Å; L367-Y369 PolarHBondContact O-N 3.09Å; L367-W370 WeakPolarHBondContact O-CB 3.49Å; L367-W370 PolarHBondContact O-N 2.98Å; L367-W370 VanDerWaalsContact O-N 3.16Å; L367-K371 PolarHBondContact O-N 3.15Å; L367-F694 HydrophobicContact CB-CE2 4.21Å; L367-F694 HydrophobicContact CD2-CE2 4.23Å; L367-L697 HydrophobicContact CD2-CB 3.74Å; L367-L697 HydrophobicContact CD2-CD1 4.22Å; L367-D698 HydrophobicContact CD1-CB 4.28Å; L367-V701 HydrophobicContact CD1-CB 4.29Å; L367-V701 HydrophobicContact CD1-CG2 3.68Å; L367-V701 HydrophobicContact CG-CG2 4.41Å
368	E	92	Very high	92.8	Very high	12 Å²	12	27.9 Å²	27.9	6%	0.056	13%	0.129	C	C	.	.	H	α-helix	trans	-63.2	-40.3	176.6	-66.6	-46.3	129.3	0	0	112.2	V364 W370 K371 R372 I797	V364-E368 HydrophobicContact CG1-CG 4.42Å; V364-E368 PolarHBondContact O-N 3.04Å; E368-W370 VanDerWaalsContact C-N 3.32Å; E368-W370 PolarHBondContact O-N 2.91Å; E368-K371 PolarHBondContact O-N 3.26Å; E368-K371 WeakPolarHBondContact OE1-CE 3.41Å; E368-K371 IonicContact OE1-NZ 3.65Å; E368-K371 PolarHBondContact OE1-NZ 3.45Å; E368-K371 WeakPolarHBondContact OE2-CD 3.35Å; E368-K371 WeakPolarHBondContact OE2-CE 3.42Å; E368-K371 IonicContact OE2-NZ 2.7Å; E368-K371 PolarHBondContact OE2-NZ 2.83Å; E368-R372 WeakPolarHBondContact O-CG 3.3Å; E368-R372 PolarHBondContact O-N 3.21Å; E368-I797 HydrophobicContact CB-CB 4.35Å; E368-I797 HydrophobicContact CB-CG2 3.98Å
369	Y	92.8	Very high	92.7	Very high	80 Å²	80	26.4 Å²	26.4	31%	0.314	12%	0.123	S	C	.	.	H	α-helix	trans	-66.2	-36.6	174.9	-166.8	-91	0	0	0	112.1	L280 W284 T365 F366 L367 R372 K373	L280-Y369 HydrophobicContact CD1-CD1 3.61Å; L280-Y369 HydrophobicContact CD1-CE1 3.49Å; L280-Y369 VanDerWaalsContact CD1-CE1 3.49Å; L280-Y369 HydrophobicContact CD2-CD1 3.84Å; L280-Y369 HydrophobicContact CD2-CE1 4.43Å; L280-Y369 HydrophobicContact CG-CD1 4.32Å; W284-Y369 HydrophobicContact CZ2-CD1 4.19Å; W284-Y369 HydrophobicContact CZ2-CD2 4.08Å; W284-Y369 AromaticContact CZ2-CG 3.7Å; W284-Y369 HydrophobicContact CZ2-CG 3.7Å; W284-Y369 AromaticContact NE1-CD1 3.54Å; W284-Y369 AromaticContact NE1-CG 3.97Å; T365-Y369 VanDerWaalsContact O-CB 3.28Å; T365-Y369 WeakPolarHBondContact O-CB 3.43Å; T365-Y369 PolarHBondContact O-N 3.09Å; F366-Y369 PolarHBondContact O-N 2.75Å; L367-Y369 VanDerWaalsContact C-N 3.33Å; L367-Y369 PolarHBondContact O-N 3.09Å; Y369-R372 PolarHBondContact O-N 3.28Å; Y369-K373 WeakPolarHBondContact O-CB 3.42Å; Y369-K373 PolarHBondContact O-N 3.29Å
370	W	94.8	Very high	92.4	Very high	3 Å²	3	27.8 Å²	27.8	1%	0.011	13%	0.127	C	C	.	.	H	α-helix	trans	-63.7	-45.2	173.5	173.9	-110.6	0	0	0	111.9	F273 A276 W277 L280 F366 L367 E368 R372 K373 N374 I690 F694	F273-W370 HydrophobicContact CD1-CH2 4.36Å; F273-W370 HydrophobicContact CD1-CZ2 4.5Å; A276-W370 HydrophobicContact CB-CH2 4.41Å; A276-W370 HydrophobicContact CB-CZ3 4.47Å; W277-W370 HydrophobicContact CB-CE3 4.32Å; W277-W370 HydrophobicContact CB-CH2 3.46Å; W277-W370 VanDerWaalsContact CB-CH2 3.46Å; W277-W370 HydrophobicContact CB-CZ2 3.82Å; W277-W370 HydrophobicContact CB-CZ3 3.75Å; W277-W370 AromaticContact CD1-CD2 3.62Å; W277-W370 AromaticContact CD1-CE2 3.61Å; W277-W370 AromaticContact CD1-CE3 3.97Å; W277-W370 AromaticContact CD1-CZ2 3.95Å; W277-W370 AromaticContact CD1-NE1 3.99Å; W277-W370 HydrophobicContact CG-CH2 4.28Å; W277-W370 HydrophobicContact CG-CZ2 4.26Å; W277-W370 HydrophobicContact CG-CZ3 4.43Å; L280-W370 HydrophobicContact CB-CE3 4.45Å; L280-W370 HydrophobicContact CD2-CB 3.91Å; L280-W370 HydrophobicContact CD2-CD2 4.39Å; L280-W370 HydrophobicContact CD2-CE3 3.62Å; F366-W370 PolarHBondContact O-N 2.8Å; L367-W370 WeakPolarHBondContact O-CB 3.49Å; L367-W370 PolarHBondContact O-N 2.98Å; L367-W370 VanDerWaalsContact O-N 3.16Å; E368-W370 VanDerWaalsContact C-N 3.32Å; E368-W370 PolarHBondContact O-N 2.91Å; W370-R372 VanDerWaalsContact C-N 3.28Å; W370-R372 PolarHBondContact O-N 2.83Å; W370-K373 HydrophobicContact CE3-CB 4.39Å; W370-K373 HydrophobicContact CE3-CD 4.37Å; W370-K373 HydrophobicContact CZ3-CD 4.25Å; W370-K373 PolarHBondContact O-N 3.09Å; W370-K373 VanDerWaalsContact O-N 3.15Å; W370-N374 HydrophobicContact CD2-CB 4.5Å; W370-N374 HydrophobicContact CZ2-CB 4.15Å; W370-N374 VanDerWaalsContact O-CB 3.24Å; W370-N374 WeakPolarHBondContact O-CB 3.15Å; W370-N374 PolarHBondContact O-N 3.49Å; W370-I690 HydrophobicContact CH2-CG2 4.48Å; W370-I690 HydrophobicContact CZ2-CG2 3.64Å; W370-F694 AromaticContact CD1-CD2 3.87Å
371	K	93.5	Very high	92.4	Very high	44 Å²	44	27.3 Å²	27.3	19%	0.191	13%	0.125	C	C	.	.	H	α-helix	trans	-53.4	-47	175	-67.9	-176.4	-165	160.1	0	111.4	L367 E368 K373 N374 A375 F694 D794 D799	L367-K371 PolarHBondContact O-N 3.15Å; E368-K371 PolarHBondContact O-N 3.26Å; E368-K371 WeakPolarHBondContact OE1-CE 3.41Å; E368-K371 IonicContact OE1-NZ 3.65Å; E368-K371 PolarHBondContact OE1-NZ 3.45Å; E368-K371 WeakPolarHBondContact OE2-CD 3.35Å; E368-K371 WeakPolarHBondContact OE2-CE 3.42Å; E368-K371 IonicContact OE2-NZ 2.7Å; E368-K371 PolarHBondContact OE2-NZ 2.83Å; K371-K373 PolarHBondContact O-N 2.87Å; K371-N374 PolarHBondContact O-N 3.44Å; K371-A375 WeakPolarHBondContact O-CB 3.49Å; K371-A375 PolarHBondContact O-N 3.2Å; K371-F694 HydrophobicContact CD-CZ 3.9Å; K371-F694 HydrophobicContact CG-CE1 4.35Å; K371-F694 HydrophobicContact CG-CE2 3.66Å; K371-F694 HydrophobicContact CG-CZ 3.52Å; K371-D794 IonicContact NZ-OD1 3.9Å; K371-D794 PolarHBondContact NZ-OD1 2.96Å; K371-D799 HydrophobicContact CD-CB 4.4Å; K371-D799 WeakPolarHBondContact CD-OD1 3.16Å; K371-D799 WeakPolarHBondContact CE-OD1 3.34Å; K371-D799 IonicContact NZ-OD1 2.79Å; K371-D799 PolarHBondContact NZ-OD1 2.97Å
372	R	93.1	Very high	92.2	Very high	84 Å²	84	26.5 Å²	26.5	32%	0.317	12%	0.121	S	C	.	.	H	α-helix	trans	-62.2	-43.8	177.9	-69.6	178	69.3	-172.7	2.8	112.9	E368 Y369 W370 K376 P798 D799 P801	E368-R372 WeakPolarHBondContact O-CG 3.3Å; E368-R372 PolarHBondContact O-N 3.21Å; Y369-R372 PolarHBondContact O-N 3.28Å; W370-R372 VanDerWaalsContact C-N 3.28Å; W370-R372 PolarHBondContact O-N 2.83Å; R372-K376 PolarHBondContact O-N 3.5Å; R372-P798 VanDerWaalsContact CD-O 3.29Å; R372-P798 WeakPolarHBondContact CD-O 3.46Å; R372-P798 WeakPolarHBondContact CG-O 3.31Å; R372-D799 VanDerWaalsContact CA-O 3.24Å; R372-D799 WeakPolarHBondContact CA-O 3.27Å; R372-D799 VanDerWaalsContact CG-O 3.26Å; R372-D799 WeakPolarHBondContact CG-O 3.49Å; R372-D799 PolarHBondContact N-O 3.15Å; R372-P801 HydrophobicContact CB-CG 4.11Å; R372-P801 HydrophobicContact CG-CG 4.41Å
373	K	91.9	Very high	92	Very high	53 Å²	53	26.1 Å²	26.1	23%	0.23	12%	0.119	C	C	.	.	H	α-helix	trans	-67.3	-42.4	177.2	-168.8	-178.6	-178.7	-169	0	111.1	A276 L280 Y369 W370 K371 K376 L377	A276-K373 PolarHBondContact O-NZ 2.97Å; L280-K373 HydrophobicContact CB-CD 4.25Å; L280-K373 HydrophobicContact CD1-CD 4.12Å; L280-K373 HydrophobicContact CD2-CD 4.09Å; L280-K373 HydrophobicContact CG-CD 4.37Å; Y369-K373 WeakPolarHBondContact O-CB 3.42Å; Y369-K373 PolarHBondContact O-N 3.29Å; W370-K373 HydrophobicContact CE3-CB 4.39Å; W370-K373 HydrophobicContact CE3-CD 4.37Å; W370-K373 HydrophobicContact CZ3-CD 4.25Å; W370-K373 PolarHBondContact O-N 3.09Å; W370-K373 VanDerWaalsContact O-N 3.15Å; K371-K373 PolarHBondContact O-N 2.87Å; K373-K376 PolarHBondContact O-N 3.45Å; K373-L377 HydrophobicContact CG-CD1 4.13Å; K373-L377 WeakPolarHBondContact O-CG 3.35Å; K373-L377 PolarHBondContact O-N 3.23Å
374	N	94.4	Very high	91.7	Very high	23 Å²	23	29 Å²	29	12%	0.123	13%	0.134	C	C	.	.	H	α-helix	trans	-59.3	-49	176.9	-175	80.7	0	0	0	110.9	F273 W370 K371 K376 L377 A378 Q688 N689	F273-N374 WeakPolarHBondContact CD1-OD1 3.47Å; F273-N374 VanDerWaalsContact CE1-OD1 3.23Å; F273-N374 WeakPolarHBondContact CE1-OD1 3.48Å; W370-N374 HydrophobicContact CD2-CB 4.5Å; W370-N374 HydrophobicContact CZ2-CB 4.15Å; W370-N374 VanDerWaalsContact O-CB 3.24Å; W370-N374 WeakPolarHBondContact O-CB 3.15Å; W370-N374 PolarHBondContact O-N 3.49Å; K371-N374 PolarHBondContact O-N 3.44Å; N374-K376 VanDerWaalsContact C-N 3.31Å; N374-K376 PolarHBondContact O-N 3.14Å; N374-L377 PolarHBondContact O-N 3.34Å; N374-A378 VanDerWaalsContact O-CB 3.3Å; N374-A378 WeakPolarHBondContact O-CB 3.43Å; N374-A378 PolarHBondContact O-N 2.89Å; N374-Q688 PolarHBondContact ND2-O 2.88Å; N374-N689 WeakPolarHBondContact OD1-CA 3.24Å
375	A	93	Very high	91.3	Very high	14 Å²	14	31 Å²	31	12%	0.116	14%	0.144	C	C	.	.	H	α-helix	trans	-58.4	-42.2	176.8	0	0	0	0	0	112.3	K371 H379 V800 L804	K371-A375 WeakPolarHBondContact O-CB 3.49Å; K371-A375 PolarHBondContact O-N 3.2Å; A375-H379 WeakPolarHBondContact O-CB 3.49Å; A375-H379 PolarHBondContact O-N 3.2Å; A375-V800 HydrophobicContact CB-CG2 4.26Å; A375-L804 HydrophobicContact CB-CD2 4.13Å
376	K	91.3	Very high	91	Very high	87 Å²	87	31.7 Å²	31.7	38%	0.378	14%	0.144	S	C	.	.	H	α-helix	trans	-64.4	-42.1	176.7	-171	-177.1	-178.1	-172.3	0	112.5	M126 R372 K373 N374 R380 L804	M126-K376 HydrophobicContact SD-CD 4.11Å; M126-K376 WeakPolarHBondContact SD-CE 3.4Å; R372-K376 PolarHBondContact O-N 3.5Å; K373-K376 PolarHBondContact O-N 3.45Å; N374-K376 VanDerWaalsContact C-N 3.31Å; N374-K376 PolarHBondContact O-N 3.14Å; K376-R380 VanDerWaalsContact O-CB 3.31Å; K376-R380 WeakPolarHBondContact O-CB 3.43Å; K376-R380 PolarHBondContact O-N 2.9Å; K376-L804 HydrophobicContact CB-CD2 4.24Å
377	L	92	Very high	90.5	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-69.9	-44	177.4	-69.9	172.4	0	0	0	111.3	F273 A276 K373 N374 H379 R380 W381	F273-L377 HydrophobicContact CE1-CB 3.9Å; F273-L377 HydrophobicContact CZ-CB 4.35Å; A276-L377 HydrophobicContact CB-CD1 3.54Å; K373-L377 HydrophobicContact CG-CD1 4.13Å; K373-L377 WeakPolarHBondContact O-CG 3.35Å; K373-L377 PolarHBondContact O-N 3.23Å; N374-L377 PolarHBondContact O-N 3.34Å; L377-H379 VanDerWaalsContact C-N 3.32Å; L377-H379 PolarHBondContact O-N 2.89Å; L377-R380 PolarHBondContact O-N 2.87Å; L377-W381 HydrophobicContact CB-CD2 4.41Å; L377-W381 HydrophobicContact CB-CE3 4.39Å; L377-W381 HydrophobicContact CB-CZ3 4.49Å; L377-W381 HydrophobicContact CD1-CH2 4.4Å; L377-W381 HydrophobicContact CD2-CH2 4.36Å; L377-W381 HydrophobicContact CD2-CZ2 3.87Å; L377-W381 WeakPolarHBondContact O-CB 3.37Å; L377-W381 PolarHBondContact O-N 3.26Å
378	A	93.1	Very high	89.9	Confident	3 Å²	3	41.4 Å²	41.4	3%	0.025	19%	0.193	C	C	.	.	H	α-helix	trans	-61	-39.6	179.1	0	0	0	0	0	112.6	F273 N374 D382 V383 L384	F273-A378 HydrophobicContact CZ-CB 4.12Å; N374-A378 VanDerWaalsContact O-CB 3.3Å; N374-A378 WeakPolarHBondContact O-CB 3.43Å; N374-A378 PolarHBondContact O-N 2.89Å; A378-D382 PolarHBondContact O-N 2.92Å; A378-V383 HydrophobicContact CB-CG2 4.25Å; A378-V383 WeakPolarHBondContact O-CG2 3.4Å; A378-V383 PolarHBondContact O-N 2.77Å; A378-L384 HydrophobicContact CB-CD1 4.41Å; A378-L384 PolarHBondContact O-N 2.88Å
379	H	89.5	Confident	89.3	Confident	21 Å²	21	47 Å²	47	10%	0.097	22%	0.219	C	C	.	.	H	α-helix	trans	-66.7	-52	171.8	175.1	-98.3	0	0	0	112	A375 L377 W381 D382 L804 I808 E811	A375-H379 WeakPolarHBondContact O-CB 3.49Å; A375-H379 PolarHBondContact O-N 3.2Å; L377-H379 VanDerWaalsContact C-N 3.32Å; L377-H379 PolarHBondContact O-N 2.89Å; H379-W381 PolarHBondContact O-N 3.24Å; H379-W381 VanDerWaalsContact O-N 3.14Å; H379-D382 PolarHBondContact O-N 2.9Å; H379-L804 HydrophobicContact CB-CD1 3.85Å; H379-L804 HydrophobicContact CB-CD2 4.41Å; H379-L804 WeakPolarHBondContact ND1-CD1 3.22Å; H379-I808 VanDerWaalsContact CD2-CG1 3.47Å; H379-I808 WeakPolarHBondContact CD2-CG1 3.47Å; H379-E811 IonicContact CD2-OE2 3.33Å; H379-E811 IonicContact CE1-OE1 3.83Å; H379-E811 PolarHBondContact CE1-OE1 3.01Å; H379-E811 IonicContact CE1-OE2 3.96Å; H379-E811 PolarHBondContact CE1-OE2 3.04Å; H379-E811 IonicContact NE2-OE1 3.97Å; H379-E811 IonicContact NE2-OE2 3.63Å; H379-E811 PolarHBondContact NE2-OE2 3.3Å
380	R	87.4	Confident	88.8	Confident	33 Å²	33	44.3 Å²	44.3	13%	0.125	21%	0.209	C	C	.	.	H	α-helix	trans	-60.9	-25.6	179.3	-173.5	175.5	-177.4	-134.9	2.9	112.7	M126 E153 D261 R264 K376 L377	M126-R380 VanDerWaalsContact CE-NH1 3.26Å; E153-R380 VanDerWaalsContact CD-NE 3.26Å; E153-R380 IonicContact OE1-CZ 3.41Å; E153-R380 IonicContact OE1-NE 2.89Å; E153-R380 PolarHBondContact OE1-NE 3.01Å; E153-R380 IonicContact OE1-NH2 3.78Å; E153-R380 PolarHBondContact OE1-NH2 2.96Å; E153-R380 IonicContact OE2-NE 2.88Å; D261-R380 VanDerWaalsContact CG-NH1 3.28Å; D261-R380 IonicContact OD1-CZ 3.52Å; D261-R380 VanDerWaalsContact OD1-CZ 3.31Å; D261-R380 IonicContact OD1-NH1 2.76Å; D261-R380 PolarHBondContact OD1-NH1 3.4Å; D261-R380 IonicContact OD1-NH2 2.89Å; D261-R380 IonicContact OD2-CZ 2.57Å; D261-R380 VanDerWaalsContact OD2-CZ 3.23Å; D261-R380 IonicContact OD2-NH1 3.26Å; D261-R380 PolarHBondContact OD2-NH1 3.32Å; D261-R380 IonicContact OD2-NH2 3.8Å; D261-R380 PolarHBondContact OD2-NH2 3Å; R264-R380 PolarHBondContact NH1-O 3.35Å; K376-R380 VanDerWaalsContact O-CB 3.31Å; K376-R380 WeakPolarHBondContact O-CB 3.43Å; K376-R380 PolarHBondContact O-N 2.9Å; L377-R380 PolarHBondContact O-N 2.87Å
381	W	89.8	Confident	88.4	Confident	1 Å²	1	45.9 Å²	45.9	0%	0.004	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	10.5	-179.8	-61.7	-9.6	0	0	0	114.2	L260 R264 E269 G272 F273 A276 L377 H379 V383	L260-W381 HydrophobicContact CB-CZ2 4.35Å; R264-W381 HydrophobicContact CB-CZ2 4.31Å; R264-W381 VanDerWaalsContact CD-CD1 3.41Å; R264-W381 VanDerWaalsContact CD-CG 3.46Å; R264-W381 HydrophobicContact CG-CD2 4.32Å; R264-W381 VanDerWaalsContact CZ-CB 3.43Å; R264-W381 VanDerWaalsContact NH1-CA 3.34Å; R264-W381 VanDerWaalsContact NH2-C 3.35Å; R264-W381 PolarHBondContact NH2-O 3.43Å; E269-W381 HydrophobicContact CB-CE3 4.35Å; E269-W381 HydrophobicContact CG-CB 4.17Å; E269-W381 HydrophobicContact CG-CE3 4.25Å; G272-W381 VanDerWaalsContact C-CH2 3.4Å; F273-W381 HydrophobicContact CB-CZ3 4.48Å; F273-W381 AromaticContact CD1-CZ3 4Å; F273-W381 HydrophobicContact CD1-CZ3 4Å; F273-W381 AromaticContact CD2-CE3 3.97Å; F273-W381 HydrophobicContact CD2-CE3 3.97Å; F273-W381 AromaticContact CD2-CZ3 3.69Å; F273-W381 HydrophobicContact CD2-CZ3 3.69Å; F273-W381 HydrophobicContact CE1-CE3 4.24Å; F273-W381 HydrophobicContact CE1-CZ3 4.08Å; F273-W381 AromaticContact CE2-CE3 3.54Å; F273-W381 HydrophobicContact CE2-CE3 3.54Å; F273-W381 AromaticContact CE2-CZ3 3.74Å; F273-W381 HydrophobicContact CE2-CZ3 3.74Å; F273-W381 HydrophobicContact CG-CE3 4.45Å; F273-W381 AromaticContact CG-CZ3 3.8Å; F273-W381 HydrophobicContact CG-CZ3 3.8Å; F273-W381 AromaticContact CZ-CE3 3.71Å; F273-W381 HydrophobicContact CZ-CE3 3.71Å; F273-W381 AromaticContact CZ-CZ3 3.95Å; F273-W381 HydrophobicContact CZ-CZ3 3.95Å; A276-W381 HydrophobicContact CB-CH2 4.42Å; L377-W381 HydrophobicContact CB-CD2 4.41Å; L377-W381 HydrophobicContact CB-CE3 4.39Å; L377-W381 HydrophobicContact CB-CZ3 4.49Å; L377-W381 HydrophobicContact CD1-CH2 4.4Å; L377-W381 HydrophobicContact CD2-CH2 4.36Å; L377-W381 HydrophobicContact CD2-CZ2 3.87Å; L377-W381 WeakPolarHBondContact O-CB 3.37Å; L377-W381 PolarHBondContact O-N 3.26Å; H379-W381 PolarHBondContact O-N 3.24Å; H379-W381 VanDerWaalsContact O-N 3.14Å; W381-V383 HydrophobicContact CB-CG2 3.95Å; W381-V383 PolarHBondContact O-N 3.15Å; W381-V383 VanDerWaalsContact O-N 3.12Å
382	D	87.9	Confident	88	Confident	44 Å²	44	48.9 Å²	48.9	24%	0.235	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	37.7	177	-56.2	-42.6	0	0	0	113.3	R116 T156 A378 H379 R686	R116-D382 HydrophobicContact CG-CB 4.15Å; T156-D382 WeakPolarHBondContact CB-OD2 3.38Å; T156-D382 WeakPolarHBondContact CG2-OD2 3.39Å; T156-D382 PolarHBondContact OG1-OD1 3.5Å; T156-D382 PolarHBondContact OG1-OD2 3.26Å; A378-D382 PolarHBondContact O-N 2.92Å; H379-D382 PolarHBondContact O-N 2.9Å; D382-R686 PolarHBondContact O-NH2 3.29Å
383	V	89.5	Confident	87.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.221	C	C	.	.			trans	-123.1	12.1	178.2	-71.5	0	0	0	0	111.6	E269 F273 A378 W381 D385 Y386 R686 A687 Q688	E269-V383 HydrophobicContact CB-CG1 4.47Å; E269-V383 HydrophobicContact CG-CG1 3.89Å; F273-V383 HydrophobicContact CE2-CG2 4.01Å; F273-V383 HydrophobicContact CZ-CG2 4.18Å; A378-V383 HydrophobicContact CB-CG2 4.25Å; A378-V383 WeakPolarHBondContact O-CG2 3.4Å; A378-V383 PolarHBondContact O-N 2.77Å; W381-V383 HydrophobicContact CB-CG2 3.95Å; W381-V383 PolarHBondContact O-N 3.15Å; W381-V383 VanDerWaalsContact O-N 3.12Å; V383-D385 PolarHBondContact O-N 3.29Å; V383-Y386 WeakPolarHBondContact O-CB 3.47Å; V383-Y386 PolarHBondContact O-N 2.92Å; V383-R686 HydrophobicContact CG1-CB 4.44Å; V383-A687 WeakPolarHBondContact CB-O 3.1Å; V383-A687 VanDerWaalsContact CG2-O 3.32Å; V383-A687 WeakPolarHBondContact CG2-O 3.32Å; V383-Q688 WeakPolarHBondContact O-CB 3.36Å
384	L	87.3	Confident	87.7	Confident	60 Å²	60	45.2 Å²	45.2	31%	0.314	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	129.7	168.7	-166.7	72.5	0	0	0	109.2	A378 Y386 I808	A378-L384 HydrophobicContact CB-CD1 4.41Å; A378-L384 PolarHBondContact O-N 2.88Å; L384-Y386 PolarHBondContact O-N 3.02Å; L384-I808 HydrophobicContact CD2-CD1 3.96Å
385	D	83.9	Confident	87.2	Confident	58 Å²	58	46.3 Å²	46.3	31%	0.31	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	16	179.6	-54	-41.3	0	0	0	115.7	V383 E387 I388 E389	V383-D385 PolarHBondContact O-N 3.29Å; D385-E387 VanDerWaalsContact C-N 3.34Å; D385-E387 PolarHBondContact O-N 3.12Å; D385-I388 PolarHBondContact O-N 3.41Å; D385-I388 VanDerWaalsContact O-N 3.14Å; D385-E389 PolarHBondContact O-N 3.31Å; D385-E389 VanDerWaalsContact O-N 3.14Å
386	Y	85.7	Confident	86.8	Confident	40 Å²	40	47.6 Å²	47.6	16%	0.157	23%	0.227	C	C	.	.	H	α-helix	trans	-53.4	-43.2	-179.8	164.3	-102.9	0	0	0	113.8	V383 L384 I388 E390 E391 R686	V383-Y386 WeakPolarHBondContact O-CB 3.47Å; V383-Y386 PolarHBondContact O-N 2.92Å; L384-Y386 PolarHBondContact O-N 3.02Å; Y386-I388 PolarHBondContact O-N 2.89Å; Y386-E390 HydrophobicContact CD2-CB 3.76Å; Y386-E390 HydrophobicContact CE2-CB 4.05Å; Y386-E390 PolarHBondContact O-N 3.1Å; Y386-E391 HydrophobicContact CE1-CB 4.49Å; Y386-E391 PolarHBondContact O-N 3.03Å; Y386-R686 HydrophobicContact CD2-CB 4.25Å; Y386-R686 HydrophobicContact CE1-CB 4.16Å; Y386-R686 HydrophobicContact CE2-CB 3.86Å
387	E	83.4	Confident	86.6	Confident	63 Å²	63	43.9 Å²	43.9	29%	0.294	21%	0.211	S	C	.	.	H	α-helix	trans	-64.1	-28.4	-177.7	-74.7	172.2	-149.5	0	0	113.1	D385 Q688	D385-E387 VanDerWaalsContact C-N 3.34Å; D385-E387 PolarHBondContact O-N 3.12Å; E387-Q688 HydrophobicContact CG-CG 4.08Å; E387-Q688 VanDerWaalsContact OE1-CG 3.27Å; E387-Q688 WeakPolarHBondContact OE1-CG 3.41Å; E387-Q688 PolarHBondContact OE1-NE2 3.45Å; E387-Q688 PolarHBondContact OE2-NE2 3.11Å
388	I	81.9	Confident	86.2	Confident	145 Å²	145	45.6 Å²	45.6	74%	0.744	22%	0.224	S	C	*	.	H	α-helix	trans	-90.7	-42.9	-176.3	-58.9	175.1	0	0	0	110.7	D385 Y386	D385-I388 PolarHBondContact O-N 3.41Å; D385-I388 VanDerWaalsContact O-N 3.14Å; Y386-I388 PolarHBondContact O-N 2.89Å
389	E	79.9	Confident	85.7	Confident	129 Å²	129	46.3 Å²	46.3	60%	0.603	23%	0.229	S	C	*	.	H	α-helix	trans	-91.9	-32.6	-170.4	-63.6	-170.9	168.5	0	0	113.7	D385	D385-E389 PolarHBondContact O-N 3.31Å; D385-E389 VanDerWaalsContact O-N 3.14Å
390	E	80.8	Confident	85.5	Confident	23 Å²	23	50.5 Å²	50.5	11%	0.107	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.7	-18.6	-161.9	-63.5	178	-178.7	0	0	114.6	N114 R116 Y386 R392 R686	N114-E390 HydrophobicContact CB-CG 4.35Å; R116-E390 IonicContact CZ-OE1 3.42Å; R116-E390 IonicContact NE-OE1 3.94Å; R116-E390 PolarHBondContact NE-OE1 3.35Å; R116-E390 VanDerWaalsContact NE-OE1 3.08Å; R116-E390 IonicContact NH2-OE1 3.62Å; R116-E390 PolarHBondContact NH2-OE1 3.45Å; Y386-E390 HydrophobicContact CD2-CB 3.76Å; Y386-E390 HydrophobicContact CE2-CB 4.05Å; Y386-E390 PolarHBondContact O-N 3.1Å; E390-R392 PolarHBondContact O-N 3.35Å; E390-R686 IonicContact OE2-CZ 2.59Å; E390-R686 IonicContact OE2-NH1 3.56Å; E390-R686 PolarHBondContact OE2-NH1 2.79Å; E390-R686 IonicContact OE2-NH2 2.71Å; E390-R686 PolarHBondContact OE2-NH2 3.46Å
391	E	86.4	Confident	85.4	Confident	36 Å²	36	49.4 Å²	49.4	17%	0.168	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-71.3	123.2	-175.3	-166.5	178.2	-155.3	0	0	112.9	Y386 T506 Q507 S508	Y386-E391 HydrophobicContact CE1-CB 4.49Å; Y386-E391 PolarHBondContact O-N 3.03Å; E391-T506 HydrophobicContact CG-CG2 4.19Å; E391-T506 WeakPolarHBondContact OE1-CB 3.16Å; E391-T506 WeakPolarHBondContact OE2-CB 3.28Å; E391-T506 PolarHBondContact OE2-OG1 3.27Å; E391-Q507 PolarHBondContact OE1-N 3Å; E391-S508 VanDerWaalsContact CD-OG 3.28Å; E391-S508 VanDerWaalsContact OE1-CB 3.25Å; E391-S508 WeakPolarHBondContact OE1-CB 3.49Å; E391-S508 PolarHBondContact OE1-N 2.82Å; E391-S508 PolarHBondContact OE1-OG 3.12Å; E391-S508 PolarHBondContact OE2-OG 3.36Å
392	R	86.6	Confident	85	Confident	108 Å²	108	55.6 Å²	55.6	41%	0.408	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-91.3	157.4	179.1	-68.8	-178	-58.3	151.6	20.4	112.5	D188 E390 R394	D188-R392 IonicContact OD1-CZ 3.02Å; D188-R392 VanDerWaalsContact OD1-CZ 3.28Å; D188-R392 IonicContact OD1-NH1 3.31Å; D188-R392 PolarHBondContact OD1-NH1 3.4Å; D188-R392 VanDerWaalsContact OD1-NH1 3.1Å; D188-R392 IonicContact OD1-NH2 2.75Å; D188-R392 PolarHBondContact OD1-NH2 3.18Å; D188-R392 IonicContact OD2-CZ 2.86Å; D188-R392 IonicContact OD2-NH1 2.64Å; D188-R392 PolarHBondContact OD2-NH1 2.94Å; D188-R392 IonicContact OD2-NH2 3.71Å; D188-R392 PolarHBondContact OD2-NH2 2.7Å; E390-R392 PolarHBondContact O-N 3.35Å; R392-R394 PolarHBondContact O-N 3.02Å
393	P	88.5	Confident	84.8	Confident	31 Å²	31	58.2 Å²	58.2	20%	0.201	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-58.1	138.4	171.5	-21.8	32.5	0	0	0	111.7	Y397 R505	P393-Y397 HydrophobicContact CB-CD1 4.26Å; P393-R505 CarbonylContact C-O 3.57Å; P393-R505 WeakPolarHBondContact CA-O 3.33Å; P393-R505 HydrophobicContact CB-CG 4.3Å
394	R	89.9	Confident	84.7	Confident	29 Å²	29	64.5 Å²	64.5	11%	0.109	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-58.5	137.4	179.3	-175	-176.6	-179.6	-174.3	6.6	110.4	R392 Q396 Y397 S398 R505 F510	R392-R394 PolarHBondContact O-N 3.02Å; R394-Q396 VanDerWaalsContact C-N 3.29Å; R394-Q396 HydrophobicContact CG-CB 4.38Å; R394-Q396 PolarHBondContact O-N 2.86Å; R394-Y397 WeakPolarHBondContact O-CA 3.42Å; R394-Y397 WeakPolarHBondContact O-CB 3.19Å; R394-Y397 PolarHBondContact O-N 3.19Å; R394-S398 PolarHBondContact O-N 3.36Å; R394-S398 PolarHBondContact O-OG 2.93Å; R394-R505 PolarHBondContact N-O 3.36Å; R394-F510 VanDerWaalsContact NH1-CD2 3.28Å
395	P	84.5	Confident	84.8	Confident	46 Å²	46	63.3 Å²	63.3	30%	0.299	32%	0.318	S	S	.	.	H	α-helix	trans	-54.7	-41.1	179.9	-28	34.8	0	0	0	113.9	A191 Y397 S398 A399	A191-P395 HydrophobicContact CB-CB 4.35Å; A191-P395 HydrophobicContact CB-CG 3.91Å; P395-Y397 VanDerWaalsContact C-N 3.35Å; P395-Y397 PolarHBondContact O-N 3.37Å; P395-S398 PolarHBondContact O-N 3.42Å; P395-A399 WeakPolarHBondContact O-CB 3.4Å; P395-A399 PolarHBondContact O-N 3.32Å
396	Q	83.7	Confident	85.1	Confident	40 Å²	40	66.5 Å²	66.5	19%	0.187	33%	0.329	C	S	.	.	H	α-helix	trans	-63.5	-39.4	176.2	-62.5	179.7	9	0	0	112.2	R394 A399 H400	R394-Q396 VanDerWaalsContact C-N 3.29Å; R394-Q396 HydrophobicContact CG-CB 4.38Å; R394-Q396 PolarHBondContact O-N 2.86Å; Q396-A399 PolarHBondContact O-N 3.1Å; Q396-H400 PolarHBondContact O-CD2 3.09Å; Q396-H400 PolarHBondContact O-N 2.93Å; Q396-H400 VanDerWaalsContact O-N 3.13Å
397	Y	87	Confident	85.1	Confident	9 Å²	9	65.5 Å²	65.5	4%	0.035	33%	0.327	C	S	.	.	H	α-helix	trans	-63	-48	176	175.3	-94.2	0	0	0	110.5	P393 R394 P395 A399 H400 C401 P415 F417 R422 M503 H504 R505	P393-Y397 HydrophobicContact CB-CD1 4.26Å; R394-Y397 WeakPolarHBondContact O-CA 3.42Å; R394-Y397 WeakPolarHBondContact O-CB 3.19Å; R394-Y397 PolarHBondContact O-N 3.19Å; P395-Y397 VanDerWaalsContact C-N 3.35Å; P395-Y397 PolarHBondContact O-N 3.37Å; Y397-A399 VanDerWaalsContact C-N 3.3Å; Y397-A399 PolarHBondContact O-N 2.88Å; Y397-H400 PolarHBondContact O-N 3.49Å; Y397-C401 PolarHBondContact O-N 3.37Å; Y397-C401 VanDerWaalsContact O-N 3.1Å; Y397-C401 PolarHBondContact O-SG 3.26Å; Y397-P415 HydrophobicContact CE1-CB 4.4Å; Y397-P415 WeakPolarHBondContact CE1-O 3.19Å; Y397-F417 HydrophobicContact CE2-CB 3.9Å; Y397-F417 WeakPolarHBondContact OH-CB 3.13Å; Y397-F417 PolarHBondContact OH-N 3.37Å; Y397-F417 VanDerWaalsContact OH-N 3.09Å; Y397-R422 VanDerWaalsContact CE2-NH2 3.32Å; Y397-R422 PolarHBondContact OH-NH2 3Å; Y397-M503 HydrophobicContact CD2-CB 4.35Å; Y397-M503 HydrophobicContact CD2-CE 3.82Å; Y397-M503 HydrophobicContact CE2-CB 4.39Å; Y397-M503 HydrophobicContact CE2-CE 4.34Å; Y397-M503 VanDerWaalsContact CE2-O 3.29Å; Y397-M503 WeakPolarHBondContact CE2-O 3.38Å; Y397-M503 HydrophobicContact CG-CE 4.49Å; Y397-H504 WeakPolarHBondContact CD2-O 3.26Å; Y397-R505 HydrophobicContact CD1-CG 4.38Å; Y397-R505 HydrophobicContact CE1-CB 4.27Å; Y397-R505 HydrophobicContact CE1-CG 4.02Å
398	S	84.3	Confident	85.4	Confident	39 Å²	39	68.5 Å²	68.5	27%	0.273	35%	0.352	S	S	.	.	H	α-helix	trans	-61.4	-36	177.5	-59.5	0	0	0	0	113	R394 P395	R394-S398 PolarHBondContact O-N 3.36Å; R394-S398 PolarHBondContact O-OG 2.93Å; P395-S398 PolarHBondContact O-N 3.42Å
399	A	82.8	Confident	85.5	Confident	18 Å²	18	68.9 Å²	68.9	15%	0.149	35%	0.354	C	S	.	.	H	α-helix	trans	-72.7	-34.1	179.6	0	0	0	0	0	113.3	A201 V203 P395 Q396 Y397	A201-A399 HydrophobicContact CB-CB 3.81Å; A201-A399 VanDerWaalsContact CB-O 3.23Å; A201-A399 WeakPolarHBondContact CB-O 3.36Å; V203-A399 HydrophobicContact CB-CB 4.2Å; V203-A399 HydrophobicContact CG2-CB 4.42Å; P395-A399 WeakPolarHBondContact O-CB 3.4Å; P395-A399 PolarHBondContact O-N 3.32Å; Q396-A399 PolarHBondContact O-N 3.1Å; Y397-A399 VanDerWaalsContact C-N 3.3Å; Y397-A399 PolarHBondContact O-N 2.88Å
400	H	83.9	Confident	85.7	Confident	108 Å²	108	66.3 Å²	66.3	50%	0.5	35%	0.347	S	S	.	.	H	α-helix	trans	-90.4	-15.8	-177.6	-74.6	-61.3	0	0	0	114.4	Q396 Y397 M503	Q396-H400 PolarHBondContact O-CD2 3.09Å; Q396-H400 PolarHBondContact O-N 2.93Å; Q396-H400 VanDerWaalsContact O-N 3.13Å; Y397-H400 PolarHBondContact O-N 3.49Å; H400-M503 HydrophobicContact CB-CE 3.44Å; H400-M503 VanDerWaalsContact CB-CE 3.44Å; H400-M503 HydrophobicContact CB-SD 4.04Å
401	C	85.6	Confident	86	Confident	10 Å²	10	70.1 Å²	70.1	7%	0.068	37%	0.368	C	S	.	.			trans	-75	126.9	176.9	-73.2	0	0	0	0	111.2	Y397 P415	Y397-C401 PolarHBondContact O-N 3.37Å; Y397-C401 VanDerWaalsContact O-N 3.1Å; Y397-C401 PolarHBondContact O-SG 3.26Å; C401-P415 HydrophobicContact CB-CB 3.75Å
402	T	80.7	Confident	86	Confident	131 Å²	131	72.3 Å²	72.3	80%	0.804	38%	0.384	S	S	*	.			trans	-92.7	-19.9	175.5	54.3	0	0	0	0	113.2
403	Q	85.2	Confident	86.1	Confident	100 Å²	100	72.5 Å²	72.5	47%	0.467	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	150.1	-177.7	-63.2	179.5	-0.5	0	0	110.8	Y416	Q403-Y416 PolarHBondContact O-N 3.49Å
404	Y	87.5	Confident	86.1	Confident	132 Å²	132	72.6 Å²	72.6	52%	0.518	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	141.4	174.9	-71.6	-97.5	0	0	0	109.5	L413 E414 P415	Y404-L413 HydrophobicContact CD1-CD2 4.21Å; Y404-L413 HydrophobicContact CD1-CG 4.22Å; Y404-L413 HydrophobicContact CG-CD2 4.24Å; Y404-L413 HydrophobicContact CG-CG 4.38Å; Y404-E414 CarbonylContact C-O 3.53Å; Y404-E414 VanDerWaalsContact CA-O 3.29Å; Y404-E414 WeakPolarHBondContact CA-O 3.44Å; Y404-P415 HydrophobicContact CD1-CG 4.41Å; Y404-P415 HydrophobicContact CE1-CG 3.93Å
405	A	88.8	Confident	86	Confident	34 Å²	34	72.2 Å²	72.2	28%	0.281	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	149.5	175.1	0	0	0	0	0	110.2	N407 E414 Y416	A405-N407 PolarHBondContact O-N 2.85Å; A405-E414 PolarHBondContact N-O 2.79Å; A405-E414 PolarHBondContact O-N 3.1Å; A405-Y416 HydrophobicContact CB-CD1 4.07Å; A405-Y416 HydrophobicContact CB-CD2 4.1Å; A405-Y416 HydrophobicContact CB-CG 3.65Å
406	K	89.6	Confident	86.2	Confident	125 Å²	125	74.9 Å²	74.9	54%	0.543	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	123.9	176.5	-157.9	-177.8	-161.3	-157.3	0	109.3	D411	K406-D411 WeakPolarHBondContact CD-OD1 3.33Å; K406-D411 WeakPolarHBondContact CE-O 3.44Å; K406-D411 WeakPolarHBondContact CE-OD1 3.31Å; K406-D411 VanDerWaalsContact CE-OD2 3.29Å; K406-D411 WeakPolarHBondContact CE-OD2 3.42Å; K406-D411 IonicContact NZ-OD1 3.88Å; K406-D411 PolarHBondContact NZ-OD1 2.73Å; K406-D411 IonicContact NZ-OD2 3.93Å; K406-D411 PolarHBondContact NZ-OD2 2.71Å
407	N	86.3	Confident	86.6	Confident	20 Å²	20	74.2 Å²	74.2	11%	0.107	39%	0.392	C	S	.	.			trans	-70.3	125.9	175.9	179	-16.5	0	0	0	109.2	A405 I409 T410 D411 V412 E414 R505	A405-N407 PolarHBondContact O-N 2.85Å; N407-I409 PolarHBondContact O-N 3.13Å; N407-I409 PolarHBondContact OD1-N 3.36Å; N407-T410 VanDerWaalsContact CB-OG1 3.29Å; N407-T410 WeakPolarHBondContact CB-OG1 3.28Å; N407-T410 VanDerWaalsContact CG-OG1 3.25Å; N407-T410 PolarHBondContact ND2-OG1 3.11Å; N407-T410 VanDerWaalsContact ND2-OG1 3.15Å; N407-D411 WeakPolarHBondContact O-CA 3.37Å; N407-D411 PolarHBondContact O-N 3.32Å; N407-V412 PolarHBondContact N-O 3.38Å; N407-E414 HydrophobicContact CB-CG 4.43Å; N407-E414 WeakPolarHBondContact CB-OE1 3.47Å; N407-E414 PolarHBondContact ND2-OE1 3.25Å; N407-R505 PolarHBondContact ND2-NH2 2.85Å
408	P	89.1	Confident	86.8	Confident	125 Å²	125	75.7 Å²	75.7	81%	0.812	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-16.1	-177.6	27.5	-36	0	0	0	114.3
409	I	84.5	Confident	87	Confident	154 Å²	154	77 Å²	77	79%	0.79	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-52.7	-178	-57.6	172.6	0	0	0	110.6	N407	N407-I409 PolarHBondContact O-N 3.13Å; N407-I409 PolarHBondContact OD1-N 3.36Å
410	T	83.2	Confident	87.4	Confident	75 Å²	75	87 Å²	87	46%	0.46	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-14.6	-176.2	56.4	0	0	0	0	113.2	N407 V412 E414	N407-T410 VanDerWaalsContact CB-OG1 3.29Å; N407-T410 WeakPolarHBondContact CB-OG1 3.28Å; N407-T410 VanDerWaalsContact CG-OG1 3.25Å; N407-T410 PolarHBondContact ND2-OG1 3.11Å; N407-T410 VanDerWaalsContact ND2-OG1 3.15Å; T410-V412 PolarHBondContact O-N 2.86Å; T410-V412 VanDerWaalsContact O-N 3.17Å; T410-E414 PolarHBondContact OG1-OE1 3.44Å
411	D	87.1	Confident	87.8	Confident	102 Å²	102	83.8 Å²	83.8	55%	0.545	44%	0.437	S	S	.	.			trans	61.1	14.1	-173	-147.7	43.8	0	0	0	114	K406 N407	K406-D411 WeakPolarHBondContact CD-OD1 3.33Å; K406-D411 WeakPolarHBondContact CE-O 3.44Å; K406-D411 WeakPolarHBondContact CE-OD1 3.31Å; K406-D411 VanDerWaalsContact CE-OD2 3.29Å; K406-D411 WeakPolarHBondContact CE-OD2 3.42Å; K406-D411 IonicContact NZ-OD1 3.88Å; K406-D411 PolarHBondContact NZ-OD1 2.73Å; K406-D411 IonicContact NZ-OD2 3.93Å; K406-D411 PolarHBondContact NZ-OD2 2.71Å; N407-D411 WeakPolarHBondContact O-CA 3.37Å; N407-D411 PolarHBondContact O-N 3.32Å
412	V	86.9	Confident	88.1	Confident	83 Å²	83	85.6 Å²	85.6	50%	0.503	44%	0.442	S	S	.	.			trans	-94.1	144.7	179.9	179	0	0	0	0	110.6	N407 T410 E414	N407-V412 PolarHBondContact N-O 3.38Å; T410-V412 PolarHBondContact O-N 2.86Å; T410-V412 VanDerWaalsContact O-N 3.17Å; V412-E414 PolarHBondContact O-N 3.36Å
413	L	89.8	Confident	88.7	Confident	112 Å²	112	83.1 Å²	83.1	59%	0.586	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	117.5	172.8	-172	79	0	0	0	110	Y404	Y404-L413 HydrophobicContact CD1-CD2 4.21Å; Y404-L413 HydrophobicContact CD1-CG 4.22Å; Y404-L413 HydrophobicContact CG-CD2 4.24Å; Y404-L413 HydrophobicContact CG-CG 4.38Å
414	E	87.2	Confident	89.2	Confident	33 Å²	33	81.2 Å²	81.2	15%	0.154	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	154.9	-176.7	-69.4	-178.6	-148.1	0	0	112.3	Y404 A405 N407 T410 V412 Y416 R505	Y404-E414 CarbonylContact C-O 3.53Å; Y404-E414 VanDerWaalsContact CA-O 3.29Å; Y404-E414 WeakPolarHBondContact CA-O 3.44Å; A405-E414 PolarHBondContact N-O 2.79Å; A405-E414 PolarHBondContact O-N 3.1Å; N407-E414 HydrophobicContact CB-CG 4.43Å; N407-E414 WeakPolarHBondContact CB-OE1 3.47Å; N407-E414 PolarHBondContact ND2-OE1 3.25Å; T410-E414 PolarHBondContact OG1-OE1 3.44Å; V412-E414 PolarHBondContact O-N 3.36Å; E414-Y416 PolarHBondContact O-N 3.13Å; E414-R505 IonicContact OE1-NH2 3.12Å; E414-R505 IonicContact OE2-CZ 3.9Å; E414-R505 IonicContact OE2-NE 3.74Å; E414-R505 IonicContact OE2-NH2 3.46Å; E414-R505 PolarHBondContact OE2-NH2 3.06Å
415	P	88.1	Confident	89.5	Confident	21 Å²	21	78.1 Å²	78.1	14%	0.136	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	129.3	172.6	-21.3	32.2	0	0	0	111.4	Y397 C401 Y404	Y397-P415 HydrophobicContact CE1-CB 4.4Å; Y397-P415 WeakPolarHBondContact CE1-O 3.19Å; C401-P415 HydrophobicContact CB-CB 3.75Å; Y404-P415 HydrophobicContact CD1-CG 4.41Å; Y404-P415 HydrophobicContact CE1-CG 3.93Å
416	Y	89.4	Confident	89.7	Confident	101 Å²	101	78.5 Å²	78.5	40%	0.396	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	134.7	-173.2	176	-101.8	0	0	0	111.1	Q403 A405 E414 P419	Q403-Y416 PolarHBondContact O-N 3.49Å; A405-Y416 HydrophobicContact CB-CD1 4.07Å; A405-Y416 HydrophobicContact CB-CD2 4.1Å; A405-Y416 HydrophobicContact CB-CG 3.65Å; E414-Y416 PolarHBondContact O-N 3.13Å; Y416-P419 WeakPolarHBondContact OH-CD 3.36Å
417	F	90.8	Very high	90	Very high	26 Å²	26	77.1 Å²	77.1	11%	0.114	41%	0.41	C	S	.	.			trans	-114.4	127.6	174.7	-170.8	-101.8	0	0	0	109.8	Y397 A421 R422 M503	Y397-F417 HydrophobicContact CE2-CB 3.9Å; Y397-F417 WeakPolarHBondContact OH-CB 3.13Å; Y397-F417 PolarHBondContact OH-N 3.37Å; Y397-F417 VanDerWaalsContact OH-N 3.09Å; F417-A421 HydrophobicContact CE1-CB 3.97Å; F417-A421 HydrophobicContact CZ-CB 3.88Å; F417-R422 HydrophobicContact CD1-CB 3.86Å; F417-R422 HydrophobicContact CE1-CB 3.83Å; F417-M503 HydrophobicContact CD1-CB 4.23Å; F417-M503 HydrophobicContact CE1-CB 4.4Å; F417-M503 HydrophobicContact CG-CB 4.34Å
418	P	91	Very high	90.3	Very high	41 Å²	41	78.2 Å²	78.2	27%	0.266	42%	0.421	S	S	.	.			trans	-63.3	127.8	-172.8	22.2	-32	0	0	0	111.6	R420 A421 R422	P418-R420 VanDerWaalsContact C-N 3.28Å; P418-R420 PolarHBondContact O-N 2.88Å; P418-A421 HydrophobicContact CG-CB 4.04Å; P418-A421 PolarHBondContact O-N 3.47Å; P418-A421 VanDerWaalsContact O-N 3.13Å; P418-R422 PolarHBondContact O-N 2.9Å; P418-R422 VanDerWaalsContact O-N 3.15Å
419	P	89.5	Confident	90.5	Very high	67 Å²	67	72.3 Å²	72.3	44%	0.435	38%	0.384	S	S	.	.	H	α-helix	trans	-62.8	-33.7	-172.4	22.1	-33.7	0	0	0	112.2	Y416 A421 R422 V423	Y416-P419 WeakPolarHBondContact OH-CD 3.36Å; P419-A421 VanDerWaalsContact C-N 3.35Å; P419-A421 PolarHBondContact O-N 2.84Å; P419-R422 WeakPolarHBondContact O-CB 3.13Å; P419-R422 PolarHBondContact O-N 3.37Å; P419-R422 VanDerWaalsContact O-N 3.15Å; P419-V423 VanDerWaalsContact O-CG2 3.3Å; P419-V423 WeakPolarHBondContact O-CG2 3.37Å; P419-V423 PolarHBondContact O-N 3.1Å
420	R	91.9	Very high	90.8	Very high	228 Å²	228	69.6 Å²	69.6	86%	0.86	37%	0.37	S	S	*	.	H	α-helix	trans	-60.6	-42.7	177.3	-65.8	-176.6	-176.9	169.8	1.1	112.4	P418 R422 A424	P418-R420 VanDerWaalsContact C-N 3.28Å; P418-R420 PolarHBondContact O-N 2.88Å; R420-R422 VanDerWaalsContact C-N 3.35Å; R420-A424 PolarHBondContact O-N 3.23Å; R420-A424 VanDerWaalsContact O-N 3.15Å
421	A	92.4	Very high	91.3	Very high	39 Å²	39	71 Å²	71	32%	0.322	37%	0.373	S	S	.	.	H	α-helix	trans	-68	-38.9	176	0	0	0	0	0	110.8	F417 P418 P419 A424 R425	F417-A421 HydrophobicContact CE1-CB 3.97Å; F417-A421 HydrophobicContact CZ-CB 3.88Å; P418-A421 HydrophobicContact CG-CB 4.04Å; P418-A421 PolarHBondContact O-N 3.47Å; P418-A421 VanDerWaalsContact O-N 3.13Å; P419-A421 VanDerWaalsContact C-N 3.35Å; P419-A421 PolarHBondContact O-N 2.84Å; A421-A424 PolarHBondContact O-N 3.36Å; A421-R425 WeakPolarHBondContact O-CG 3.32Å; A421-R425 PolarHBondContact O-N 3.07Å; A421-R425 VanDerWaalsContact O-N 3.13Å
422	R	91.9	Very high	91.6	Very high	48 Å²	48	68 Å²	68	18%	0.181	36%	0.36	C	S	.	.	H	α-helix	trans	-60.4	-50.5	175.5	-172	179	-74.3	156.4	-0.7	111.6	Y397 F417 P418 P419 R420 A424 R425 I426 E502 M503	Y397-R422 VanDerWaalsContact CE2-NH2 3.32Å; Y397-R422 PolarHBondContact OH-NH2 3Å; F417-R422 HydrophobicContact CD1-CB 3.86Å; F417-R422 HydrophobicContact CE1-CB 3.83Å; P418-R422 PolarHBondContact O-N 2.9Å; P418-R422 VanDerWaalsContact O-N 3.15Å; P419-R422 WeakPolarHBondContact O-CB 3.13Å; P419-R422 PolarHBondContact O-N 3.37Å; P419-R422 VanDerWaalsContact O-N 3.15Å; R420-R422 VanDerWaalsContact C-N 3.35Å; R422-A424 VanDerWaalsContact C-N 3.3Å; R422-A424 PolarHBondContact O-N 2.85Å; R422-R425 WeakPolarHBondContact O-CB 3.31Å; R422-R425 PolarHBondContact O-N 3.39Å; R422-R425 VanDerWaalsContact O-N 3.07Å; R422-I426 HydrophobicContact CG-CD1 3.84Å; R422-I426 HydrophobicContact CG-CG1 4.36Å; R422-I426 WeakPolarHBondContact O-CG1 3.36Å; R422-I426 PolarHBondContact O-N 3.46Å; R422-E502 WeakPolarHBondContact CG-O 3.3Å; R422-M503 PolarHBondContact NE-O 2.98Å; R422-M503 VanDerWaalsContact NE-O 3.09Å; R422-M503 PolarHBondContact NH2-O 3.27Å
423	V	92.9	Very high	91.8	Very high	79 Å²	79	64.3 Å²	64.3	48%	0.479	34%	0.338	S	S	.	.	H	α-helix	trans	-58.6	-42.8	179.3	173.4	0	0	0	0	111	P419 R425 I426 I427	P419-V423 VanDerWaalsContact O-CG2 3.3Å; P419-V423 WeakPolarHBondContact O-CG2 3.37Å; P419-V423 PolarHBondContact O-N 3.1Å; V423-R425 VanDerWaalsContact C-N 3.32Å; V423-R425 PolarHBondContact O-N 3.12Å; V423-I426 PolarHBondContact O-N 3.2Å; V423-I427 HydrophobicContact CG1-CD1 3.8Å; V423-I427 HydrophobicContact CG1-CG1 4.32Å; V423-I427 VanDerWaalsContact O-CG1 3.31Å; V423-I427 WeakPolarHBondContact O-CG1 3.4Å; V423-I427 PolarHBondContact O-N 3.13Å
424	A	94.9	Very high	91.9	Very high	60 Å²	60	63.7 Å²	63.7	50%	0.496	33%	0.333	S	S	.	.	H	α-helix	trans	-59.8	-40.8	175.6	0	0	0	0	0	112.5	R420 A421 R422 A428	R420-A424 PolarHBondContact O-N 3.23Å; R420-A424 VanDerWaalsContact O-N 3.15Å; A421-A424 PolarHBondContact O-N 3.36Å; R422-A424 VanDerWaalsContact C-N 3.3Å; R422-A424 PolarHBondContact O-N 2.85Å; A424-A428 PolarHBondContact O-N 2.94Å; A424-A428 VanDerWaalsContact O-N 3.1Å
425	R	95.1	Very high	92.3	Very high	68 Å²	68	66.5 Å²	66.5	26%	0.257	35%	0.352	S	S	.	.	H	α-helix	trans	-67.3	-41.1	175.1	-65.3	-171.7	-172	178.2	2.1	112.5	A421 R422 V423 A428 G429 W501	A421-R425 WeakPolarHBondContact O-CG 3.32Å; A421-R425 PolarHBondContact O-N 3.07Å; A421-R425 VanDerWaalsContact O-N 3.13Å; R422-R425 WeakPolarHBondContact O-CB 3.31Å; R422-R425 PolarHBondContact O-N 3.39Å; R422-R425 VanDerWaalsContact O-N 3.07Å; V423-R425 VanDerWaalsContact C-N 3.32Å; V423-R425 PolarHBondContact O-N 3.12Å; R425-A428 PolarHBondContact O-N 3.28Å; R425-G429 PolarHBondContact O-N 2.83Å; R425-W501 HydrophobicContact CB-CD2 4.29Å; R425-W501 HydrophobicContact CB-CE3 3.84Å; R425-W501 HydrophobicContact CB-CH2 3.94Å; R425-W501 HydrophobicContact CB-CZ2 4.36Å; R425-W501 HydrophobicContact CB-CZ3 3.66Å; R425-W501 WeakPolarHBondContact CD-O 3.31Å; R425-W501 HydrophobicContact CG-CD2 4.13Å; R425-W501 HydrophobicContact CG-CE3 4.12Å; R425-W501 HydrophobicContact CG-CH2 3.69Å; R425-W501 HydrophobicContact CG-CZ2 3.67Å; R425-W501 HydrophobicContact CG-CZ3 3.91Å; R425-W501 PolarHBondContact NH1-O 3.12Å; R425-W501 WeakPolarHBondContact O-CZ3 3.37Å
426	I	93	Very high	92.5	Very high	42 Å²	42	66.6 Å²	66.6	22%	0.215	35%	0.352	C	S	.	.	H	α-helix	trans	-62.6	-42.8	176.4	-68.5	169.9	0	0	0	110.8	R422 V423 G429 L430 E502	R422-I426 HydrophobicContact CG-CD1 3.84Å; R422-I426 HydrophobicContact CG-CG1 4.36Å; R422-I426 WeakPolarHBondContact O-CG1 3.36Å; R422-I426 PolarHBondContact O-N 3.46Å; V423-I426 PolarHBondContact O-N 3.2Å; I426-G429 CarbonylContact O-C 3.43Å; I426-G429 WeakPolarHBondContact O-CA 3.45Å; I426-G429 PolarHBondContact O-N 2.96Å; I426-G429 VanDerWaalsContact O-N 3.17Å; I426-L430 HydrophobicContact CG2-CD1 4.17Å; I426-L430 PolarHBondContact O-N 2.98Å; I426-E502 HydrophobicContact CG1-CB 4.35Å; I426-E502 HydrophobicContact CG1-CG 3.95Å
427	I	94.4	Very high	92.7	Very high	96 Å²	96	62.6 Å²	62.6	49%	0.492	34%	0.338	S	S	.	.	H	α-helix	trans	-62.2	-47	177.1	-68.8	167.5	0	0	0	110.5	V423 G429 L430 I431	V423-I427 HydrophobicContact CG1-CD1 3.8Å; V423-I427 HydrophobicContact CG1-CG1 4.32Å; V423-I427 VanDerWaalsContact O-CG1 3.31Å; V423-I427 WeakPolarHBondContact O-CG1 3.4Å; V423-I427 PolarHBondContact O-N 3.13Å; I427-G429 PolarHBondContact O-N 2.98Å; I427-L430 PolarHBondContact O-N 3.44Å; I427-I431 HydrophobicContact CG2-CD1 4.11Å; I427-I431 WeakPolarHBondContact O-CG1 3.33Å; I427-I431 PolarHBondContact O-N 2.85Å
428	A	94.1	Very high	92.8	Very high	42 Å²	42	66.2 Å²	66.2	35%	0.347	36%	0.356	S	S	.	.	H	α-helix	trans	-59.9	-38.1	174.5	0	0	0	0	0	111.7	A424 R425 I431 C432 W501	A424-A428 PolarHBondContact O-N 2.94Å; A424-A428 VanDerWaalsContact O-N 3.1Å; R425-A428 PolarHBondContact O-N 3.28Å; A428-I431 PolarHBondContact O-N 3.36Å; A428-C432 PolarHBondContact O-N 3.17Å; A428-C432 VanDerWaalsContact O-N 3.12Å; A428-W501 HydrophobicContact CB-CH2 4.02Å; A428-W501 HydrophobicContact CB-CZ3 3.88Å
429	G	92.5	Very high	92.9	Very high	2 Å²	2	67.4 Å²	67.4	2%	0.021	36%	0.36	C	S	.	.	H	α-helix	trans	-58.1	-51.2	171.8	0	0	0	0	0	112.2	R425 I426 I427 I431 C432 V433 M498	R425-G429 PolarHBondContact O-N 2.83Å; I426-G429 CarbonylContact O-C 3.43Å; I426-G429 WeakPolarHBondContact O-CA 3.45Å; I426-G429 PolarHBondContact O-N 2.96Å; I426-G429 VanDerWaalsContact O-N 3.17Å; I427-G429 PolarHBondContact O-N 2.98Å; G429-I431 VanDerWaalsContact C-N 3.35Å; G429-I431 PolarHBondContact O-N 2.78Å; G429-C432 WeakPolarHBondContact O-CB 3.45Å; G429-C432 PolarHBondContact O-N 2.64Å; G429-C432 VanDerWaalsContact O-N 3.17Å; G429-V433 WeakPolarHBondContact O-CG2 3.46Å; G429-V433 PolarHBondContact O-N 3.23Å; G429-M498 WeakPolarHBondContact O-CE 3.32Å
430	L	90.9	Very high	93	Very high	96 Å²	96	64.3 Å²	64.3	50%	0.503	34%	0.34	S	S	.	.	H	α-helix	trans	-59.1	-42	177.8	-116.4	104.9	0	0	0	112.6	I426 I427 C432 V433 M434	I426-L430 HydrophobicContact CG2-CD1 4.17Å; I426-L430 PolarHBondContact O-N 2.98Å; I427-L430 PolarHBondContact O-N 3.44Å; L430-C432 VanDerWaalsContact C-N 3.31Å; L430-C432 PolarHBondContact O-N 3.34Å; L430-V433 WeakPolarHBondContact O-CB 3.5Å; L430-V433 PolarHBondContact O-N 3.39Å; L430-M434 WeakPolarHBondContact O-CG 3.41Å; L430-M434 PolarHBondContact O-N 3.06Å
431	I	94.1	Very high	93	Very high	104 Å²	104	56.8 Å²	56.8	53%	0.533	32%	0.316	S	S	.	.	H	α-helix	trans	-59.9	-44.6	176.6	-67.6	166.9	0	0	0	110.3	I427 A428 G429 V433 M434 V435	I427-I431 HydrophobicContact CG2-CD1 4.11Å; I427-I431 WeakPolarHBondContact O-CG1 3.33Å; I427-I431 PolarHBondContact O-N 2.85Å; A428-I431 PolarHBondContact O-N 3.36Å; G429-I431 VanDerWaalsContact C-N 3.35Å; G429-I431 PolarHBondContact O-N 2.78Å; I431-V433 VanDerWaalsContact C-N 3.33Å; I431-V433 PolarHBondContact O-N 3.17Å; I431-M434 PolarHBondContact O-N 2.97Å; I431-V435 WeakPolarHBondContact O-CG2 3.43Å; I431-V435 PolarHBondContact O-N 2.91Å
432	C	92.9	Very high	93	Very high	40 Å²	40	59.2 Å²	59.2	27%	0.27	33%	0.327	S	S	.	.	H	α-helix	trans	-62	-40.2	176.8	-175.1	0	0	0	0	111.9	A428 G429 L430 M434 V435 M436 M498	A428-C432 PolarHBondContact O-N 3.17Å; A428-C432 VanDerWaalsContact O-N 3.12Å; G429-C432 WeakPolarHBondContact O-CB 3.45Å; G429-C432 PolarHBondContact O-N 2.64Å; G429-C432 VanDerWaalsContact O-N 3.17Å; L430-C432 VanDerWaalsContact C-N 3.31Å; L430-C432 PolarHBondContact O-N 3.34Å; C432-M434 PolarHBondContact O-N 3.42Å; C432-V435 PolarHBondContact O-N 3.39Å; C432-M436 WeakPolarHBondContact O-CG 3.4Å; C432-M436 PolarHBondContact O-N 3.06Å; C432-M436 VanDerWaalsContact O-N 3.09Å; C432-M498 HydrophobicContact CB-CE 3.68Å; C432-M498 HydrophobicContact CB-SD 4.13Å; C432-M498 VanDerWaalsContact SG-SD 3.68Å
433	V	91.5	Very high	92.9	Very high	6 Å²	6	60.2 Å²	60.2	4%	0.036	33%	0.332	C	S	.	.	H	α-helix	trans	-60.5	-45.5	173.2	179.8	0	0	0	0	111.5	G429 L430 I431 V435 M436 V437 Y491 M498 K517 L520	G429-V433 WeakPolarHBondContact O-CG2 3.46Å; G429-V433 PolarHBondContact O-N 3.23Å; L430-V433 WeakPolarHBondContact O-CB 3.5Å; L430-V433 PolarHBondContact O-N 3.39Å; I431-V433 VanDerWaalsContact C-N 3.33Å; I431-V433 PolarHBondContact O-N 3.17Å; V433-V435 VanDerWaalsContact C-N 3.34Å; V433-V435 PolarHBondContact O-N 3.13Å; V433-M436 PolarHBondContact O-N 3.2Å; V433-V437 HydrophobicContact CG1-CG2 4.35Å; V433-V437 WeakPolarHBondContact O-CG2 3.31Å; V433-V437 PolarHBondContact O-N 2.88Å; V433-Y491 VanDerWaalsContact CG1-OH 3.32Å; V433-Y491 WeakPolarHBondContact CG1-OH 3.4Å; V433-Y491 WeakPolarHBondContact CG2-OH 3.01Å; V433-M498 HydrophobicContact CG2-CE 3.82Å; V433-K517 HydrophobicContact CG2-CD 4.11Å; V433-K517 HydrophobicContact CG2-CG 4.24Å; V433-L520 HydrophobicContact CG1-CD2 3.94Å
434	M	92.5	Very high	92.6	Very high	99 Å²	99	57.2 Å²	57.2	49%	0.488	31%	0.314	S	S	.	.	H	α-helix	trans	-62.2	-40.1	178.8	-67.9	-62.5	-77.4	0	0	112.2	L430 I431 C432 M436 V437 M438	L430-M434 WeakPolarHBondContact O-CG 3.41Å; L430-M434 PolarHBondContact O-N 3.06Å; I431-M434 PolarHBondContact O-N 2.97Å; C432-M434 PolarHBondContact O-N 3.42Å; M434-M436 VanDerWaalsContact C-N 3.34Å; M434-M436 PolarHBondContact O-N 3.3Å; M434-V437 PolarHBondContact O-N 3Å; M434-M438 HydrophobicContact CE-CE 4.49Å; M434-M438 VanDerWaalsContact O-CG 3.32Å; M434-M438 WeakPolarHBondContact O-CG 3.49Å; M434-M438 PolarHBondContact O-N 3.47Å
435	V	94.5	Very high	92.3	Very high	91 Å²	91	58.3 Å²	58.3	55%	0.552	31%	0.31	S	S	*	.	H	α-helix	trans	-60.5	-44.5	174.5	171.5	0	0	0	0	111	I431 C432 V433 M438 L439	I431-V435 WeakPolarHBondContact O-CG2 3.43Å; I431-V435 PolarHBondContact O-N 2.91Å; C432-V435 PolarHBondContact O-N 3.39Å; V433-V435 VanDerWaalsContact C-N 3.34Å; V433-V435 PolarHBondContact O-N 3.13Å; V435-M438 PolarHBondContact O-N 2.98Å; V435-L439 PolarHBondContact O-N 2.82Å
436	M	93.2	Very high	92.1	Very high	24 Å²	24	57.4 Å²	57.4	12%	0.118	32%	0.317	C	S	.	.	H	α-helix	trans	-66.5	-36.7	177.9	-69.3	-59	-62.6	0	0	112.6	C432 V433 M434 L439 V440 Y491 L494 F521	C432-M436 WeakPolarHBondContact O-CG 3.4Å; C432-M436 PolarHBondContact O-N 3.06Å; C432-M436 VanDerWaalsContact O-N 3.09Å; V433-M436 PolarHBondContact O-N 3.2Å; M434-M436 VanDerWaalsContact C-N 3.34Å; M434-M436 PolarHBondContact O-N 3.3Å; M436-L439 HydrophobicContact CE-CD2 4.12Å; M436-L439 WeakPolarHBondContact O-CB 3.47Å; M436-L439 PolarHBondContact O-N 3.44Å; M436-L439 HydrophobicContact SD-CD2 4.22Å; M436-V440 PolarHBondContact O-N 2.85Å; M436-V440 VanDerWaalsContact O-N 3.16Å; M436-Y491 HydrophobicContact CB-CD2 3.82Å; M436-Y491 HydrophobicContact CB-CE2 3.84Å; M436-Y491 HydrophobicContact CE-CD2 4.24Å; M436-Y491 HydrophobicContact CG-CD2 3.91Å; M436-Y491 HydrophobicContact CG-CE2 4.06Å; M436-L494 HydrophobicContact CG-CD2 4.05Å; M436-L494 HydrophobicContact SD-CD2 4.23Å; M436-F521 HydrophobicContact CB-CD2 4.06Å; M436-F521 HydrophobicContact CB-CE2 3.98Å; M436-F521 HydrophobicContact CE-CE2 4.29Å
437	V	92.1	Very high	91.8	Very high	17 Å²	17	56.1 Å²	56.1	10%	0.103	31%	0.311	C	S	.	.	H	α-helix	trans	-63.4	-42.8	173.4	163.9	0	0	0	0	111.2	V433 M434 L439 V440 L441 V524	V433-V437 HydrophobicContact CG1-CG2 4.35Å; V433-V437 WeakPolarHBondContact O-CG2 3.31Å; V433-V437 PolarHBondContact O-N 2.88Å; M434-V437 PolarHBondContact O-N 3Å; V437-L439 VanDerWaalsContact C-N 3.3Å; V437-L439 PolarHBondContact O-N 2.89Å; V437-V440 WeakPolarHBondContact O-CB 3.25Å; V437-V440 PolarHBondContact O-N 3.02Å; V437-L441 PolarHBondContact O-N 3.35Å; V437-V524 HydrophobicContact CG1-CG1 4.12Å; V437-V524 HydrophobicContact CG1-CG2 4.09Å; V437-V524 HydrophobicContact CG2-CG2 4.3Å
438	M	93.3	Very high	91.3	Very high	101 Å²	101	53.1 Å²	53.1	50%	0.498	30%	0.296	S	S	.	.	H	α-helix	trans	-63.9	-37.5	175.6	-66.7	-61.1	150.5	0	0	112	M434 V435 V440 L441 V442	M434-M438 HydrophobicContact CE-CE 4.49Å; M434-M438 VanDerWaalsContact O-CG 3.32Å; M434-M438 WeakPolarHBondContact O-CG 3.49Å; M434-M438 PolarHBondContact O-N 3.47Å; V435-M438 PolarHBondContact O-N 2.98Å; M438-V440 VanDerWaalsContact C-N 3.31Å; M438-V440 PolarHBondContact O-N 3.25Å; M438-L441 PolarHBondContact O-N 2.74Å; M438-L441 HydrophobicContact SD-CD1 4.02Å; M438-V442 WeakPolarHBondContact O-CG2 3.42Å; M438-V442 PolarHBondContact O-N 3.34Å; M438-V442 VanDerWaalsContact O-N 3.08Å
439	L	93.5	Very high	90.9	Very high	67 Å²	67	54.2 Å²	54.2	35%	0.351	30%	0.295	S	S	.	.	H	α-helix	trans	-59.7	-40.9	175.1	-178.3	65	0	0	0	111.9	V435 M436 V437 L441 V442 F443 L487	V435-L439 PolarHBondContact O-N 2.82Å; M436-L439 HydrophobicContact CE-CD2 4.12Å; M436-L439 WeakPolarHBondContact O-CB 3.47Å; M436-L439 PolarHBondContact O-N 3.44Å; M436-L439 HydrophobicContact SD-CD2 4.22Å; V437-L439 VanDerWaalsContact C-N 3.3Å; V437-L439 PolarHBondContact O-N 2.89Å; L439-L441 PolarHBondContact O-N 2.93Å; L439-V442 WeakPolarHBondContact O-CB 3.11Å; L439-V442 PolarHBondContact O-N 3.38Å; L439-F443 HydrophobicContact CD1-CD2 4.14Å; L439-F443 HydrophobicContact CD1-CE2 3.63Å; L439-F443 HydrophobicContact CD1-CZ 4.4Å; L439-F443 HydrophobicContact CD2-CE2 4.06Å; L439-F443 HydrophobicContact CG-CD2 3.92Å; L439-F443 HydrophobicContact CG-CE2 3.58Å; L439-F443 WeakPolarHBondContact O-CD2 3.31Å; L439-F443 PolarHBondContact O-N 3.19Å; L439-L487 HydrophobicContact CD2-CD2 4.42Å
440	V	91.9	Very high	90.7	Very high	2 Å²	2	58 Å²	58	1%	0.012	31%	0.309	C	S	.	.	H	α-helix	trans	-60	-44.3	174.6	171.3	0	0	0	0	111.4	M436 V437 M438 V442 F443 I444 F521 V524 N525	M436-V440 PolarHBondContact O-N 2.85Å; M436-V440 VanDerWaalsContact O-N 3.16Å; V437-V440 WeakPolarHBondContact O-CB 3.25Å; V437-V440 PolarHBondContact O-N 3.02Å; M438-V440 VanDerWaalsContact C-N 3.31Å; M438-V440 PolarHBondContact O-N 3.25Å; V440-V442 VanDerWaalsContact C-N 3.3Å; V440-V442 PolarHBondContact O-N 3Å; V440-F443 PolarHBondContact O-N 3.04Å; V440-I444 HydrophobicContact CG1-CD1 4.04Å; V440-I444 WeakPolarHBondContact O-CG1 3.32Å; V440-I444 PolarHBondContact O-N 3.41Å; V440-F521 HydrophobicContact CG2-CD2 4.28Å; V440-F521 HydrophobicContact CG2-CE2 3.44Å; V440-F521 VanDerWaalsContact CG2-CE2 3.44Å; V440-F521 HydrophobicContact CG2-CZ 3.73Å; V440-V524 HydrophobicContact CB-CG1 4.3Å; V440-V524 HydrophobicContact CG1-CG1 3.89Å; V440-N525 HydrophobicContact CG1-CB 4.39Å; V440-N525 HydrophobicContact CG2-CB 4.48Å
441	L	90.5	Very high	90.4	Very high	69 Å²	69	54.2 Å²	54.2	36%	0.361	29%	0.289	S	S	.	.	H	α-helix	trans	-61.8	-38.4	177.8	-62.1	178.3	0	0	0	112.1	V437 M438 L439 I444 I445 V524	V437-L441 PolarHBondContact O-N 3.35Å; M438-L441 PolarHBondContact O-N 2.74Å; M438-L441 HydrophobicContact SD-CD1 4.02Å; L439-L441 PolarHBondContact O-N 2.93Å; L441-I444 PolarHBondContact O-N 3.45Å; L441-I445 WeakPolarHBondContact O-CG1 3.15Å; L441-I445 PolarHBondContact O-N 2.91Å; L441-I445 VanDerWaalsContact O-N 3.12Å; L441-V524 HydrophobicContact CD2-CG1 4.37Å
442	V	92.4	Very high	89.7	Confident	90 Å²	90	51 Å²	51	55%	0.545	27%	0.271	S	S	.	.	H	α-helix	trans	-62.5	-44.5	174.2	173.7	0	0	0	0	111.2	M438 L439 V440 I444 I445 A446	M438-V442 WeakPolarHBondContact O-CG2 3.42Å; M438-V442 PolarHBondContact O-N 3.34Å; M438-V442 VanDerWaalsContact O-N 3.08Å; L439-V442 WeakPolarHBondContact O-CB 3.11Å; L439-V442 PolarHBondContact O-N 3.38Å; V440-V442 VanDerWaalsContact C-N 3.3Å; V440-V442 PolarHBondContact O-N 3Å; V442-I444 VanDerWaalsContact C-N 3.3Å; V442-I444 PolarHBondContact O-N 3.42Å; V442-I445 PolarHBondContact O-N 2.82Å; V442-A446 PolarHBondContact O-N 2.55Å
443	F	91.1	Very high	89.4	Confident	69 Å²	69	53.5 Å²	53.5	30%	0.303	28%	0.281	S	S	.	.	H	α-helix	trans	-62.6	-36.1	176.6	-80.5	-65.1	0	0	0	112.7	L439 V440 A446 V447 L483 L487	L439-F443 HydrophobicContact CD1-CD2 4.14Å; L439-F443 HydrophobicContact CD1-CE2 3.63Å; L439-F443 HydrophobicContact CD1-CZ 4.4Å; L439-F443 HydrophobicContact CD2-CE2 4.06Å; L439-F443 HydrophobicContact CG-CD2 3.92Å; L439-F443 HydrophobicContact CG-CE2 3.58Å; L439-F443 WeakPolarHBondContact O-CD2 3.31Å; L439-F443 PolarHBondContact O-N 3.19Å; V440-F443 PolarHBondContact O-N 3.04Å; F443-A446 WeakPolarHBondContact O-CB 3.45Å; F443-A446 PolarHBondContact O-N 3.11Å; F443-V447 WeakPolarHBondContact O-CG2 3.27Å; F443-V447 PolarHBondContact O-N 3Å; F443-L483 HydrophobicContact CD1-CD1 4.44Å; F443-L483 HydrophobicContact CD1-CD2 4.39Å; F443-L483 HydrophobicContact CE1-CD2 4.48Å; F443-L487 HydrophobicContact CD2-CD1 3.54Å; F443-L487 HydrophobicContact CD2-CD2 4.26Å; F443-L487 HydrophobicContact CD2-CG 4.48Å; F443-L487 HydrophobicContact CE2-CD1 3.91Å; F443-L487 HydrophobicContact CE2-CD2 3.81Å; F443-L487 HydrophobicContact CE2-CG 4.4Å; F443-L487 HydrophobicContact CG-CD1 4.13Å
444	I	87.1	Confident	89.2	Confident	17 Å²	17	55.3 Å²	55.3	9%	0.087	29%	0.29	C	S	.	.	H	α-helix	trans	-64.4	-44.2	175.8	-69	166.5	0	0	0	111	V440 L441 V442 A446 V447 I448	V440-I444 HydrophobicContact CG1-CD1 4.04Å; V440-I444 WeakPolarHBondContact O-CG1 3.32Å; V440-I444 PolarHBondContact O-N 3.41Å; L441-I444 PolarHBondContact O-N 3.45Å; V442-I444 VanDerWaalsContact C-N 3.3Å; V442-I444 PolarHBondContact O-N 3.42Å; I444-A446 VanDerWaalsContact C-N 3.25Å; I444-A446 PolarHBondContact O-N 2.83Å; I444-V447 PolarHBondContact O-N 2.69Å; I444-I448 HydrophobicContact CG2-CD1 3.89Å; I444-I448 VanDerWaalsContact O-CG1 3.29Å; I444-I448 WeakPolarHBondContact O-CG1 3.28Å; I444-I448 PolarHBondContact O-N 3.15Å
445	I	88.3	Confident	88.6	Confident	82 Å²	82	52.3 Å²	52.3	42%	0.421	27%	0.274	S	S	.	.	H	α-helix	trans	-59.3	-41.4	174.1	-64.7	167.1	0	0	0	110.1	L441 V442 V447 I448 I449	L441-I445 WeakPolarHBondContact O-CG1 3.15Å; L441-I445 PolarHBondContact O-N 2.91Å; L441-I445 VanDerWaalsContact O-N 3.12Å; V442-I445 PolarHBondContact O-N 2.82Å; I445-V447 PolarHBondContact O-N 3.45Å; I445-I448 PolarHBondContact O-N 3.46Å; I445-I449 HydrophobicContact CG2-CD1 3.91Å; I445-I449 HydrophobicContact CG2-CG1 4.49Å; I445-I449 VanDerWaalsContact O-CG1 3.32Å; I445-I449 WeakPolarHBondContact O-CG1 3.39Å; I445-I449 PolarHBondContact O-N 3.07Å
446	A	89.4	Confident	88.1	Confident	49 Å²	49	49.9 Å²	49.9	41%	0.405	26%	0.258	S	S	.	.	H	α-helix	trans	-62.7	-40.3	175.9	0	0	0	0	0	112.8	V442 F443 I444 I449 Y450	V442-A446 PolarHBondContact O-N 2.55Å; F443-A446 WeakPolarHBondContact O-CB 3.45Å; F443-A446 PolarHBondContact O-N 3.11Å; I444-A446 VanDerWaalsContact C-N 3.25Å; I444-A446 PolarHBondContact O-N 2.83Å; A446-I449 PolarHBondContact O-N 3.22Å; A446-Y450 WeakPolarHBondContact O-CB 3.19Å; A446-Y450 PolarHBondContact O-N 2.92Å
447	V	87	Confident	87.7	Confident	15 Å²	15	51.8 Å²	51.8	9%	0.091	27%	0.272	C	S	.	.	H	α-helix	trans	-65	-39.7	174.8	170.6	0	0	0	0	111.4	F443 I444 I445 Y450 R451 A476 N480 L483	F443-V447 WeakPolarHBondContact O-CG2 3.27Å; F443-V447 PolarHBondContact O-N 3Å; I444-V447 PolarHBondContact O-N 2.69Å; I445-V447 PolarHBondContact O-N 3.45Å; V447-Y450 WeakPolarHBondContact O-CB 3.39Å; V447-Y450 PolarHBondContact O-N 2.82Å; V447-R451 PolarHBondContact O-N 3.26Å; V447-A476 HydrophobicContact CG1-CB 4.5Å; V447-N480 HydrophobicContact CG1-CB 4.08Å; V447-N480 HydrophobicContact CG2-CB 4.38Å; V447-L483 HydrophobicContact CG2-CD1 3.64Å
448	I	83.7	Confident	87.4	Confident	34 Å²	34	52 Å²	52	17%	0.174	27%	0.273	C	S	.	.	H	α-helix	trans	-62.8	-47	175.6	-66.7	160.8	0	0	0	110.1	I444 I445 Y450 R451 F452 Y532	I444-I448 HydrophobicContact CG2-CD1 3.89Å; I444-I448 VanDerWaalsContact O-CG1 3.29Å; I444-I448 WeakPolarHBondContact O-CG1 3.28Å; I444-I448 PolarHBondContact O-N 3.15Å; I445-I448 PolarHBondContact O-N 3.46Å; I448-Y450 VanDerWaalsContact C-N 3.33Å; I448-Y450 PolarHBondContact O-N 3.49Å; I448-R451 WeakPolarHBondContact O-CB 3.26Å; I448-R451 PolarHBondContact O-N 2.72Å; I448-F452 PolarHBondContact O-N 3.26Å; I448-Y532 HydrophobicContact CD1-CD1 3.83Å; I448-Y532 HydrophobicContact CD1-CD2 3.93Å; I448-Y532 HydrophobicContact CD1-CE1 3.61Å; I448-Y532 HydrophobicContact CD1-CE2 3.71Å; I448-Y532 HydrophobicContact CD1-CG 3.98Å; I448-Y532 HydrophobicContact CG1-CD1 4.3Å; I448-Y532 HydrophobicContact CG1-CE1 3.94Å
449	I	86.5	Confident	86.7	Confident	65 Å²	65	48.6 Å²	48.6	33%	0.333	26%	0.255	S	S	.	.	H	α-helix	trans	-61.2	-43.6	176.3	-66.8	166.8	0	0	0	110.4	I445 A446 R451 F452 L453	I445-I449 HydrophobicContact CG2-CD1 3.91Å; I445-I449 HydrophobicContact CG2-CG1 4.49Å; I445-I449 VanDerWaalsContact O-CG1 3.32Å; I445-I449 WeakPolarHBondContact O-CG1 3.39Å; I445-I449 PolarHBondContact O-N 3.07Å; A446-I449 PolarHBondContact O-N 3.22Å; I449-R451 VanDerWaalsContact C-N 3.33Å; I449-R451 PolarHBondContact O-N 3.05Å; I449-F452 WeakPolarHBondContact O-CB 3.31Å; I449-F452 PolarHBondContact O-N 3.17Å; I449-L453 HydrophobicContact CG2-CD1 3.84Å; I449-L453 HydrophobicContact CG2-CG 4.2Å; I449-L453 VanDerWaalsContact O-CG 3.31Å; I449-L453 WeakPolarHBondContact O-CG 3.49Å; I449-L453 PolarHBondContact O-N 3.29Å
450	Y	89.2	Confident	86	Confident	80 Å²	80	51.4 Å²	51.4	31%	0.314	27%	0.266	S	S	.	.	H	α-helix	trans	-56.4	-45.9	175.3	167.3	-98.5	0	0	0	111.9	A446 V447 I448 F452 L453 I454 A476 V479	A446-Y450 WeakPolarHBondContact O-CB 3.19Å; A446-Y450 PolarHBondContact O-N 2.92Å; V447-Y450 WeakPolarHBondContact O-CB 3.39Å; V447-Y450 PolarHBondContact O-N 2.82Å; I448-Y450 VanDerWaalsContact C-N 3.33Å; I448-Y450 PolarHBondContact O-N 3.49Å; Y450-F452 VanDerWaalsContact C-N 3.32Å; Y450-F452 PolarHBondContact O-N 2.81Å; Y450-L453 PolarHBondContact O-N 3.44Å; Y450-I454 HydrophobicContact CE2-CD1 4.45Å; Y450-I454 WeakPolarHBondContact O-CB 3.41Å; Y450-I454 PolarHBondContact O-N 2.82Å; Y450-A476 HydrophobicContact CD1-CB 4.26Å; Y450-A476 HydrophobicContact CE1-CB 4.34Å; Y450-V479 HydrophobicContact CE1-CB 4.44Å; Y450-V479 HydrophobicContact CE1-CG2 3.97Å
451	R	83.6	Confident	85.6	Confident	18 Å²	18	55.1 Å²	55.1	7%	0.068	29%	0.286	C	S	.	.	H	α-helix	trans	-61.7	-40.6	177.3	-172.6	-172.6	-176.6	-176.2	6.6	111.9	V447 I448 I449 I454 K455 T473 A476 K537 E556 E566	V447-R451 PolarHBondContact O-N 3.26Å; I448-R451 WeakPolarHBondContact O-CB 3.26Å; I448-R451 PolarHBondContact O-N 2.72Å; I449-R451 VanDerWaalsContact C-N 3.33Å; I449-R451 PolarHBondContact O-N 3.05Å; R451-I454 WeakPolarHBondContact O-CG2 3.28Å; R451-K455 WeakPolarHBondContact O-CG 3.21Å; R451-K455 PolarHBondContact O-N 3.31Å; R451-T473 PolarHBondContact NH2-OG1 3.45Å; R451-A476 HydrophobicContact CB-CB 3.9Å; R451-A476 HydrophobicContact CG-CB 4Å; R451-K537 VanDerWaalsContact NH1-NZ 3.11Å; R451-E556 IonicContact NH1-OE2 2.7Å; R451-E566 IonicContact CZ-OE1 2.87Å; R451-E566 IonicContact NH1-OE1 3.03Å; R451-E566 PolarHBondContact NH1-OE1 3.38Å; R451-E566 IonicContact NH2-OE1 3.97Å; R451-E566 PolarHBondContact NH2-OE1 3.24Å
452	F	80	Confident	85.1	Confident	36 Å²	36	61 Å²	61	16%	0.158	31%	0.309	C	S	.	.	H	α-helix	trans	-63.2	-47.8	175.3	-177.9	-92.2	0	0	0	111.3	I448 I449 Y450 I454 K455 I456 L553	I448-F452 PolarHBondContact O-N 3.26Å; I449-F452 WeakPolarHBondContact O-CB 3.31Å; I449-F452 PolarHBondContact O-N 3.17Å; Y450-F452 VanDerWaalsContact C-N 3.32Å; Y450-F452 PolarHBondContact O-N 2.81Å; F452-I454 PolarHBondContact O-N 3.22Å; F452-K455 PolarHBondContact O-N 2.93Å; F452-I456 HydrophobicContact CE1-CD1 4.12Å; F452-L553 HydrophobicContact CD1-CD1 4.1Å; F452-L553 HydrophobicContact CD1-CD2 3.93Å; F452-L553 HydrophobicContact CD1-CG 4.39Å; F452-L553 HydrophobicContact CE1-CB 4.19Å; F452-L553 HydrophobicContact CE1-CD1 4.35Å; F452-L553 HydrophobicContact CE1-CD2 3.35Å; F452-L553 HydrophobicContact CE1-CG 4.15Å; F452-L553 HydrophobicContact CZ-CB 4.36Å; F452-L553 HydrophobicContact CZ-CD2 4.1Å
453	L	85.3	Confident	84.5	Confident	92 Å²	92	64 Å²	64	48%	0.482	32%	0.321	S	S	.	.	H	α-helix	trans	-65.6	-37.3	-177.6	-68.8	176.1	0	0	0	112.8	I449 Y450 K455 I456 P457	I449-L453 HydrophobicContact CG2-CD1 3.84Å; I449-L453 HydrophobicContact CG2-CG 4.2Å; I449-L453 VanDerWaalsContact O-CG 3.31Å; I449-L453 WeakPolarHBondContact O-CG 3.49Å; I449-L453 PolarHBondContact O-N 3.29Å; Y450-L453 PolarHBondContact O-N 3.44Å; L453-K455 VanDerWaalsContact C-N 3.32Å; L453-K455 PolarHBondContact O-N 3.33Å; L453-I456 PolarHBondContact O-N 3.26Å; L453-P457 WeakPolarHBondContact O-CD 3.4Å
454	I	87.6	Confident	84	Confident	45 Å²	45	63.3 Å²	63.3	23%	0.231	32%	0.32	C	S	.	.	H	α-helix	trans	-70.6	-28.4	179.6	-153	68.9	0	0	0	111.6	Y450 R451 F452 I456 P457 L458 A472	Y450-I454 HydrophobicContact CE2-CD1 4.45Å; Y450-I454 WeakPolarHBondContact O-CB 3.41Å; Y450-I454 PolarHBondContact O-N 2.82Å; R451-I454 WeakPolarHBondContact O-CG2 3.28Å; F452-I454 PolarHBondContact O-N 3.22Å; I454-I456 VanDerWaalsContact C-N 3.3Å; I454-I456 PolarHBondContact O-N 2.79Å; I454-P457 VanDerWaalsContact O-CD 3.23Å; I454-P457 WeakPolarHBondContact O-CD 3.34Å; I454-P457 WeakPolarHBondContact O-CG 3.39Å; I454-L458 HydrophobicContact CB-CD1 4.42Å; I454-L458 HydrophobicContact CD1-CD1 4.47Å; I454-L458 HydrophobicContact CG1-CD1 3.65Å; I454-L458 WeakPolarHBondContact O-CD1 3.31Å; I454-L458 PolarHBondContact O-N 3.42Å; I454-A472 HydrophobicContact CG2-CB 3.63Å
455	K	81.2	Confident	83.5	Confident	35 Å²	35	66 Å²	66	15%	0.152	33%	0.329	C	S	.	.	H	α-helix	trans	-60.8	-37.8	176.9	-79.6	-176.7	171.7	-160.4	0	112.4	R451 F452 L453 L458 F459 E469 A472	R451-K455 WeakPolarHBondContact O-CG 3.21Å; R451-K455 PolarHBondContact O-N 3.31Å; F452-K455 PolarHBondContact O-N 2.93Å; L453-K455 VanDerWaalsContact C-N 3.32Å; L453-K455 PolarHBondContact O-N 3.33Å; K455-L458 PolarHBondContact O-N 3.28Å; K455-F459 HydrophobicContact CB-CD2 4.13Å; K455-F459 HydrophobicContact CB-CE2 4.1Å; K455-F459 HydrophobicContact CD-CE2 4.38Å; K455-F459 HydrophobicContact CG-CE2 4.3Å; K455-F459 WeakPolarHBondContact O-CD2 3.16Å; K455-F459 PolarHBondContact O-N 3.2Å; K455-E469 IonicContact NZ-OE1 2.73Å; K455-E469 PolarHBondContact NZ-OE1 3.04Å; K455-A472 HydrophobicContact CG-CB 3.72Å
456	I	82.3	Confident	82.8	Confident	40 Å²	40	67.2 Å²	67.2	21%	0.205	35%	0.345	C	S	.	.	H	α-helix	trans	-56.6	-58.5	-176.2	-58.4	171.4	0	0	0	112.3	F452 L453 I454 L458 F459 Q460	F452-I456 HydrophobicContact CE1-CD1 4.12Å; L453-I456 PolarHBondContact O-N 3.26Å; I454-I456 VanDerWaalsContact C-N 3.3Å; I454-I456 PolarHBondContact O-N 2.79Å; I456-L458 VanDerWaalsContact C-N 3.32Å; I456-L458 PolarHBondContact O-N 3.01Å; I456-F459 PolarHBondContact O-N 3.49Å; I456-Q460 WeakPolarHBondContact O-CG 3.31Å; I456-Q460 PolarHBondContact O-N 3.29Å
457	P	86	Confident	82.1	Confident	65 Å²	65	68.1 Å²	68.1	42%	0.422	34%	0.343	S	S	.	.	H	α-helix	trans	-66.8	-31.4	178.9	26.8	-35.5	0	0	0	112.9	L453 I454 Q460 N461	L453-P457 WeakPolarHBondContact O-CD 3.4Å; I454-P457 VanDerWaalsContact O-CD 3.23Å; I454-P457 WeakPolarHBondContact O-CD 3.34Å; I454-P457 WeakPolarHBondContact O-CG 3.39Å; P457-Q460 PolarHBondContact O-N 3.5Å; P457-N461 PolarHBondContact O-N 3Å
458	L	85.2	Confident	81.8	Confident	22 Å²	22	67.4 Å²	67.4	12%	0.115	34%	0.339	C	S	.	.	H	α-helix	trans	-66.8	-37.7	177.6	-89.1	107.5	0	0	0	112.7	I454 K455 I456 L464 A468 Y471	I454-L458 HydrophobicContact CB-CD1 4.42Å; I454-L458 HydrophobicContact CD1-CD1 4.47Å; I454-L458 HydrophobicContact CG1-CD1 3.65Å; I454-L458 WeakPolarHBondContact O-CD1 3.31Å; I454-L458 PolarHBondContact O-N 3.42Å; K455-L458 PolarHBondContact O-N 3.28Å; I456-L458 VanDerWaalsContact C-N 3.32Å; I456-L458 PolarHBondContact O-N 3.01Å; L458-L464 HydrophobicContact CD2-CB 4.47Å; L458-A468 HydrophobicContact CB-CB 3.72Å; L458-A468 HydrophobicContact CD2-CB 4.26Å; L458-Y471 HydrophobicContact CD2-CD2 4.12Å; L458-Y471 HydrophobicContact CD2-CG 4.33Å
459	F	78.2	Confident	81.3	Confident	29 Å²	29	67.1 Å²	67.1	13%	0.127	34%	0.337	C	S	.	.	H	α-helix	trans	-73.6	-29.9	175.8	-81.5	-64.3	0	0	0	113.4	K455 I456 N461 R465 A468	K455-F459 HydrophobicContact CB-CD2 4.13Å; K455-F459 HydrophobicContact CB-CE2 4.1Å; K455-F459 HydrophobicContact CD-CE2 4.38Å; K455-F459 HydrophobicContact CG-CE2 4.3Å; K455-F459 WeakPolarHBondContact O-CD2 3.16Å; K455-F459 PolarHBondContact O-N 3.2Å; I456-F459 PolarHBondContact O-N 3.49Å; F459-N461 VanDerWaalsContact C-N 3.34Å; F459-R465 HydrophobicContact CD1-CG 4.13Å; F459-A468 HydrophobicContact CD1-CB 4.03Å; F459-A468 HydrophobicContact CE1-CB 3.98Å; F459-A468 HydrophobicContact CE2-CB 4.47Å; F459-A468 HydrophobicContact CG-CB 4.3Å; F459-A468 HydrophobicContact CZ-CB 4.2Å
460	Q	80.5	Confident	80.7	Confident	125 Å²	125	67.2 Å²	67.2	58%	0.584	34%	0.337	S	S	*	.	H	α-helix	trans	-68.7	-33.2	175.8	-72.7	176.5	-9.7	0	0	112.2	I456 P457 K462	I456-Q460 WeakPolarHBondContact O-CG 3.31Å; I456-Q460 PolarHBondContact O-N 3.29Å; P457-Q460 PolarHBondContact O-N 3.5Å; Q460-K462 PolarHBondContact O-N 3.38Å
461	N	83.3	Confident	80.4	Confident	80 Å²	80	68.5 Å²	68.5	43%	0.428	34%	0.343	S	S	.	.	S	Bend	trans	-78.2	115.9	-179.9	-165.8	-8.4	0	0	0	111.7	P457 F459 L463 L464 R465	P457-N461 PolarHBondContact O-N 3Å; F459-N461 VanDerWaalsContact C-N 3.34Å; N461-L463 PolarHBondContact O-N 3.28Å; N461-L463 VanDerWaalsContact O-N 3.15Å; N461-L464 HydrophobicContact CB-CB 4.35Å; N461-L464 HydrophobicContact CB-CD1 4.45Å; N461-L464 PolarHBondContact O-N 2.96Å; N461-R465 WeakPolarHBondContact O-CB 3.36Å; N461-R465 PolarHBondContact O-N 3.47Å
462	K	78.8	Confident	80.4	Confident	192 Å²	192	67.7 Å²	67.7	84%	0.835	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-35.4	-175.2	-69.4	-177.9	-178.4	176.5	0	113.6	Q460	Q460-K462 PolarHBondContact O-N 3.38Å
463	L	80.4	Confident	80.4	Confident	154 Å²	154	67 Å²	67	81%	0.806	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-40.9	-178.6	-167.5	99.2	0	0	0	112.2	N461	N461-L463 PolarHBondContact O-N 3.28Å; N461-L463 VanDerWaalsContact O-N 3.15Å
464	L	80.2	Confident	80.1	Confident	55 Å²	55	66.2 Å²	66.2	29%	0.288	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-15.7	-174.2	-64.8	173.8	0	0	0	112.7	L458 N461 S466 N467 A468 Y471	L458-L464 HydrophobicContact CD2-CB 4.47Å; N461-L464 HydrophobicContact CB-CB 4.35Å; N461-L464 HydrophobicContact CB-CD1 4.45Å; N461-L464 PolarHBondContact O-N 2.96Å; L464-S466 VanDerWaalsContact C-N 3.27Å; L464-S466 PolarHBondContact O-N 3.03Å; L464-S466 VanDerWaalsContact O-N 3.15Å; L464-N467 CarbonylContact O-C 3.25Å; L464-N467 PolarHBondContact O-N 2.9Å; L464-A468 WeakPolarHBondContact O-CA 3.38Å; L464-A468 WeakPolarHBondContact O-CB 3.34Å; L464-A468 PolarHBondContact O-N 3.47Å; L464-Y471 HydrophobicContact CD2-CD2 4.23Å; L464-Y471 HydrophobicContact CD2-CE2 3.88Å
465	R	76.3	Confident	80	Confident	72 Å²	72	65.6 Å²	65.6	27%	0.272	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-50.5	-41.3	-175.4	-166.5	-178.6	-165.4	159.5	3.6	114.3	G328 F459 N461 N467	G328-R465 PolarHBondContact O-NH2 3.43Å; F459-R465 HydrophobicContact CD1-CG 4.13Å; N461-R465 WeakPolarHBondContact O-CB 3.36Å; N461-R465 PolarHBondContact O-N 3.47Å; R465-N467 VanDerWaalsContact C-N 3.29Å; R465-N467 PolarHBondContact O-N 3.38Å
466	S	74.9	Confident	80.1	Confident	109 Å²	109	64.2 Å²	64.2	76%	0.762	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-64.6	-33.2	-178	-171.9	0	0	0	0	112.9	L464	L464-S466 VanDerWaalsContact C-N 3.27Å; L464-S466 PolarHBondContact O-N 3.03Å; L464-S466 VanDerWaalsContact O-N 3.15Å
467	N	75	Confident	80	Confident	68 Å²	68	63.4 Å²	63.4	36%	0.364	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-117.1	12.1	-174.8	-64.9	-9.8	0	0	0	111.9	L464 R465 E469 I470 Y471	L464-N467 CarbonylContact O-C 3.25Å; L464-N467 PolarHBondContact O-N 2.9Å; R465-N467 VanDerWaalsContact C-N 3.29Å; R465-N467 PolarHBondContact O-N 3.38Å; N467-E469 PolarHBondContact O-N 3.47Å; N467-I470 PolarHBondContact O-N 2.91Å; N467-I470 VanDerWaalsContact O-N 3.15Å; N467-Y471 HydrophobicContact CB-CD2 3.81Å; N467-Y471 HydrophobicContact CB-CE2 3.42Å; N467-Y471 VanDerWaalsContact CB-CE2 3.42Å; N467-Y471 WeakPolarHBondContact O-CD2 3.44Å; N467-Y471 PolarHBondContact O-N 3.28Å
468	A	79.1	Confident	79.8	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-55.4	-40.9	-173.5	0	0	0	0	0	111.9	L458 F459 L464 A472	L458-A468 HydrophobicContact CB-CB 3.72Å; L458-A468 HydrophobicContact CD2-CB 4.26Å; F459-A468 HydrophobicContact CD1-CB 4.03Å; F459-A468 HydrophobicContact CE1-CB 3.98Å; F459-A468 HydrophobicContact CE2-CB 4.47Å; F459-A468 HydrophobicContact CG-CB 4.3Å; F459-A468 HydrophobicContact CZ-CB 4.2Å; L464-A468 WeakPolarHBondContact O-CA 3.38Å; L464-A468 WeakPolarHBondContact O-CB 3.34Å; L464-A468 PolarHBondContact O-N 3.47Å; A468-A472 VanDerWaalsContact O-CB 3.22Å; A468-A472 WeakPolarHBondContact O-CB 3.38Å; A468-A472 PolarHBondContact O-N 3.4Å
469	E	73	Confident	79.9	Confident	28 Å²	28	65.8 Å²	65.8	13%	0.131	34%	0.338	C	S	.	.	H	α-helix	trans	-65.9	-44.5	179.5	-178.2	128.4	-128.7	0	0	113	K455 N467 A472 T473 D559	K455-E469 IonicContact NZ-OE1 2.73Å; K455-E469 PolarHBondContact NZ-OE1 3.04Å; N467-E469 PolarHBondContact O-N 3.47Å; E469-A472 PolarHBondContact O-N 3.41Å; E469-T473 WeakPolarHBondContact O-CB 3.34Å; E469-T473 PolarHBondContact O-N 3.34Å; E469-T473 PolarHBondContact O-OG1 2.57Å; E469-D559 WeakPolarHBondContact CG-OD2 3.19Å; E469-D559 VanDerWaalsContact OE2-OD1 3.13Å
470	I	75.7	Confident	80.3	Confident	67 Å²	67	65 Å²	65	34%	0.344	34%	0.336	S	S	.	.	H	α-helix	trans	-63.8	-48.5	178	-62.4	173	0	0	0	109.6	N467 T473 L474	N467-I470 PolarHBondContact O-N 2.91Å; N467-I470 VanDerWaalsContact O-N 3.15Å; I470-T473 PolarHBondContact O-N 3.41Å; I470-L474 WeakPolarHBondContact O-CB 3.36Å; I470-L474 PolarHBondContact O-N 2.96Å
471	Y	83	Confident	80.3	Confident	107 Å²	107	60.5 Å²	60.5	42%	0.42	32%	0.315	S	S	.	.	H	α-helix	trans	-63.9	-42.5	-179.9	-66.7	-48.5	0	0	0	112.5	L458 L464 N467 T473 L474 S475	L458-Y471 HydrophobicContact CD2-CD2 4.12Å; L458-Y471 HydrophobicContact CD2-CG 4.33Å; L464-Y471 HydrophobicContact CD2-CD2 4.23Å; L464-Y471 HydrophobicContact CD2-CE2 3.88Å; N467-Y471 HydrophobicContact CB-CD2 3.81Å; N467-Y471 HydrophobicContact CB-CE2 3.42Å; N467-Y471 VanDerWaalsContact CB-CE2 3.42Å; N467-Y471 WeakPolarHBondContact O-CD2 3.44Å; N467-Y471 PolarHBondContact O-N 3.28Å; Y471-T473 VanDerWaalsContact C-N 3.31Å; Y471-T473 PolarHBondContact O-N 3.09Å; Y471-L474 PolarHBondContact O-N 2.75Å; Y471-S475 WeakPolarHBondContact O-CB 3.46Å; Y471-S475 PolarHBondContact O-N 2.82Å; Y471-S475 PolarHBondContact O-OG 3.4Å
472	A	82.7	Confident	80.4	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-63.2	-38.1	176.4	0	0	0	0	0	112.2	I454 K455 A468 E469 S475 A476	I454-A472 HydrophobicContact CG2-CB 3.63Å; K455-A472 HydrophobicContact CG-CB 3.72Å; A468-A472 VanDerWaalsContact O-CB 3.22Å; A468-A472 WeakPolarHBondContact O-CB 3.38Å; A468-A472 PolarHBondContact O-N 3.4Å; E469-A472 PolarHBondContact O-N 3.41Å; A472-S475 PolarHBondContact O-OG 3.42Å; A472-S475 VanDerWaalsContact O-OG 3.12Å; A472-A476 VanDerWaalsContact O-CB 3.25Å; A472-A476 WeakPolarHBondContact O-CB 3.36Å; A472-A476 PolarHBondContact O-N 3.02Å; A472-A476 VanDerWaalsContact O-N 3.1Å
473	T	79.2	Confident	80.9	Confident	21 Å²	21	54.6 Å²	54.6	13%	0.129	29%	0.291	C	S	.	.	H	α-helix	trans	-71.5	-43.1	178.1	-56.9	0	0	0	0	111.3	R451 E469 I470 Y471 A477	R451-T473 PolarHBondContact NH2-OG1 3.45Å; E469-T473 WeakPolarHBondContact O-CB 3.34Å; E469-T473 PolarHBondContact O-N 3.34Å; E469-T473 PolarHBondContact O-OG1 2.57Å; I470-T473 PolarHBondContact O-N 3.41Å; Y471-T473 VanDerWaalsContact C-N 3.31Å; Y471-T473 PolarHBondContact O-N 3.09Å; T473-A477 WeakPolarHBondContact O-CB 3.49Å; T473-A477 PolarHBondContact O-N 3.2Å
474	L	79	Confident	81.2	Confident	77 Å²	77	47.4 Å²	47.4	40%	0.403	25%	0.254	S	S	.	.	H	α-helix	trans	-64.8	-44.3	177.3	-176.6	62.8	0	0	0	111.7	I470 Y471 A477 I478	I470-L474 WeakPolarHBondContact O-CB 3.36Å; I470-L474 PolarHBondContact O-N 2.96Å; Y471-L474 PolarHBondContact O-N 2.75Å; L474-A477 PolarHBondContact O-N 2.99Å; L474-I478 HydrophobicContact CD1-CD1 4.32Å; L474-I478 HydrophobicContact CG-CD1 4.09Å; L474-I478 VanDerWaalsContact O-CG1 3.3Å; L474-I478 WeakPolarHBondContact O-CG1 3.24Å; L474-I478 PolarHBondContact O-N 3.32Å
475	S	85.7	Confident	81.4	Confident	31 Å²	31	48.5 Å²	48.5	22%	0.217	26%	0.258	C	S	.	.	H	α-helix	trans	-64.7	-44.8	178.1	67.7	0	0	0	0	111.7	Y471 A472 A477 I478 V479	Y471-S475 WeakPolarHBondContact O-CB 3.46Å; Y471-S475 PolarHBondContact O-N 2.82Å; Y471-S475 PolarHBondContact O-OG 3.4Å; A472-S475 PolarHBondContact O-OG 3.42Å; A472-S475 VanDerWaalsContact O-OG 3.12Å; S475-A477 VanDerWaalsContact C-N 3.31Å; S475-A477 PolarHBondContact O-N 3.37Å; S475-I478 PolarHBondContact O-N 3.24Å; S475-V479 WeakPolarHBondContact O-CG2 3.19Å; S475-V479 PolarHBondContact O-N 2.91Å
476	A	84.6	Confident	82	Confident	7 Å²	7	48.8 Å²	48.8	6%	0.058	27%	0.27	C	S	.	.	H	α-helix	trans	-61.6	-39.8	176.2	0	0	0	0	0	111.9	V447 Y450 R451 A472 V479 N480	V447-A476 HydrophobicContact CG1-CB 4.5Å; Y450-A476 HydrophobicContact CD1-CB 4.26Å; Y450-A476 HydrophobicContact CE1-CB 4.34Å; R451-A476 HydrophobicContact CB-CB 3.9Å; R451-A476 HydrophobicContact CG-CB 4Å; A472-A476 VanDerWaalsContact O-CB 3.25Å; A472-A476 WeakPolarHBondContact O-CB 3.36Å; A472-A476 PolarHBondContact O-N 3.02Å; A472-A476 VanDerWaalsContact O-N 3.1Å; A476-V479 PolarHBondContact O-N 2.96Å; A476-N480 VanDerWaalsContact O-CB 3.26Å; A476-N480 WeakPolarHBondContact O-CB 3.27Å; A476-N480 PolarHBondContact O-N 2.9Å
477	A	79.2	Confident	82.8	Confident	23 Å²	23	44.5 Å²	44.5	19%	0.19	24%	0.239	C	C	.	.	H	α-helix	trans	-63.4	-42.1	175.6	0	0	0	0	0	112.4	T473 L474 S475 N480 L481 V573	T473-A477 WeakPolarHBondContact O-CB 3.49Å; T473-A477 PolarHBondContact O-N 3.2Å; L474-A477 PolarHBondContact O-N 2.99Å; S475-A477 VanDerWaalsContact C-N 3.31Å; S475-A477 PolarHBondContact O-N 3.37Å; A477-N480 PolarHBondContact O-N 2.73Å; A477-L481 WeakPolarHBondContact O-CB 3.21Å; A477-L481 PolarHBondContact O-N 2.86Å; A477-V573 HydrophobicContact CB-CG1 4.28Å
478	I	81.8	Confident	83.5	Confident	87 Å²	87	41.4 Å²	41.4	45%	0.446	22%	0.223	S	C	.	.	H	α-helix	trans	-65.5	-45.9	176.8	-67.5	165.1	0	0	0	111	L474 S475 N480 L481 I482	L474-I478 HydrophobicContact CD1-CD1 4.32Å; L474-I478 HydrophobicContact CG-CD1 4.09Å; L474-I478 VanDerWaalsContact O-CG1 3.3Å; L474-I478 WeakPolarHBondContact O-CG1 3.24Å; L474-I478 PolarHBondContact O-N 3.32Å; S475-I478 PolarHBondContact O-N 3.24Å; I478-N480 VanDerWaalsContact C-N 3.33Å; I478-N480 PolarHBondContact O-N 3.27Å; I478-L481 WeakPolarHBondContact O-CB 3.28Å; I478-L481 PolarHBondContact O-N 2.99Å; I478-I482 HydrophobicContact CG2-CD1 4.04Å; I478-I482 WeakPolarHBondContact O-CG1 3.43Å; I478-I482 PolarHBondContact O-N 3.43Å
479	V	87.2	Confident	83.9	Confident	49 Å²	49	47.1 Å²	47.1	30%	0.297	25%	0.248	S	C	.	.	H	α-helix	trans	-60.5	-45.1	177.2	171.9	0	0	0	0	110.6	Y450 S475 A476 L481 I482 L483	Y450-V479 HydrophobicContact CE1-CB 4.44Å; Y450-V479 HydrophobicContact CE1-CG2 3.97Å; S475-V479 WeakPolarHBondContact O-CG2 3.19Å; S475-V479 PolarHBondContact O-N 2.91Å; A476-V479 PolarHBondContact O-N 2.96Å; V479-L481 VanDerWaalsContact C-N 3.32Å; V479-L481 PolarHBondContact O-N 3.46Å; V479-I482 PolarHBondContact O-N 3.17Å; V479-L483 HydrophobicContact CG1-CD1 4.14Å; V479-L483 WeakPolarHBondContact O-CG 3.38Å; V479-L483 PolarHBondContact O-N 3.44Å
480	N	86.2	Confident	84.8	Confident	14 Å²	14	50 Å²	50	8%	0.075	27%	0.267	C	S	.	.	H	α-helix	trans	-58.4	-44.4	175.7	-170.9	56.9	0	0	0	111.7	V447 A476 A477 I478 I482 L483 I484 S529	V447-N480 HydrophobicContact CG1-CB 4.08Å; V447-N480 HydrophobicContact CG2-CB 4.38Å; A476-N480 VanDerWaalsContact O-CB 3.26Å; A476-N480 WeakPolarHBondContact O-CB 3.27Å; A476-N480 PolarHBondContact O-N 2.9Å; A477-N480 PolarHBondContact O-N 2.73Å; I478-N480 VanDerWaalsContact C-N 3.33Å; I478-N480 PolarHBondContact O-N 3.27Å; N480-I482 PolarHBondContact O-N 3.02Å; N480-L483 PolarHBondContact O-N 3.48Å; N480-I484 WeakPolarHBondContact ND2-CD1 3.22Å; N480-I484 WeakPolarHBondContact O-CB 3.36Å; N480-I484 VanDerWaalsContact O-CG1 3.23Å; N480-I484 WeakPolarHBondContact O-CG1 3.44Å; N480-I484 PolarHBondContact O-N 3.4Å; N480-S529 PolarHBondContact ND2-OG 3.44Å
481	L	81.9	Confident	85.7	Confident	29 Å²	29	46.8 Å²	46.8	15%	0.152	25%	0.251	C	S	.	.	H	α-helix	trans	-61.8	-43.9	178.6	-176.9	62.5	0	0	0	112.3	A477 I478 V479 L483 I484 M485 I581	A477-L481 WeakPolarHBondContact O-CB 3.21Å; A477-L481 PolarHBondContact O-N 2.86Å; I478-L481 WeakPolarHBondContact O-CB 3.28Å; I478-L481 PolarHBondContact O-N 2.99Å; V479-L481 VanDerWaalsContact C-N 3.32Å; V479-L481 PolarHBondContact O-N 3.46Å; L481-L483 PolarHBondContact O-N 2.87Å; L481-I484 PolarHBondContact O-N 2.82Å; L481-M485 HydrophobicContact CG-SD 4.42Å; L481-M485 WeakPolarHBondContact O-CG 3.12Å; L481-M485 PolarHBondContact O-N 3.18Å; L481-I581 HydrophobicContact CD2-CD1 3.7Å
482	I	84.9	Confident	86.1	Confident	97 Å²	97	43.5 Å²	43.5	50%	0.497	24%	0.239	S	C	.	.	H	α-helix	trans	-61.6	-44.7	176.5	-66.4	167.2	0	0	0	110.7	I478 V479 N480 M485 C486	I478-I482 HydrophobicContact CG2-CD1 4.04Å; I478-I482 WeakPolarHBondContact O-CG1 3.43Å; I478-I482 PolarHBondContact O-N 3.43Å; V479-I482 PolarHBondContact O-N 3.17Å; N480-I482 PolarHBondContact O-N 3.02Å; I482-M485 PolarHBondContact O-N 3.37Å; I482-C486 PolarHBondContact O-N 3.43Å; I482-C486 PolarHBondContact O-SG 3.17Å; I482-C486 VanDerWaalsContact O-SG 3.41Å
483	L	88.9	Confident	86.5	Confident	51 Å²	51	46.9 Å²	46.9	27%	0.267	26%	0.26	S	S	.	.	H	α-helix	trans	-61.6	-44.6	177.3	-71.3	172.5	0	0	0	111.7	F443 V447 V479 N480 L481 M485 C486 L487	F443-L483 HydrophobicContact CD1-CD1 4.44Å; F443-L483 HydrophobicContact CD1-CD2 4.39Å; F443-L483 HydrophobicContact CE1-CD2 4.48Å; V447-L483 HydrophobicContact CG2-CD1 3.64Å; V479-L483 HydrophobicContact CG1-CD1 4.14Å; V479-L483 WeakPolarHBondContact O-CG 3.38Å; V479-L483 PolarHBondContact O-N 3.44Å; N480-L483 PolarHBondContact O-N 3.48Å; L481-L483 PolarHBondContact O-N 2.87Å; L483-M485 VanDerWaalsContact C-N 3.34Å; L483-M485 PolarHBondContact O-N 3.12Å; L483-C486 PolarHBondContact O-N 3.1Å; L483-L487 WeakPolarHBondContact O-CB 3.38Å; L483-L487 WeakPolarHBondContact O-CG 3.38Å; L483-L487 PolarHBondContact O-N 2.79Å
484	I	87.1	Confident	87.2	Confident	3 Å²	3	48.6 Å²	48.6	2%	0.015	27%	0.268	C	S	.	.	H	α-helix	trans	-56.4	-48	176.6	-74.5	168.1	0	0	0	110.5	N480 L481 G488 N525 F526	N480-I484 WeakPolarHBondContact ND2-CD1 3.22Å; N480-I484 WeakPolarHBondContact O-CB 3.36Å; N480-I484 VanDerWaalsContact O-CG1 3.23Å; N480-I484 WeakPolarHBondContact O-CG1 3.44Å; N480-I484 PolarHBondContact O-N 3.4Å; L481-I484 PolarHBondContact O-N 2.82Å; I484-G488 PolarHBondContact O-N 2.89Å; I484-N525 WeakPolarHBondContact CD1-O 3.11Å; I484-N525 PolarHBondContact O-ND2 3.43Å; I484-F526 HydrophobicContact CD1-CD1 4.43Å; I484-F526 HydrophobicContact CG2-CD1 3.8Å; I484-F526 HydrophobicContact CG2-CD2 4.24Å; I484-F526 HydrophobicContact CG2-CE1 3.41Å; I484-F526 VanDerWaalsContact CG2-CE1 3.41Å; I484-F526 HydrophobicContact CG2-CE2 3.88Å; I484-F526 HydrophobicContact CG2-CG 4.2Å; I484-F526 HydrophobicContact CG2-CZ 3.45Å; I484-F526 VanDerWaalsContact CG2-CZ 3.45Å
485	M	83.6	Confident	88	Confident	78 Å²	78	44.9 Å²	44.9	38%	0.384	25%	0.248	S	C	.	.	H	α-helix	trans	-63.9	-45.7	-179.6	-68.7	175.7	73.5	0	0	112.4	L481 I482 L483 G488 K489 I581	L481-M485 HydrophobicContact CG-SD 4.42Å; L481-M485 WeakPolarHBondContact O-CG 3.12Å; L481-M485 PolarHBondContact O-N 3.18Å; I482-M485 PolarHBondContact O-N 3.37Å; L483-M485 VanDerWaalsContact C-N 3.34Å; L483-M485 PolarHBondContact O-N 3.12Å; M485-G488 PolarHBondContact O-N 3.01Å; M485-K489 PolarHBondContact O-N 2.82Å; M485-I581 HydrophobicContact CE-CG2 4.14Å
486	C	88.6	Confident	88.4	Confident	78 Å²	78	47.5 Å²	47.5	53%	0.527	25%	0.254	S	S	.	.	H	α-helix	trans	-63.8	-47.3	179.2	-72.3	0	0	0	0	112	I482 L483 G488 K489 V490	I482-C486 PolarHBondContact O-N 3.43Å; I482-C486 PolarHBondContact O-SG 3.17Å; I482-C486 VanDerWaalsContact O-SG 3.41Å; L483-C486 PolarHBondContact O-N 3.1Å; C486-G488 VanDerWaalsContact C-N 3.34Å; C486-G488 PolarHBondContact O-N 3.45Å; C486-K489 PolarHBondContact O-N 3.36Å; C486-V490 WeakPolarHBondContact O-CG2 3.47Å; C486-V490 PolarHBondContact O-N 3.09Å
487	L	91.5	Very high	88.7	Confident	20 Å²	20	53.6 Å²	53.6	11%	0.105	28%	0.279	C	S	.	.	H	α-helix	trans	-65.7	-37.1	179.5	-75.4	170.2	0	0	0	112.1	L439 F443 L483 K489 V490 Y491 F521	L439-L487 HydrophobicContact CD2-CD2 4.42Å; F443-L487 HydrophobicContact CD2-CD1 3.54Å; F443-L487 HydrophobicContact CD2-CD2 4.26Å; F443-L487 HydrophobicContact CD2-CG 4.48Å; F443-L487 HydrophobicContact CE2-CD1 3.91Å; F443-L487 HydrophobicContact CE2-CD2 3.81Å; F443-L487 HydrophobicContact CE2-CG 4.4Å; F443-L487 HydrophobicContact CG-CD1 4.13Å; L483-L487 WeakPolarHBondContact O-CB 3.38Å; L483-L487 WeakPolarHBondContact O-CG 3.38Å; L483-L487 PolarHBondContact O-N 2.79Å; L487-K489 PolarHBondContact O-N 3.29Å; L487-V490 PolarHBondContact O-N 3.44Å; L487-Y491 WeakPolarHBondContact O-CB 3.4Å; L487-Y491 PolarHBondContact O-N 3.05Å; L487-F521 HydrophobicContact CB-CZ 4.11Å
488	G	90.2	Very high	89.4	Confident	2 Å²	2	53.3 Å²	53.3	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-53.7	-52	173.8	0	0	0	0	0	112.1	I484 M485 C486 V490 Y491 E492	I484-G488 PolarHBondContact O-N 2.89Å; M485-G488 PolarHBondContact O-N 3.01Å; C486-G488 VanDerWaalsContact C-N 3.34Å; C486-G488 PolarHBondContact O-N 3.45Å; G488-V490 PolarHBondContact O-N 3.47Å; G488-Y491 PolarHBondContact O-N 2.95Å; G488-E492 WeakPolarHBondContact O-CG 2.99Å; G488-E492 PolarHBondContact O-N 3.3Å
489	K	88.3	Confident	90	Very high	121 Å²	121	49.2 Å²	49.2	53%	0.526	25%	0.253	S	S	.	.	H	α-helix	trans	-65.8	-38.4	-176.7	-166.4	61.1	178.5	175.1	0	113.6	M485 C486 L487 E492 T493	M485-K489 PolarHBondContact O-N 2.82Å; C486-K489 PolarHBondContact O-N 3.36Å; L487-K489 PolarHBondContact O-N 3.29Å; K489-E492 IonicContact NZ-OE2 3.71Å; K489-E492 PolarHBondContact NZ-OE2 3.5Å; K489-T493 PolarHBondContact O-N 2.9Å; K489-T493 PolarHBondContact O-OG1 3.24Å
490	V	92.4	Very high	90.2	Very high	88 Å²	88	49.5 Å²	49.5	53%	0.533	25%	0.251	S	S	.	.	H	α-helix	trans	-63.5	-45.7	175.7	173.6	0	0	0	0	110.1	C486 L487 G488 T493 L494	C486-V490 WeakPolarHBondContact O-CG2 3.47Å; C486-V490 PolarHBondContact O-N 3.09Å; L487-V490 PolarHBondContact O-N 3.44Å; G488-V490 PolarHBondContact O-N 3.47Å; V490-T493 PolarHBondContact O-N 3.44Å; V490-L494 WeakPolarHBondContact O-CB 3.43Å; V490-L494 PolarHBondContact O-N 3.38Å; V490-L494 VanDerWaalsContact O-N 3.13Å
491	Y	94.4	Very high	90.5	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-67.4	-42	-178.9	-174.6	-89.7	0	0	0	112.7	V433 M436 L487 G488 T493 L494 A495 K517 V518 F521	V433-Y491 VanDerWaalsContact CG1-OH 3.32Å; V433-Y491 WeakPolarHBondContact CG1-OH 3.4Å; V433-Y491 WeakPolarHBondContact CG2-OH 3.01Å; M436-Y491 HydrophobicContact CB-CD2 3.82Å; M436-Y491 HydrophobicContact CB-CE2 3.84Å; M436-Y491 HydrophobicContact CE-CD2 4.24Å; M436-Y491 HydrophobicContact CG-CD2 3.91Å; M436-Y491 HydrophobicContact CG-CE2 4.06Å; L487-Y491 WeakPolarHBondContact O-CB 3.4Å; L487-Y491 PolarHBondContact O-N 3.05Å; G488-Y491 PolarHBondContact O-N 2.95Å; Y491-T493 VanDerWaalsContact C-N 3.3Å; Y491-T493 PolarHBondContact O-N 3.22Å; Y491-L494 CarbonylContact O-C 3.1Å; Y491-L494 WeakPolarHBondContact O-CB 3.46Å; Y491-L494 PolarHBondContact O-N 2.93Å; Y491-L494 VanDerWaalsContact O-N 3.12Å; Y491-A495 HydrophobicContact CD1-CB 4.15Å; Y491-A495 HydrophobicContact CE1-CB 3.74Å; Y491-A495 VanDerWaalsContact O-CB 3.3Å; Y491-A495 WeakPolarHBondContact O-CB 3.45Å; Y491-A495 PolarHBondContact O-N 2.82Å; Y491-K517 WeakPolarHBondContact CE1-O 3.41Å; Y491-K517 PolarHBondContact OH-O 2.89Å; Y491-V518 HydrophobicContact CE1-CG2 4.29Å; Y491-F521 HydrophobicContact CD1-CB 3.52Å; Y491-F521 AromaticContact CD1-CD1 3.52Å; Y491-F521 HydrophobicContact CD1-CD1 3.52Å; Y491-F521 HydrophobicContact CD1-CD2 4.25Å; Y491-F521 HydrophobicContact CD1-CE1 4.31Å; Y491-F521 AromaticContact CD1-CG 3.49Å; Y491-F521 HydrophobicContact CD1-CG 3.49Å; Y491-F521 VanDerWaalsContact CD1-CG 3.49Å; Y491-F521 HydrophobicContact CD2-CB 4.04Å; Y491-F521 HydrophobicContact CD2-CD1 4.04Å; Y491-F521 AromaticContact CD2-CD2 3.41Å; Y491-F521 HydrophobicContact CD2-CD2 3.41Å; Y491-F521 VanDerWaalsContact CD2-CD2 3.41Å; Y491-F521 HydrophobicContact CD2-CE1 4.38Å; Y491-F521 AromaticContact CD2-CE2 3.79Å; Y491-F521 HydrophobicContact CD2-CE2 3.79Å; Y491-F521 AromaticContact CD2-CG 3.54Å; Y491-F521 HydrophobicContact CD2-CG 3.54Å; Y491-F521 HydrophobicContact CD2-CZ 4.25Å; Y491-F521 HydrophobicContact CE1-CB 3.33Å; Y491-F521 HydrophobicContact CE1-CD1 4.27Å; Y491-F521 AromaticContact CE1-CG 3.82Å; Y491-F521 HydrophobicContact CE1-CG 3.82Å; Y491-F521 HydrophobicContact CE2-CB 3.84Å; Y491-F521 AromaticContact CE2-CD2 3.72Å; Y491-F521 HydrophobicContact CE2-CD2 3.72Å; Y491-F521 HydrophobicContact CE2-CE2 4.47Å; Y491-F521 AromaticContact CE2-CG 3.84Å; Y491-F521 HydrophobicContact CE2-CG 3.84Å; Y491-F521 HydrophobicContact CG-CB 3.87Å; Y491-F521 AromaticContact CG-CD1 3.39Å; Y491-F521 HydrophobicContact CG-CD1 3.39Å; Y491-F521 AromaticContact CG-CD2 3.69Å; Y491-F521 HydrophobicContact CG-CD2 3.69Å; Y491-F521 AromaticContact CG-CE1 3.78Å; Y491-F521 HydrophobicContact CG-CE1 3.78Å; Y491-F521 HydrophobicContact CG-CE2 4.03Å; Y491-F521 AromaticContact CG-CG 3.34Å; Y491-F521 HydrophobicContact CG-CG 3.34Å; Y491-F521 HydrophobicContact CG-CZ 4.07Å; Y491-F521 VanDerWaalsContact CZ-CB 3.48Å; Y491-F521 AromaticContact CZ-CG 3.96Å
492	E	91.2	Very high	91	Very high	38 Å²	38	53.6 Å²	53.6	18%	0.178	26%	0.264	C	S	.	.	H	α-helix	trans	-54.6	-47.2	175.7	-78.4	159.8	-153.2	0	0	112	G488 K489 L494 A495 Y496 V518 Q522	G488-E492 WeakPolarHBondContact O-CG 2.99Å; G488-E492 PolarHBondContact O-N 3.3Å; K489-E492 IonicContact NZ-OE2 3.71Å; K489-E492 PolarHBondContact NZ-OE2 3.5Å; E492-L494 VanDerWaalsContact C-N 3.29Å; E492-L494 PolarHBondContact O-N 3.48Å; E492-A495 PolarHBondContact O-N 2.9Å; E492-Y496 PolarHBondContact O-N 3.05Å; E492-V518 HydrophobicContact CG-CG1 4.03Å; E492-Q522 PolarHBondContact OE1-NE2 3.09Å
493	T	91.4	Very high	91.3	Very high	71 Å²	71	50 Å²	50	44%	0.436	25%	0.245	S	C	.	.	H	α-helix	trans	-62.3	-40.5	178.6	-54.4	0	0	0	0	111.4	K489 V490 Y491 K497	K489-T493 PolarHBondContact O-N 2.9Å; K489-T493 PolarHBondContact O-OG1 3.24Å; V490-T493 PolarHBondContact O-N 3.44Å; Y491-T493 VanDerWaalsContact C-N 3.3Å; Y491-T493 PolarHBondContact O-N 3.22Å; T493-K497 WeakPolarHBondContact O-CG 3.21Å; T493-K497 PolarHBondContact O-N 2.74Å
494	L	94.1	Very high	91.5	Very high	56 Å²	56	48.5 Å²	48.5	29%	0.293	24%	0.237	S	C	.	.	H	α-helix	trans	-68.4	-45.8	177.8	-180	59.6	0	0	0	111.4	M436 V490 Y491 E492 Y496 K497 M498	M436-L494 HydrophobicContact CG-CD2 4.05Å; M436-L494 HydrophobicContact SD-CD2 4.23Å; V490-L494 WeakPolarHBondContact O-CB 3.43Å; V490-L494 PolarHBondContact O-N 3.38Å; V490-L494 VanDerWaalsContact O-N 3.13Å; Y491-L494 CarbonylContact O-C 3.1Å; Y491-L494 WeakPolarHBondContact O-CB 3.46Å; Y491-L494 PolarHBondContact O-N 2.93Å; Y491-L494 VanDerWaalsContact O-N 3.12Å; E492-L494 VanDerWaalsContact C-N 3.29Å; E492-L494 PolarHBondContact O-N 3.48Å; L494-Y496 VanDerWaalsContact C-N 3.35Å; L494-Y496 PolarHBondContact O-N 2.94Å; L494-K497 PolarHBondContact O-N 3.32Å; L494-M498 HydrophobicContact CD1-CG 4.2Å; L494-M498 HydrophobicContact CD1-SD 4.02Å; L494-M498 HydrophobicContact CD2-SD 4.31Å; L494-M498 HydrophobicContact CG-CG 4.37Å; L494-M498 HydrophobicContact CG-SD 3.63Å; L494-M498 WeakPolarHBondContact O-CB 3.42Å; L494-M498 WeakPolarHBondContact O-CG 3.47Å; L494-M498 PolarHBondContact O-N 3.15Å
495	A	95.1	Very high	91.6	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.6	-39.3	179.8	0	0	0	0	0	112.2	Y491 E492 M498 T499 L514 V518	Y491-A495 HydrophobicContact CD1-CB 4.15Å; Y491-A495 HydrophobicContact CE1-CB 3.74Å; Y491-A495 VanDerWaalsContact O-CB 3.3Å; Y491-A495 WeakPolarHBondContact O-CB 3.45Å; Y491-A495 PolarHBondContact O-N 2.82Å; E492-A495 PolarHBondContact O-N 2.9Å; A495-M498 PolarHBondContact O-N 3.01Å; A495-T499 WeakPolarHBondContact O-CB 3.34Å; A495-T499 PolarHBondContact O-N 3.4Å; A495-T499 PolarHBondContact O-OG1 3.1Å; A495-L514 HydrophobicContact CB-CD1 4.01Å; A495-V518 HydrophobicContact CB-CG2 3.67Å
496	Y	92.9	Very high	92	Very high	85 Å²	85	49.4 Å²	49.4	33%	0.333	24%	0.237	S	C	.	.	H	α-helix	trans	-60.4	-51	173.4	-179	-99.5	0	0	0	111.3	E492 L494 M498 T499 Q500 F510 L514	E492-Y496 PolarHBondContact O-N 3.05Å; L494-Y496 VanDerWaalsContact C-N 3.35Å; L494-Y496 PolarHBondContact O-N 2.94Å; Y496-M498 PolarHBondContact O-N 3.11Å; Y496-T499 PolarHBondContact O-N 3.22Å; Y496-Q500 HydrophobicContact CD1-CG 4.35Å; Y496-Q500 HydrophobicContact CE1-CG 4Å; Y496-Q500 HydrophobicContact CE2-CG 4.47Å; Y496-Q500 WeakPolarHBondContact O-CG 3.34Å; Y496-Q500 PolarHBondContact O-N 3.2Å; Y496-Q500 PolarHBondContact OH-NE2 2.73Å; Y496-Q500 VanDerWaalsContact OH-NE2 3.1Å; Y496-F510 HydrophobicContact CD2-CZ 4.16Å; Y496-F510 HydrophobicContact CE2-CE1 4.23Å; Y496-F510 AromaticContact CE2-CZ 3.93Å; Y496-F510 HydrophobicContact CE2-CZ 3.93Å; Y496-L514 HydrophobicContact CD2-CD2 4.13Å
497	K	92.3	Very high	92.1	Very high	135 Å²	135	48.7 Å²	48.7	59%	0.587	23%	0.226	S	C	*	.	H	α-helix	trans	-61.1	-42.4	178.1	-72	178.4	-179.5	179.4	0	112.5	T493 L494 Q500 W501	T493-K497 WeakPolarHBondContact O-CG 3.21Å; T493-K497 PolarHBondContact O-N 2.74Å; L494-K497 PolarHBondContact O-N 3.32Å; K497-Q500 PolarHBondContact O-N 2.79Å; K497-W501 PolarHBondContact O-N 3.37Å
498	M	93.8	Very high	92.1	Very high	18 Å²	18	49 Å²	49	9%	0.089	23%	0.23	C	C	.	.	H	α-helix	trans	-62.8	-45.5	176.7	-71.2	165	59.9	0	0	111.5	G429 C432 V433 L494 A495 Y496 Q500 W501 E502 K517	G429-M498 WeakPolarHBondContact O-CE 3.32Å; C432-M498 HydrophobicContact CB-CE 3.68Å; C432-M498 HydrophobicContact CB-SD 4.13Å; C432-M498 VanDerWaalsContact SG-SD 3.68Å; V433-M498 HydrophobicContact CG2-CE 3.82Å; L494-M498 HydrophobicContact CD1-CG 4.2Å; L494-M498 HydrophobicContact CD1-SD 4.02Å; L494-M498 HydrophobicContact CD2-SD 4.31Å; L494-M498 HydrophobicContact CG-CG 4.37Å; L494-M498 HydrophobicContact CG-SD 3.63Å; L494-M498 WeakPolarHBondContact O-CB 3.42Å; L494-M498 WeakPolarHBondContact O-CG 3.47Å; L494-M498 PolarHBondContact O-N 3.15Å; A495-M498 PolarHBondContact O-N 3.01Å; Y496-M498 PolarHBondContact O-N 3.11Å; M498-Q500 VanDerWaalsContact C-N 3.34Å; M498-Q500 PolarHBondContact O-N 2.73Å; M498-W501 WeakPolarHBondContact O-CB 3.43Å; M498-W501 PolarHBondContact O-N 2.91Å; M498-W501 VanDerWaalsContact O-N 3.13Å; M498-E502 WeakPolarHBondContact O-CG 3.37Å; M498-E502 PolarHBondContact O-N 3.09Å; M498-E502 VanDerWaalsContact O-N 3.1Å; M498-K517 HydrophobicContact CE-CD 4.47Å
499	T	94.1	Very high	92.2	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-70	-33.2	-178.5	-50.7	0	0	0	0	111.4	A495 Y496 W501 E502 F510 Q513 L514	A495-T499 WeakPolarHBondContact O-CB 3.34Å; A495-T499 PolarHBondContact O-N 3.4Å; A495-T499 PolarHBondContact O-OG1 3.1Å; Y496-T499 PolarHBondContact O-N 3.22Å; T499-W501 VanDerWaalsContact C-N 3.32Å; T499-E502 PolarHBondContact O-N 3.43Å; T499-F510 HydrophobicContact CG2-CD2 3.75Å; T499-F510 HydrophobicContact CG2-CE2 3.72Å; T499-F510 HydrophobicContact CG2-CG 4.38Å; T499-F510 HydrophobicContact CG2-CZ 4.32Å; T499-Q513 HydrophobicContact CG2-CB 4.33Å; T499-Q513 HydrophobicContact CG2-CG 4.29Å; T499-L514 HydrophobicContact CG2-CB 4.12Å
500	Q	91.4	Very high	92.4	Very high	56 Å²	56	47.7 Å²	47.7	26%	0.262	23%	0.225	S	C	.	.	H	α-helix	trans	-61.6	-41.8	169.2	-75.2	-173.2	-52.8	0	0	111.6	Y496 K497 M498 E502 M503 F510	Y496-Q500 HydrophobicContact CD1-CG 4.35Å; Y496-Q500 HydrophobicContact CE1-CG 4Å; Y496-Q500 HydrophobicContact CE2-CG 4.47Å; Y496-Q500 WeakPolarHBondContact O-CG 3.34Å; Y496-Q500 PolarHBondContact O-N 3.2Å; Y496-Q500 PolarHBondContact OH-NE2 2.73Å; Y496-Q500 VanDerWaalsContact OH-NE2 3.1Å; K497-Q500 PolarHBondContact O-N 2.79Å; M498-Q500 VanDerWaalsContact C-N 3.34Å; M498-Q500 PolarHBondContact O-N 2.73Å; Q500-E502 VanDerWaalsContact C-N 3.29Å; Q500-E502 PolarHBondContact O-N 3.47Å; Q500-M503 PolarHBondContact O-N 3.02Å; Q500-F510 HydrophobicContact CB-CE2 4.47Å; Q500-F510 HydrophobicContact CG-CE2 3.9Å; Q500-F510 HydrophobicContact CG-CZ 3.95Å
501	W	91.9	Very high	92.4	Very high	129 Å²	129	45.2 Å²	45.2	49%	0.489	21%	0.209	S	C	.	.	H	α-helix	trans	-66.4	-28.8	179	-176.5	64.8	0	0	0	113.6	R425 A428 K497 M498 T499 M503	R425-W501 HydrophobicContact CB-CD2 4.29Å; R425-W501 HydrophobicContact CB-CE3 3.84Å; R425-W501 HydrophobicContact CB-CH2 3.94Å; R425-W501 HydrophobicContact CB-CZ2 4.36Å; R425-W501 HydrophobicContact CB-CZ3 3.66Å; R425-W501 WeakPolarHBondContact CD-O 3.31Å; R425-W501 HydrophobicContact CG-CD2 4.13Å; R425-W501 HydrophobicContact CG-CE3 4.12Å; R425-W501 HydrophobicContact CG-CH2 3.69Å; R425-W501 HydrophobicContact CG-CZ2 3.67Å; R425-W501 HydrophobicContact CG-CZ3 3.91Å; R425-W501 PolarHBondContact NH1-O 3.12Å; R425-W501 WeakPolarHBondContact O-CZ3 3.37Å; A428-W501 HydrophobicContact CB-CH2 4.02Å; A428-W501 HydrophobicContact CB-CZ3 3.88Å; K497-W501 PolarHBondContact O-N 3.37Å; M498-W501 WeakPolarHBondContact O-CB 3.43Å; M498-W501 PolarHBondContact O-N 2.91Å; M498-W501 VanDerWaalsContact O-N 3.13Å; T499-W501 VanDerWaalsContact C-N 3.32Å; W501-M503 PolarHBondContact O-N 3.43Å
502	E	92.9	Very high	92.4	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-15.8	177.5	-73.6	171.3	-173.8	0	0	114.5	R422 I426 M498 T499 Q500 H504 Q513 K517	R422-E502 WeakPolarHBondContact CG-O 3.3Å; I426-E502 HydrophobicContact CG1-CB 4.35Å; I426-E502 HydrophobicContact CG1-CG 3.95Å; M498-E502 WeakPolarHBondContact O-CG 3.37Å; M498-E502 PolarHBondContact O-N 3.09Å; M498-E502 VanDerWaalsContact O-N 3.1Å; T499-E502 PolarHBondContact O-N 3.43Å; Q500-E502 VanDerWaalsContact C-N 3.29Å; Q500-E502 PolarHBondContact O-N 3.47Å; E502-H504 IonicContact OE2-CD2 3.13Å; E502-H504 IonicContact OE2-CE1 3.87Å; E502-H504 IonicContact OE2-NE2 2.79Å; E502-H504 PolarHBondContact OE2-NE2 3.23Å; E502-Q513 WeakPolarHBondContact OE2-CG 3.49Å; E502-K517 WeakPolarHBondContact OE1-CE 3.49Å; E502-K517 IonicContact OE1-NZ 3.23Å; E502-K517 PolarHBondContact OE1-NZ 3.3Å; E502-K517 IonicContact OE2-NZ 2.96Å; E502-K517 PolarHBondContact OE2-NZ 2.68Å
503	M	91.1	Very high	92.5	Very high	21 Å²	21	47.7 Å²	47.7	10%	0.103	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	59.5	174	-67	-65.3	-64.2	0	0	113.7	Y397 H400 F417 R422 Q500 W501	Y397-M503 HydrophobicContact CD2-CB 4.35Å; Y397-M503 HydrophobicContact CD2-CE 3.82Å; Y397-M503 HydrophobicContact CE2-CB 4.39Å; Y397-M503 HydrophobicContact CE2-CE 4.34Å; Y397-M503 VanDerWaalsContact CE2-O 3.29Å; Y397-M503 WeakPolarHBondContact CE2-O 3.38Å; Y397-M503 HydrophobicContact CG-CE 4.49Å; H400-M503 HydrophobicContact CB-CE 3.44Å; H400-M503 VanDerWaalsContact CB-CE 3.44Å; H400-M503 HydrophobicContact CB-SD 4.04Å; F417-M503 HydrophobicContact CD1-CB 4.23Å; F417-M503 HydrophobicContact CE1-CB 4.4Å; F417-M503 HydrophobicContact CG-CB 4.34Å; R422-M503 PolarHBondContact NE-O 2.98Å; R422-M503 VanDerWaalsContact NE-O 3.09Å; R422-M503 PolarHBondContact NH2-O 3.27Å; Q500-M503 PolarHBondContact O-N 3.02Å; W501-M503 PolarHBondContact O-N 3.43Å
504	H	92.4	Very high	92.7	Very high	19 Å²	19	45.5 Å²	45.5	9%	0.088	21%	0.207	C	C	.	.			trans	-70.2	144.4	171.4	-65.6	-65.2	0	0	0	111.7	Y397 E502 E509 F510 Q513	Y397-H504 WeakPolarHBondContact CD2-O 3.26Å; E502-H504 IonicContact OE2-CD2 3.13Å; E502-H504 IonicContact OE2-CE1 3.87Å; E502-H504 IonicContact OE2-NE2 2.79Å; E502-H504 PolarHBondContact OE2-NE2 3.23Å; H504-E509 HydrophobicContact CB-CB 4.23Å; H504-F510 HydrophobicContact CB-CB 4.05Å; H504-Q513 WeakPolarHBondContact NE2-CG 3.41Å
505	R	90.7	Very high	92.7	Very high	87 Å²	87	43.7 Å²	43.7	33%	0.328	20%	0.198	S	C	.	.	S	Bend	trans	-76.1	-48.6	-171.1	179	-176.1	176.4	-160.2	0.5	111.4	P393 R394 Y397 N407 E414 E509	P393-R505 CarbonylContact C-O 3.57Å; P393-R505 WeakPolarHBondContact CA-O 3.33Å; P393-R505 HydrophobicContact CB-CG 4.3Å; R394-R505 PolarHBondContact N-O 3.36Å; Y397-R505 HydrophobicContact CD1-CG 4.38Å; Y397-R505 HydrophobicContact CE1-CB 4.27Å; Y397-R505 HydrophobicContact CE1-CG 4.02Å; N407-R505 PolarHBondContact ND2-NH2 2.85Å; E414-R505 IonicContact OE1-NH2 3.12Å; E414-R505 IonicContact OE2-CZ 3.9Å; E414-R505 IonicContact OE2-NE 3.74Å; E414-R505 IonicContact OE2-NH2 3.46Å; E414-R505 PolarHBondContact OE2-NH2 3.06Å; R505-E509 PolarHBondContact N-OE2 3.4Å
506	T	91.2	Very high	92.6	Very high	14 Å²	14	48.3 Å²	48.3	9%	0.086	22%	0.218	C	C	.	.	S	Bend	trans	-107.1	162	-176	76.1	0	0	0	0	112.3	E391 S508 E509 F510	E391-T506 HydrophobicContact CG-CG2 4.19Å; E391-T506 WeakPolarHBondContact OE1-CB 3.16Å; E391-T506 WeakPolarHBondContact OE2-CB 3.28Å; E391-T506 PolarHBondContact OE2-OG1 3.27Å; T506-S508 VanDerWaalsContact C-N 3.35Å; T506-E509 WeakPolarHBondContact OG1-CG 3.32Å; T506-E509 PolarHBondContact OG1-N 3.24Å; T506-F510 WeakPolarHBondContact O-CB 3.43Å; T506-F510 PolarHBondContact O-N 3.16Å; T506-F510 VanDerWaalsContact O-N 3.12Å
507	Q	90.4	Very high	92.7	Very high	62 Å²	62	44.5 Å²	44.5	29%	0.29	20%	0.203	S	C	.	.	H	α-helix	trans	-68.9	-37.3	178.6	-173.5	62.4	31.1	0	0	110.6	E391 F510 D511	E391-Q507 PolarHBondContact OE1-N 3Å; Q507-F510 PolarHBondContact O-N 3.28Å; Q507-D511 PolarHBondContact NE2-OD1 3.44Å; Q507-D511 WeakPolarHBondContact O-CB 3.46Å; Q507-D511 PolarHBondContact O-N 3.49Å
508	S	91.5	Very high	92.8	Very high	26 Å²	26	38.2 Å²	38.2	18%	0.182	18%	0.176	C	C	.	.	H	α-helix	trans	-63.5	-42.6	176.8	-54.5	0	0	0	0	112.2	E391 T506 N512	E391-S508 VanDerWaalsContact CD-OG 3.28Å; E391-S508 VanDerWaalsContact OE1-CB 3.25Å; E391-S508 WeakPolarHBondContact OE1-CB 3.49Å; E391-S508 PolarHBondContact OE1-N 2.82Å; E391-S508 PolarHBondContact OE1-OG 3.12Å; E391-S508 PolarHBondContact OE2-OG 3.36Å; T506-S508 VanDerWaalsContact C-N 3.35Å; S508-N512 WeakPolarHBondContact O-CB 3.43Å; S508-N512 PolarHBondContact O-N 3.43Å; S508-N512 PolarHBondContact O-ND2 2.89Å
509	E	92.1	Very high	92.8	Very high	91 Å²	91	37.7 Å²	37.7	43%	0.425	17%	0.173	S	C	.	.	H	α-helix	trans	-63.1	-44.2	174	-75.9	-178.3	167.4	0	0	112.1	H504 R505 T506 Q513	H504-E509 HydrophobicContact CB-CB 4.23Å; R505-E509 PolarHBondContact N-OE2 3.4Å; T506-E509 WeakPolarHBondContact OG1-CG 3.32Å; T506-E509 PolarHBondContact OG1-N 3.24Å; E509-Q513 VanDerWaalsContact O-CB 3.32Å; E509-Q513 WeakPolarHBondContact O-CB 3.46Å; E509-Q513 PolarHBondContact O-N 2.86Å
510	F	93.6	Very high	92.7	Very high	6 Å²	6	40.8 Å²	40.8	3%	0.026	19%	0.189	C	C	.	.	H	α-helix	trans	-60.3	-50.8	177.4	177.1	-90.7	0	0	0	111.5	R394 Y496 T499 Q500 H504 T506 Q507 Q513 L514	R394-F510 VanDerWaalsContact NH1-CD2 3.28Å; Y496-F510 HydrophobicContact CD2-CZ 4.16Å; Y496-F510 HydrophobicContact CE2-CE1 4.23Å; Y496-F510 AromaticContact CE2-CZ 3.93Å; Y496-F510 HydrophobicContact CE2-CZ 3.93Å; T499-F510 HydrophobicContact CG2-CD2 3.75Å; T499-F510 HydrophobicContact CG2-CE2 3.72Å; T499-F510 HydrophobicContact CG2-CG 4.38Å; T499-F510 HydrophobicContact CG2-CZ 4.32Å; Q500-F510 HydrophobicContact CB-CE2 4.47Å; Q500-F510 HydrophobicContact CG-CE2 3.9Å; Q500-F510 HydrophobicContact CG-CZ 3.95Å; H504-F510 HydrophobicContact CB-CB 4.05Å; T506-F510 WeakPolarHBondContact O-CB 3.43Å; T506-F510 PolarHBondContact O-N 3.16Å; T506-F510 VanDerWaalsContact O-N 3.12Å; Q507-F510 PolarHBondContact O-N 3.28Å; F510-Q513 PolarHBondContact O-N 3.11Å; F510-L514 HydrophobicContact CE1-CD2 4.18Å; F510-L514 WeakPolarHBondContact O-CB 3.28Å; F510-L514 PolarHBondContact O-N 3.4Å
511	D	92.3	Very high	92.9	Very high	36 Å²	36	38.1 Å²	38.1	19%	0.193	18%	0.177	C	C	.	.	H	α-helix	trans	-61.8	-47.5	179.3	-75.9	-1.5	0	0	0	110.4	K270 Q507 Q513 L514 I515	K270-D511 IonicContact NZ-OD2 3.19Å; K270-D511 PolarHBondContact NZ-OD2 3.1Å; Q507-D511 PolarHBondContact NE2-OD1 3.44Å; Q507-D511 WeakPolarHBondContact O-CB 3.46Å; Q507-D511 PolarHBondContact O-N 3.49Å; D511-Q513 VanDerWaalsContact C-N 3.33Å; D511-Q513 PolarHBondContact O-N 2.73Å; D511-L514 PolarHBondContact O-N 3.5Å; D511-I515 HydrophobicContact CB-CD1 4.42Å; D511-I515 VanDerWaalsContact O-CB 3.31Å; D511-I515 WeakPolarHBondContact O-CB 3.26Å; D511-I515 VanDerWaalsContact O-CD1 3.32Å; D511-I515 WeakPolarHBondContact O-CD1 3.29Å; D511-I515 WeakPolarHBondContact O-CG1 3.15Å; D511-I515 PolarHBondContact O-N 3.4Å
512	N	94	Very high	92.9	Very high	44 Å²	44	32.4 Å²	32.4	24%	0.235	16%	0.156	C	C	.	.	H	α-helix	trans	-58.3	-43.4	178.5	-77.5	-30.5	0	0	0	112.3	S508 F516 V692	S508-N512 WeakPolarHBondContact O-CB 3.43Å; S508-N512 PolarHBondContact O-N 3.43Å; S508-N512 PolarHBondContact O-ND2 2.89Å; N512-F516 WeakPolarHBondContact O-CB 3.11Å; N512-F516 PolarHBondContact O-N 3.27Å; N512-V692 HydrophobicContact CB-CB 4.13Å; N512-V692 HydrophobicContact CB-CG1 4.34Å; N512-V692 WeakPolarHBondContact OD1-CB 3.21Å; N512-V692 PolarHBondContact OD1-N 2.88Å
513	Q	94.1	Very high	92.9	Very high	46 Å²	46	33.6 Å²	33.6	22%	0.215	16%	0.161	C	C	.	.	H	α-helix	trans	-73.7	-34.8	-179.1	-177.5	55.9	71.5	0	0	112.5	T499 E502 H504 E509 F510 D511 K517	T499-Q513 HydrophobicContact CG2-CB 4.33Å; T499-Q513 HydrophobicContact CG2-CG 4.29Å; E502-Q513 WeakPolarHBondContact OE2-CG 3.49Å; H504-Q513 WeakPolarHBondContact NE2-CG 3.41Å; E509-Q513 VanDerWaalsContact O-CB 3.32Å; E509-Q513 WeakPolarHBondContact O-CB 3.46Å; E509-Q513 PolarHBondContact O-N 2.86Å; F510-Q513 PolarHBondContact O-N 3.11Å; D511-Q513 VanDerWaalsContact C-N 3.33Å; D511-Q513 PolarHBondContact O-N 2.73Å; Q513-K517 VanDerWaalsContact CD-NZ 3.32Å; Q513-K517 WeakPolarHBondContact O-CG 3.27Å; Q513-K517 PolarHBondContact O-N 3.18Å
514	L	94	Very high	93	Very high	25 Å²	25	33.5 Å²	33.5	13%	0.131	16%	0.162	C	C	.	.	H	α-helix	trans	-64.2	-50.8	172.3	177.7	59.6	0	0	0	110.4	A495 Y496 T499 F510 D511 F516 K517 V518	A495-L514 HydrophobicContact CB-CD1 4.01Å; Y496-L514 HydrophobicContact CD2-CD2 4.13Å; T499-L514 HydrophobicContact CG2-CB 4.12Å; F510-L514 HydrophobicContact CE1-CD2 4.18Å; F510-L514 WeakPolarHBondContact O-CB 3.28Å; F510-L514 PolarHBondContact O-N 3.4Å; D511-L514 PolarHBondContact O-N 3.5Å; L514-F516 VanDerWaalsContact C-N 3.32Å; L514-F516 PolarHBondContact O-N 3.31Å; L514-K517 PolarHBondContact O-N 2.57Å; L514-V518 HydrophobicContact CD1-CG2 4.06Å; L514-V518 WeakPolarHBondContact O-CG2 3.48Å; L514-V518 PolarHBondContact O-N 3.22Å
515	I	94.4	Very high	93	Very high	17 Å²	17	32.9 Å²	32.9	9%	0.087	16%	0.159	C	C	.	.	H	α-helix	trans	-55.4	-48.4	178.7	-70.8	160.1	0	0	0	110.5	D511 K517 V518 F519 F633 V692 W693 I696	D511-I515 HydrophobicContact CB-CD1 4.42Å; D511-I515 VanDerWaalsContact O-CB 3.31Å; D511-I515 WeakPolarHBondContact O-CB 3.26Å; D511-I515 VanDerWaalsContact O-CD1 3.32Å; D511-I515 WeakPolarHBondContact O-CD1 3.29Å; D511-I515 WeakPolarHBondContact O-CG1 3.15Å; D511-I515 PolarHBondContact O-N 3.4Å; I515-K517 PolarHBondContact O-N 2.95Å; I515-V518 PolarHBondContact O-N 3.45Å; I515-F519 VanDerWaalsContact O-CB 3.22Å; I515-F519 WeakPolarHBondContact O-CB 3.21Å; I515-F519 PolarHBondContact O-N 2.9Å; I515-F633 HydrophobicContact CB-CE2 4.14Å; I515-F633 HydrophobicContact CG1-CD2 3.64Å; I515-F633 HydrophobicContact CG1-CE2 3.7Å; I515-F633 HydrophobicContact CG2-CE2 4.34Å; I515-V692 HydrophobicContact CB-CG1 3.6Å; I515-V692 HydrophobicContact CD1-CG1 4.08Å; I515-V692 HydrophobicContact CG1-CG1 4.45Å; I515-V692 HydrophobicContact CG2-CG1 3.29Å; I515-W693 HydrophobicContact CB-CZ2 4.35Å; I515-W693 HydrophobicContact CD1-CZ2 4.33Å; I515-W693 HydrophobicContact CG1-CZ2 3.98Å; I515-W693 HydrophobicContact CG2-CD2 3.76Å; I515-W693 HydrophobicContact CG2-CE3 3.83Å; I515-W693 HydrophobicContact CG2-CH2 3.56Å; I515-W693 HydrophobicContact CG2-CZ2 3.45Å; I515-W693 VanDerWaalsContact CG2-CZ2 3.45Å; I515-W693 HydrophobicContact CG2-CZ3 3.74Å; I515-I696 HydrophobicContact CG2-CD1 3.97Å
516	F	93.7	Very high	92.9	Very high	97 Å²	97	29.5 Å²	29.5	43%	0.425	15%	0.146	S	C	.	.	H	α-helix	trans	-59.7	-43.2	-179.5	180	-102.4	0	0	0	112.7	N512 L514 L520	N512-F516 WeakPolarHBondContact O-CB 3.11Å; N512-F516 PolarHBondContact O-N 3.27Å; L514-F516 VanDerWaalsContact C-N 3.32Å; L514-F516 PolarHBondContact O-N 3.31Å; F516-L520 WeakPolarHBondContact O-CB 3.21Å; F516-L520 PolarHBondContact O-N 3.28Å
517	K	94.2	Very high	93	Very high	6 Å²	6	28.8 Å²	28.8	3%	0.026	14%	0.142	C	C	.	.	H	α-helix	trans	-65.1	-49.1	178.5	-73.7	-172.4	-177.7	78.8	0	111.8	V433 Y491 M498 E502 Q513 L514 I515 L520 F521	V433-K517 HydrophobicContact CG2-CD 4.11Å; V433-K517 HydrophobicContact CG2-CG 4.24Å; Y491-K517 WeakPolarHBondContact CE1-O 3.41Å; Y491-K517 PolarHBondContact OH-O 2.89Å; M498-K517 HydrophobicContact CE-CD 4.47Å; E502-K517 WeakPolarHBondContact OE1-CE 3.49Å; E502-K517 IonicContact OE1-NZ 3.23Å; E502-K517 PolarHBondContact OE1-NZ 3.3Å; E502-K517 IonicContact OE2-NZ 2.96Å; E502-K517 PolarHBondContact OE2-NZ 2.68Å; Q513-K517 VanDerWaalsContact CD-NZ 3.32Å; Q513-K517 WeakPolarHBondContact O-CG 3.27Å; Q513-K517 PolarHBondContact O-N 3.18Å; L514-K517 PolarHBondContact O-N 2.57Å; I515-K517 PolarHBondContact O-N 2.95Å; K517-L520 PolarHBondContact O-N 2.97Å; K517-F521 PolarHBondContact O-N 3.44Å; K517-F521 VanDerWaalsContact O-N 3.16Å
518	V	94.1	Very high	93	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.012	14%	0.135	C	C	.	.	H	α-helix	trans	-64.7	-42.6	180	-177.4	0	0	0	0	111	Y491 E492 A495 L514 I515 L520 F521 Q522 F633 L637	Y491-V518 HydrophobicContact CE1-CG2 4.29Å; E492-V518 HydrophobicContact CG-CG1 4.03Å; A495-V518 HydrophobicContact CB-CG2 3.67Å; L514-V518 HydrophobicContact CD1-CG2 4.06Å; L514-V518 WeakPolarHBondContact O-CG2 3.48Å; L514-V518 PolarHBondContact O-N 3.22Å; I515-V518 PolarHBondContact O-N 3.45Å; V518-L520 PolarHBondContact O-N 3.4Å; V518-F521 PolarHBondContact O-N 2.85Å; V518-Q522 HydrophobicContact CG1-CG 3.91Å; V518-Q522 WeakPolarHBondContact O-CB 3.25Å; V518-Q522 WeakPolarHBondContact O-CG 3.44Å; V518-Q522 PolarHBondContact O-N 2.84Å; V518-F633 HydrophobicContact CB-CE1 4.21Å; V518-F633 HydrophobicContact CB-CE2 4.32Å; V518-F633 HydrophobicContact CB-CZ 3.5Å; V518-F633 HydrophobicContact CG1-CE1 3.71Å; V518-F633 HydrophobicContact CG1-CZ 3.37Å; V518-F633 HydrophobicContact CG2-CE1 4.5Å; V518-F633 HydrophobicContact CG2-CZ 4.09Å; V518-L637 HydrophobicContact CG1-CD2 4.36Å
519	F	94.4	Very high	92.7	Very high	8 Å²	8	26 Å²	26	4%	0.035	13%	0.13	C	C	.	.	H	α-helix	trans	-59	-47.5	174.2	173.3	-99.2	0	0	0	112	I515 F521 Q522 F523 V640 W693 I696 L700	I515-F519 VanDerWaalsContact O-CB 3.22Å; I515-F519 WeakPolarHBondContact O-CB 3.21Å; I515-F519 PolarHBondContact O-N 2.9Å; F519-F521 VanDerWaalsContact C-N 3.31Å; F519-F521 PolarHBondContact O-N 2.93Å; F519-Q522 PolarHBondContact O-N 3.5Å; F519-F523 HydrophobicContact CE1-CB 4.28Å; F519-F523 HydrophobicContact CE1-CD2 4.31Å; F519-F523 HydrophobicContact CE2-CB 4.41Å; F519-F523 HydrophobicContact CE2-CD2 4.34Å; F519-F523 HydrophobicContact CZ-CB 4.12Å; F519-F523 AromaticContact CZ-CD2 3.7Å; F519-F523 HydrophobicContact CZ-CD2 3.7Å; F519-F523 HydrophobicContact CZ-CG 4.24Å; F519-F523 WeakPolarHBondContact O-CB 3.43Å; F519-F523 PolarHBondContact O-N 2.97Å; F519-V640 HydrophobicContact CD2-CG1 4.31Å; F519-V640 HydrophobicContact CE2-CG1 3.96Å; F519-W693 HydrophobicContact CD2-CZ3 4.49Å; F519-I696 HydrophobicContact CB-CD1 3.92Å; F519-I696 HydrophobicContact CD1-CD1 3.95Å; F519-I696 HydrophobicContact CD1-CG1 3.97Å; F519-I696 HydrophobicContact CD1-CG2 3.89Å; F519-I696 HydrophobicContact CD2-CD1 4.37Å; F519-I696 HydrophobicContact CD2-CG2 3.75Å; F519-I696 HydrophobicContact CE1-CB 4.47Å; F519-I696 HydrophobicContact CE1-CG1 4.26Å; F519-I696 HydrophobicContact CE1-CG2 3.55Å; F519-I696 HydrophobicContact CE2-CG2 3.39Å; F519-I696 HydrophobicContact CG-CD1 3.79Å; F519-I696 HydrophobicContact CG-CG1 4.27Å; F519-I696 HydrophobicContact CG-CG2 3.98Å; F519-I696 HydrophobicContact CZ-CG2 3.29Å; F519-L700 HydrophobicContact CZ-CD1 4.47Å; F519-L700 HydrophobicContact CZ-CD2 4.15Å; F519-L700 HydrophobicContact CZ-CG 4.39Å
520	L	93.3	Very high	92.6	Very high	65 Å²	65	21.7 Å²	21.7	34%	0.34	11%	0.109	S	C	.	.	H	α-helix	trans	-57.8	-44.9	-179.6	-179.3	64.6	0	0	0	111.8	V433 F516 K517 V518 V524	V433-L520 HydrophobicContact CG1-CD2 3.94Å; F516-L520 WeakPolarHBondContact O-CB 3.21Å; F516-L520 PolarHBondContact O-N 3.28Å; K517-L520 PolarHBondContact O-N 2.97Å; V518-L520 PolarHBondContact O-N 3.4Å; L520-V524 WeakPolarHBondContact O-CG2 3.5Å; L520-V524 PolarHBondContact O-N 3.43Å
521	F	94.1	Very high	92.5	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-65.3	-49.7	176.4	176.5	-95.5	0	0	0	112.1	M436 V440 L487 Y491 K517 V518 F519 F523 V524 N525	M436-F521 HydrophobicContact CB-CD2 4.06Å; M436-F521 HydrophobicContact CB-CE2 3.98Å; M436-F521 HydrophobicContact CE-CE2 4.29Å; V440-F521 HydrophobicContact CG2-CD2 4.28Å; V440-F521 HydrophobicContact CG2-CE2 3.44Å; V440-F521 VanDerWaalsContact CG2-CE2 3.44Å; V440-F521 HydrophobicContact CG2-CZ 3.73Å; L487-F521 HydrophobicContact CB-CZ 4.11Å; Y491-F521 HydrophobicContact CD1-CB 3.52Å; Y491-F521 AromaticContact CD1-CD1 3.52Å; Y491-F521 HydrophobicContact CD1-CD1 3.52Å; Y491-F521 HydrophobicContact CD1-CD2 4.25Å; Y491-F521 HydrophobicContact CD1-CE1 4.31Å; Y491-F521 AromaticContact CD1-CG 3.49Å; Y491-F521 HydrophobicContact CD1-CG 3.49Å; Y491-F521 VanDerWaalsContact CD1-CG 3.49Å; Y491-F521 HydrophobicContact CD2-CB 4.04Å; Y491-F521 HydrophobicContact CD2-CD1 4.04Å; Y491-F521 AromaticContact CD2-CD2 3.41Å; Y491-F521 HydrophobicContact CD2-CD2 3.41Å; Y491-F521 VanDerWaalsContact CD2-CD2 3.41Å; Y491-F521 HydrophobicContact CD2-CE1 4.38Å; Y491-F521 AromaticContact CD2-CE2 3.79Å; Y491-F521 HydrophobicContact CD2-CE2 3.79Å; Y491-F521 AromaticContact CD2-CG 3.54Å; Y491-F521 HydrophobicContact CD2-CG 3.54Å; Y491-F521 HydrophobicContact CD2-CZ 4.25Å; Y491-F521 HydrophobicContact CE1-CB 3.33Å; Y491-F521 HydrophobicContact CE1-CD1 4.27Å; Y491-F521 AromaticContact CE1-CG 3.82Å; Y491-F521 HydrophobicContact CE1-CG 3.82Å; Y491-F521 HydrophobicContact CE2-CB 3.84Å; Y491-F521 AromaticContact CE2-CD2 3.72Å; Y491-F521 HydrophobicContact CE2-CD2 3.72Å; Y491-F521 HydrophobicContact CE2-CE2 4.47Å; Y491-F521 AromaticContact CE2-CG 3.84Å; Y491-F521 HydrophobicContact CE2-CG 3.84Å; Y491-F521 HydrophobicContact CG-CB 3.87Å; Y491-F521 AromaticContact CG-CD1 3.39Å; Y491-F521 HydrophobicContact CG-CD1 3.39Å; Y491-F521 AromaticContact CG-CD2 3.69Å; Y491-F521 HydrophobicContact CG-CD2 3.69Å; Y491-F521 AromaticContact CG-CE1 3.78Å; Y491-F521 HydrophobicContact CG-CE1 3.78Å; Y491-F521 HydrophobicContact CG-CE2 4.03Å; Y491-F521 AromaticContact CG-CG 3.34Å; Y491-F521 HydrophobicContact CG-CG 3.34Å; Y491-F521 HydrophobicContact CG-CZ 4.07Å; Y491-F521 VanDerWaalsContact CZ-CB 3.48Å; Y491-F521 AromaticContact CZ-CG 3.96Å; K517-F521 PolarHBondContact O-N 3.44Å; K517-F521 VanDerWaalsContact O-N 3.16Å; V518-F521 PolarHBondContact O-N 2.85Å; F519-F521 VanDerWaalsContact C-N 3.31Å; F519-F521 PolarHBondContact O-N 2.93Å; F521-F523 VanDerWaalsContact C-N 3.3Å; F521-F523 PolarHBondContact O-N 2.74Å; F521-V524 PolarHBondContact O-N 3.02Å; F521-N525 HydrophobicContact CE1-CB 4.33Å; F521-N525 WeakPolarHBondContact O-CB 3.33Å; F521-N525 PolarHBondContact O-N 2.83Å
522	Q	92.7	Very high	92.3	Very high	8 Å²	8	24.2 Å²	24.2	4%	0.037	12%	0.117	C	C	.	.	H	α-helix	trans	-65.1	-34.9	-178	-68.1	-73	14.6	0	0	111.9	E492 V518 F519 N525 F526 L637	E492-Q522 PolarHBondContact OE1-NE2 3.09Å; V518-Q522 HydrophobicContact CG1-CG 3.91Å; V518-Q522 WeakPolarHBondContact O-CB 3.25Å; V518-Q522 WeakPolarHBondContact O-CG 3.44Å; V518-Q522 PolarHBondContact O-N 2.84Å; F519-Q522 PolarHBondContact O-N 3.5Å; Q522-N525 PolarHBondContact O-N 3.25Å; Q522-F526 HydrophobicContact CB-CD2 4.4Å; Q522-F526 WeakPolarHBondContact O-CB 3.48Å; Q522-F526 WeakPolarHBondContact O-CD2 3.41Å; Q522-F526 PolarHBondContact O-N 3.45Å; Q522-F526 VanDerWaalsContact OE1-CE2 3.31Å; Q522-L637 HydrophobicContact CB-CD1 4.3Å; Q522-L637 HydrophobicContact CG-CD1 4.46Å; Q522-L637 HydrophobicContact CG-CD2 4.09Å
523	F	93.1	Very high	92	Very high	25 Å²	25	22.3 Å²	22.3	11%	0.11	11%	0.107	C	C	.	.	H	α-helix	trans	-56.9	-52	172.6	179.2	-85.9	0	0	0	110.5	F519 F521 N525 Y527 F531 I648 F699 L700 L703	F519-F523 HydrophobicContact CE1-CB 4.28Å; F519-F523 HydrophobicContact CE1-CD2 4.31Å; F519-F523 HydrophobicContact CE2-CB 4.41Å; F519-F523 HydrophobicContact CE2-CD2 4.34Å; F519-F523 HydrophobicContact CZ-CB 4.12Å; F519-F523 AromaticContact CZ-CD2 3.7Å; F519-F523 HydrophobicContact CZ-CD2 3.7Å; F519-F523 HydrophobicContact CZ-CG 4.24Å; F519-F523 WeakPolarHBondContact O-CB 3.43Å; F519-F523 PolarHBondContact O-N 2.97Å; F521-F523 VanDerWaalsContact C-N 3.3Å; F521-F523 PolarHBondContact O-N 2.74Å; F523-N525 PolarHBondContact O-N 2.99Å; F523-Y527 HydrophobicContact CB-CD2 4.25Å; F523-Y527 HydrophobicContact CD1-CD2 4.23Å; F523-Y527 AromaticContact CD2-CD2 3.24Å; F523-Y527 HydrophobicContact CD2-CD2 3.24Å; F523-Y527 AromaticContact CD2-CE2 3.33Å; F523-Y527 HydrophobicContact CD2-CE2 3.33Å; F523-Y527 HydrophobicContact CD2-CG 4.46Å; F523-Y527 HydrophobicContact CE1-CD2 4.34Å; F523-Y527 AromaticContact CE2-CD2 3.36Å; F523-Y527 HydrophobicContact CE2-CD2 3.36Å; F523-Y527 AromaticContact CE2-CE2 3.59Å; F523-Y527 HydrophobicContact CE2-CE2 3.59Å; F523-Y527 HydrophobicContact CE2-CG 4.27Å; F523-Y527 AromaticContact CG-CD2 3.68Å; F523-Y527 HydrophobicContact CG-CD2 3.68Å; F523-Y527 HydrophobicContact CG-CE2 4.1Å; F523-Y527 AromaticContact CZ-CD2 3.91Å; F523-Y527 HydrophobicContact CZ-CD2 3.91Å; F523-Y527 VanDerWaalsContact O-CB 3.31Å; F523-Y527 WeakPolarHBondContact O-CB 3.43Å; F523-Y527 WeakPolarHBondContact O-CD2 3.48Å; F523-Y527 PolarHBondContact O-N 3.47Å; F523-F531 AromaticContact CE1-CE2 3.95Å; F523-F531 HydrophobicContact CE1-CE2 3.95Å; F523-F531 AromaticContact CZ-CE2 3.81Å; F523-F531 HydrophobicContact CZ-CE2 3.81Å; F523-F531 HydrophobicContact CZ-CZ 4.06Å; F523-I648 HydrophobicContact CE2-CD1 4.09Å; F523-F699 HydrophobicContact CE2-CE1 4.34Å; F523-F699 HydrophobicContact CZ-CE1 4.47Å; F523-L700 HydrophobicContact CD2-CD2 4.09Å; F523-L700 HydrophobicContact CE2-CD2 3.73Å; F523-L703 HydrophobicContact CE1-CD2 4.47Å; F523-L703 HydrophobicContact CE2-CD2 3.97Å; F523-L703 HydrophobicContact CZ-CD2 3.45Å; F523-L703 VanDerWaalsContact CZ-CD2 3.45Å
524	V	93.3	Very high	91.7	Very high	20 Å²	20	20.1 Å²	20.1	12%	0.121	10%	0.098	C	C	.	.	H	α-helix	trans	-63	-45.6	176.3	178.3	0	0	0	0	110.4	V437 V440 L441 L520 F521 F526 S528	V437-V524 HydrophobicContact CG1-CG1 4.12Å; V437-V524 HydrophobicContact CG1-CG2 4.09Å; V437-V524 HydrophobicContact CG2-CG2 4.3Å; V440-V524 HydrophobicContact CB-CG1 4.3Å; V440-V524 HydrophobicContact CG1-CG1 3.89Å; L441-V524 HydrophobicContact CD2-CG1 4.37Å; L520-V524 WeakPolarHBondContact O-CG2 3.5Å; L520-V524 PolarHBondContact O-N 3.43Å; F521-V524 PolarHBondContact O-N 3.02Å; V524-F526 PolarHBondContact O-N 2.92Å; V524-S528 WeakPolarHBondContact CG1-OG 3.19Å; V524-S528 WeakPolarHBondContact O-CB 3.32Å; V524-S528 PolarHBondContact O-N 3.16Å; V524-S528 PolarHBondContact O-OG 3.48Å
525	N	91.4	Very high	91.5	Very high	6 Å²	6	21.5 Å²	21.5	3%	0.032	10%	0.102	C	C	.	.	H	α-helix	trans	-59.1	-46.1	-176.5	-161.5	28.3	0	0	0	112.8	V440 I484 F521 Q522 F523	V440-N525 HydrophobicContact CG1-CB 4.39Å; V440-N525 HydrophobicContact CG2-CB 4.48Å; I484-N525 WeakPolarHBondContact CD1-O 3.11Å; I484-N525 PolarHBondContact O-ND2 3.43Å; F521-N525 HydrophobicContact CE1-CB 4.33Å; F521-N525 WeakPolarHBondContact O-CB 3.33Å; F521-N525 PolarHBondContact O-N 2.83Å; Q522-N525 PolarHBondContact O-N 3.25Å; F523-N525 PolarHBondContact O-N 2.99Å
526	F	89.6	Confident	91.2	Very high	15 Å²	15	26.7 Å²	26.7	7%	0.066	13%	0.125	C	C	.	.	H	α-helix	trans	-81.5	-45.6	-179.8	-79.7	-76.7	0	0	0	113.4	I484 Q522 V524 I574 K578 L641 F645	I484-F526 HydrophobicContact CD1-CD1 4.43Å; I484-F526 HydrophobicContact CG2-CD1 3.8Å; I484-F526 HydrophobicContact CG2-CD2 4.24Å; I484-F526 HydrophobicContact CG2-CE1 3.41Å; I484-F526 VanDerWaalsContact CG2-CE1 3.41Å; I484-F526 HydrophobicContact CG2-CE2 3.88Å; I484-F526 HydrophobicContact CG2-CG 4.2Å; I484-F526 HydrophobicContact CG2-CZ 3.45Å; I484-F526 VanDerWaalsContact CG2-CZ 3.45Å; Q522-F526 HydrophobicContact CB-CD2 4.4Å; Q522-F526 WeakPolarHBondContact O-CB 3.48Å; Q522-F526 WeakPolarHBondContact O-CD2 3.41Å; Q522-F526 PolarHBondContact O-N 3.45Å; Q522-F526 VanDerWaalsContact OE1-CE2 3.31Å; V524-F526 PolarHBondContact O-N 2.92Å; F526-I574 HydrophobicContact CD1-CG2 4.42Å; F526-K578 HydrophobicContact CE1-CD 3.82Å; F526-K578 HydrophobicContact CZ-CD 4.03Å; F526-L641 HydrophobicContact CD2-CD1 3.71Å; F526-L641 HydrophobicContact CD2-CD2 4.38Å; F526-L641 HydrophobicContact CE2-CD1 3.78Å; F526-F645 HydrophobicContact CB-CZ 4.15Å; F526-F645 HydrophobicContact CD1-CZ 4.31Å; F526-F645 HydrophobicContact CG-CZ 4.49Å
527	Y	91.7	Very high	90.9	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-86.3	-22.5	-170.1	-61.7	-64	0	0	0	114.5	F523 S529 I530 F531 L641 G644 F645 F649	F523-Y527 HydrophobicContact CB-CD2 4.25Å; F523-Y527 HydrophobicContact CD1-CD2 4.23Å; F523-Y527 AromaticContact CD2-CD2 3.24Å; F523-Y527 HydrophobicContact CD2-CD2 3.24Å; F523-Y527 AromaticContact CD2-CE2 3.33Å; F523-Y527 HydrophobicContact CD2-CE2 3.33Å; F523-Y527 HydrophobicContact CD2-CG 4.46Å; F523-Y527 HydrophobicContact CE1-CD2 4.34Å; F523-Y527 AromaticContact CE2-CD2 3.36Å; F523-Y527 HydrophobicContact CE2-CD2 3.36Å; F523-Y527 AromaticContact CE2-CE2 3.59Å; F523-Y527 HydrophobicContact CE2-CE2 3.59Å; F523-Y527 HydrophobicContact CE2-CG 4.27Å; F523-Y527 AromaticContact CG-CD2 3.68Å; F523-Y527 HydrophobicContact CG-CD2 3.68Å; F523-Y527 HydrophobicContact CG-CE2 4.1Å; F523-Y527 AromaticContact CZ-CD2 3.91Å; F523-Y527 HydrophobicContact CZ-CD2 3.91Å; F523-Y527 VanDerWaalsContact O-CB 3.31Å; F523-Y527 WeakPolarHBondContact O-CB 3.43Å; F523-Y527 WeakPolarHBondContact O-CD2 3.48Å; F523-Y527 PolarHBondContact O-N 3.47Å; Y527-S529 VanDerWaalsContact C-N 3.3Å; Y527-S529 PolarHBondContact O-N 3.27Å; Y527-I530 CarbonylContact O-C 3.51Å; Y527-I530 WeakPolarHBondContact O-CA 3.32Å; Y527-I530 WeakPolarHBondContact O-CB 3.29Å; Y527-I530 PolarHBondContact O-N 2.86Å; Y527-F531 HydrophobicContact CG-CE2 4.45Å; Y527-F531 WeakPolarHBondContact O-CD2 3.48Å; Y527-F531 PolarHBondContact O-N 3.35Å; Y527-L641 HydrophobicContact CE2-CD2 3.79Å; Y527-L641 WeakPolarHBondContact OH-CA 3.04Å; Y527-L641 PolarHBondContact OH-O 3.47Å; Y527-G644 VanDerWaalsContact OH-CA 3.27Å; Y527-G644 WeakPolarHBondContact OH-CA 3.29Å; Y527-F645 AromaticContact CD1-CD1 3.96Å; Y527-F645 HydrophobicContact CD1-CD1 3.96Å; Y527-F645 AromaticContact CD1-CE1 3.67Å; Y527-F645 HydrophobicContact CD1-CE1 3.67Å; Y527-F645 AromaticContact CE1-CD1 3.35Å; Y527-F645 HydrophobicContact CE1-CD1 3.35Å; Y527-F645 AromaticContact CE1-CE1 3.34Å; Y527-F645 HydrophobicContact CE1-CE1 3.34Å; Y527-F645 HydrophobicContact CE1-CG 4.04Å; Y527-F645 HydrophobicContact CE1-CZ 4.05Å; Y527-F649 AromaticContact CD1-CE2 3.61Å; Y527-F649 HydrophobicContact CD1-CE2 3.61Å; Y527-F649 HydrophobicContact CD1-CZ 4.27Å; Y527-F649 HydrophobicContact CE1-CE2 4.06Å
528	S	90.4	Very high	90.2	Very high	20 Å²	20	23.1 Å²	23.1	14%	0.14	12%	0.116	C	C	.	.	H	α-helix	trans	-63.1	-35.7	-173.6	-64.9	0	0	0	0	113.2	V524 I530 F531 Y532	V524-S528 WeakPolarHBondContact CG1-OG 3.19Å; V524-S528 WeakPolarHBondContact O-CB 3.32Å; V524-S528 PolarHBondContact O-N 3.16Å; V524-S528 PolarHBondContact O-OG 3.48Å; S528-I530 VanDerWaalsContact C-N 3.28Å; S528-I530 PolarHBondContact O-N 2.87Å; S528-F531 PolarHBondContact O-N 2.88Å; S528-Y532 WeakPolarHBondContact O-CB 3.31Å; S528-Y532 PolarHBondContact O-N 3.48Å
529	S	86.5	Confident	89.7	Confident	9 Å²	9	27.4 Å²	27.4	6%	0.063	14%	0.136	C	C	.	.	H	α-helix	trans	-64.2	-35.2	174.7	70.9	0	0	0	0	112.2	N480 Y527 V533 Q570	N480-S529 PolarHBondContact ND2-OG 3.44Å; Y527-S529 VanDerWaalsContact C-N 3.3Å; Y527-S529 PolarHBondContact O-N 3.27Å; S529-V533 PolarHBondContact O-N 3.44Å; S529-Q570 PolarHBondContact O-NE2 3.24Å; S529-Q570 PolarHBondContact OG-NE2 2.93Å
530	I	88.9	Confident	89	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-76.1	-43.3	179	-55.3	-178.6	0	0	0	109.9	Y527 S528 Y532 V533 A534 L567 L571 I574 F645 F649	Y527-I530 CarbonylContact O-C 3.51Å; Y527-I530 WeakPolarHBondContact O-CA 3.32Å; Y527-I530 WeakPolarHBondContact O-CB 3.29Å; Y527-I530 PolarHBondContact O-N 2.86Å; S528-I530 VanDerWaalsContact C-N 3.28Å; S528-I530 PolarHBondContact O-N 2.87Å; I530-Y532 VanDerWaalsContact C-N 3.29Å; I530-Y532 PolarHBondContact O-N 2.75Å; I530-V533 PolarHBondContact O-N 3.4Å; I530-A534 VanDerWaalsContact O-CB 3.24Å; I530-A534 WeakPolarHBondContact O-CB 3.37Å; I530-A534 PolarHBondContact O-N 3.26Å; I530-L567 HydrophobicContact CG2-CD1 3.33Å; I530-L571 HydrophobicContact CD1-CD1 4.25Å; I530-I574 HydrophobicContact CD1-CD1 4.03Å; I530-I574 HydrophobicContact CG1-CD1 3.97Å; I530-F645 HydrophobicContact CD1-CD1 3.99Å; I530-F645 HydrophobicContact CD1-CE1 3.61Å; I530-F649 HydrophobicContact CB-CE1 4.31Å; I530-F649 HydrophobicContact CB-CE2 4.46Å; I530-F649 HydrophobicContact CB-CZ 4.02Å; I530-F649 HydrophobicContact CG2-CD1 3.7Å; I530-F649 HydrophobicContact CG2-CD2 4.14Å; I530-F649 HydrophobicContact CG2-CE1 3.4Å; I530-F649 HydrophobicContact CG2-CE2 3.87Å; I530-F649 HydrophobicContact CG2-CG 4.06Å; I530-F649 HydrophobicContact CG2-CZ 3.48Å; I530-F649 VanDerWaalsContact CG2-CZ 3.48Å
531	F	91.8	Very high	88.5	Confident	36 Å²	36	30.8 Å²	30.8	16%	0.158	15%	0.153	C	C	.	.	H	α-helix	trans	-61	-37.2	174	-73.6	-44.7	0	0	0	112.6	F523 Y527 S528 A534 F535 I648 F649 L703	F523-F531 AromaticContact CE1-CE2 3.95Å; F523-F531 HydrophobicContact CE1-CE2 3.95Å; F523-F531 AromaticContact CZ-CE2 3.81Å; F523-F531 HydrophobicContact CZ-CE2 3.81Å; F523-F531 HydrophobicContact CZ-CZ 4.06Å; Y527-F531 HydrophobicContact CG-CE2 4.45Å; Y527-F531 WeakPolarHBondContact O-CD2 3.48Å; Y527-F531 PolarHBondContact O-N 3.35Å; S528-F531 PolarHBondContact O-N 2.88Å; F531-A534 PolarHBondContact O-N 2.93Å; F531-F535 HydrophobicContact CB-CD2 4.34Å; F531-F535 AromaticContact CD1-CD2 3.91Å; F531-F535 HydrophobicContact CD1-CD2 3.91Å; F531-F535 AromaticContact CD1-CE2 3.45Å; F531-F535 HydrophobicContact CD1-CE2 3.45Å; F531-F535 VanDerWaalsContact CD1-CE2 3.45Å; F531-F535 AromaticContact CE1-CE2 3.93Å; F531-F535 HydrophobicContact CE1-CE2 3.93Å; F531-F535 HydrophobicContact CG-CE2 4.45Å; F531-F535 PolarHBondContact O-N 3.38Å; F531-I648 HydrophobicContact CE1-CG2 3.84Å; F531-I648 HydrophobicContact CZ-CG2 4.08Å; F531-F649 AromaticContact CD1-CE1 3.85Å; F531-F649 HydrophobicContact CD1-CE1 3.85Å; F531-F649 AromaticContact CD1-CZ 3.74Å; F531-F649 HydrophobicContact CD1-CZ 3.74Å; F531-F649 AromaticContact CE1-CE1 3.85Å; F531-F649 HydrophobicContact CE1-CE1 3.85Å; F531-F649 AromaticContact CE1-CZ 3.52Å; F531-F649 HydrophobicContact CE1-CZ 3.52Å; F531-F649 HydrophobicContact CG-CZ 4.45Å; F531-F649 HydrophobicContact CZ-CZ 4.04Å; F531-L703 HydrophobicContact CZ-CD2 4.28Å
532	Y	89.4	Confident	88.1	Confident	59 Å²	59	31.9 Å²	31.9	23%	0.231	17%	0.165	C	C	.	.	I	π-helix	trans	-58.4	-51.7	173.2	175.2	-99.6	0	0	0	111.6	I448 S528 I530 A534 F536 K537	I448-Y532 HydrophobicContact CD1-CD1 3.83Å; I448-Y532 HydrophobicContact CD1-CD2 3.93Å; I448-Y532 HydrophobicContact CD1-CE1 3.61Å; I448-Y532 HydrophobicContact CD1-CE2 3.71Å; I448-Y532 HydrophobicContact CD1-CG 3.98Å; I448-Y532 HydrophobicContact CG1-CD1 4.3Å; I448-Y532 HydrophobicContact CG1-CE1 3.94Å; S528-Y532 WeakPolarHBondContact O-CB 3.31Å; S528-Y532 PolarHBondContact O-N 3.48Å; I530-Y532 VanDerWaalsContact C-N 3.29Å; I530-Y532 PolarHBondContact O-N 2.75Å; Y532-A534 PolarHBondContact O-N 3.36Å; Y532-F536 HydrophobicContact CD2-CB 3.89Å; Y532-F536 HydrophobicContact CE2-CB 4.12Å; Y532-F536 PolarHBondContact O-N 3.3Å; Y532-K537 HydrophobicContact CE1-CB 4.23Å; Y532-K537 HydrophobicContact CE1-CG 4.44Å; Y532-K537 PolarHBondContact O-N 3.17Å
533	V	86.3	Confident	87.8	Confident	4 Å²	4	34.5 Å²	34.5	2%	0.024	18%	0.175	C	C	.	.	I	π-helix	trans	-64.5	-41.1	178.3	176.4	0	0	0	0	111.3	S529 I530 K537 E566 L567 R715	S529-V533 PolarHBondContact O-N 3.44Å; I530-V533 PolarHBondContact O-N 3.4Å; V533-K537 HydrophobicContact CG1-CD 4.49Å; V533-K537 HydrophobicContact CG2-CD 4.39Å; V533-E566 HydrophobicContact CG1-CB 4.38Å; V533-E566 HydrophobicContact CG1-CG 4.07Å; V533-L567 HydrophobicContact CG1-CB 4.21Å; V533-R715 PolarHBondContact O-NH2 2.83Å; V533-R715 VanDerWaalsContact O-NH2 3.11Å
534	A	89.1	Confident	87.4	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.008	17%	0.171	C	C	.	.	I	π-helix	trans	-70.9	-33.5	-177.8	0	0	0	0	0	114	I530 F531 Y532 L567 F649 R715	I530-A534 VanDerWaalsContact O-CB 3.24Å; I530-A534 WeakPolarHBondContact O-CB 3.37Å; I530-A534 PolarHBondContact O-N 3.26Å; F531-A534 PolarHBondContact O-N 2.93Å; Y532-A534 PolarHBondContact O-N 3.36Å; A534-L567 HydrophobicContact CB-CD1 4.05Å; A534-L567 HydrophobicContact CB-CD2 3.97Å; A534-F649 HydrophobicContact CB-CE1 4.49Å; A534-R715 WeakPolarHBondContact O-CG 3.22Å; A534-R715 PolarHBondContact O-NE 3.4Å; A534-R715 PolarHBondContact O-NH2 3.11Å
535	F	89.9	Confident	86.8	Confident	53 Å²	53	34.9 Å²	34.9	23%	0.232	19%	0.19	C	C	.	.	I	π-helix	trans	-123.3	-33.1	-170.7	-58.7	-49.1	0	0	0	114.8	F531 Q539 F710 I711 R715	F531-F535 HydrophobicContact CB-CD2 4.34Å; F531-F535 AromaticContact CD1-CD2 3.91Å; F531-F535 HydrophobicContact CD1-CD2 3.91Å; F531-F535 AromaticContact CD1-CE2 3.45Å; F531-F535 HydrophobicContact CD1-CE2 3.45Å; F531-F535 VanDerWaalsContact CD1-CE2 3.45Å; F531-F535 AromaticContact CE1-CE2 3.93Å; F531-F535 HydrophobicContact CE1-CE2 3.93Å; F531-F535 HydrophobicContact CG-CE2 4.45Å; F531-F535 PolarHBondContact O-N 3.38Å; F535-Q539 WeakPolarHBondContact O-CG 3.27Å; F535-F710 HydrophobicContact CD1-CB 4.12Å; F535-F710 HydrophobicContact CE1-CB 3.43Å; F535-F710 VanDerWaalsContact CE1-CB 3.43Å; F535-F710 HydrophobicContact CE1-CG 4.43Å; F535-F710 HydrophobicContact CZ-CB 4.08Å; F535-I711 HydrophobicContact CE1-CG1 4.02Å; F535-I711 HydrophobicContact CZ-CG1 4.26Å; F535-R715 VanDerWaalsContact C-NH2 3.33Å; F535-R715 PolarHBondContact O-NH2 3.31Å
536	F	88.2	Confident	86.5	Confident	126 Å²	126	40.5 Å²	40.5	55%	0.553	22%	0.215	S	C	*	.	I	π-helix	trans	-102.3	-35.8	-172.7	-64.6	-80.9	0	0	0	113.4	Y532 G538 Q539	Y532-F536 HydrophobicContact CD2-CB 3.89Å; Y532-F536 HydrophobicContact CE2-CB 4.12Å; Y532-F536 PolarHBondContact O-N 3.3Å; F536-G538 PolarHBondContact O-N 3.16Å; F536-Q539 PolarHBondContact O-N 3.34Å
537	K	86	Confident	86.2	Confident	1 Å²	1	42.7 Å²	42.7	0%	0.004	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	131.1	-175.9	-168.3	176.5	-170.7	-165.4	0	112	R451 Y532 V533 Q539 E556 A557 E566 R715	R451-K537 VanDerWaalsContact NH1-NZ 3.11Å; Y532-K537 HydrophobicContact CE1-CB 4.23Å; Y532-K537 HydrophobicContact CE1-CG 4.44Å; Y532-K537 PolarHBondContact O-N 3.17Å; V533-K537 HydrophobicContact CG1-CD 4.49Å; V533-K537 HydrophobicContact CG2-CD 4.39Å; K537-Q539 VanDerWaalsContact C-N 3.27Å; K537-Q539 PolarHBondContact O-N 3.4Å; K537-E556 VanDerWaalsContact CE-OE2 3.3Å; K537-E556 WeakPolarHBondContact CE-OE2 3.28Å; K537-E556 IonicContact NZ-OE2 3.36Å; K537-A557 VanDerWaalsContact CE-O 3.22Å; K537-A557 WeakPolarHBondContact CE-O 3.33Å; K537-E566 IonicContact NZ-OE1 3.64Å; K537-E566 PolarHBondContact NZ-OE1 3.33Å; K537-E566 IonicContact NZ-OE2 3.28Å; K537-E566 PolarHBondContact NZ-OE2 3.44Å; K537-R715 PolarHBondContact O-NH1 3.01Å; K537-R715 PolarHBondContact O-NH2 2.88Å
538	G	80.4	Confident	85.8	Confident	27 Å²	27	45.6 Å²	45.6	28%	0.278	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.2	-5.2	175.9	0	0	0	0	0	117	F536 E556	F536-G538 PolarHBondContact O-N 3.16Å; G538-E556 PolarHBondContact N-O 2.75Å
539	Q	82.4	Confident	85.3	Confident	92 Å²	92	48.5 Å²	48.5	43%	0.43	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-32.4	178.7	-62.8	-62.3	-24.8	0	0	112.6	F535 F536 K537	F535-Q539 WeakPolarHBondContact O-CG 3.27Å; F536-Q539 PolarHBondContact O-N 3.34Å; K537-Q539 VanDerWaalsContact C-N 3.27Å; K537-Q539 PolarHBondContact O-N 3.4Å
540	M	80.9	Confident	84.7	Confident	125 Å²	125	53.9 Å²	53.9	62%	0.616	28%	0.284	S	S	*	.	S	Bend	trans	-116.1	58	-175.5	-60.6	-174.9	-70.3	0	0	111.6	T548 N555	M540-T548 PolarHBondContact O-OG1 3.12Å; M540-N555 VanDerWaalsContact O-CB 3.31Å; M540-N555 WeakPolarHBondContact O-CB 3.25Å; M540-N555 PolarHBondContact O-ND2 3.13Å
541	V	82.6	Confident	83.8	Confident	19 Å²	19	62 Å²	62	12%	0.115	32%	0.32	C	S	.	.			trans	-99.6	-34.9	-178.9	-178.7	0	0	0	0	112.3	Y547 T548 A557	V541-Y547 HydrophobicContact CG1-CD1 3.97Å; V541-Y547 HydrophobicContact CG1-CE1 4.26Å; V541-Y547 WeakPolarHBondContact O-CA 3.08Å; V541-Y547 WeakPolarHBondContact O-CD1 3.47Å; V541-T548 PolarHBondContact O-N 3.36Å; V541-T548 VanDerWaalsContact O-N 3.08Å; V541-T548 PolarHBondContact O-OG1 3.47Å; V541-A557 HydrophobicContact CG1-CB 4.42Å; V541-A557 HydrophobicContact CG2-CB 4.33Å
542	G	85.1	Confident	82.9	Confident	24 Å²	24	63.5 Å²	63.5	25%	0.247	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	94.6	-156.1	-170	0	0	0	0	0	112.6	R758	G542-R758 PolarHBondContact O-NH1 2.97Å
543	Y	86.9	Confident	82	Confident	62 Å²	62	63.5 Å²	63.5	24%	0.243	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	162.4	171.2	48.8	-80.9	0	0	0	110	G545 H546 P744	Y543-G545 PolarHBondContact O-N 3.19Å; Y543-G545 VanDerWaalsContact O-N 3.14Å; Y543-H546 HydrophobicContact CD1-CB 4.38Å; Y543-H546 HydrophobicContact CD2-CB 4.28Å; Y543-H546 HydrophobicContact CE1-CB 3.83Å; Y543-H546 HydrophobicContact CE2-CB 3.71Å; Y543-H546 VanDerWaalsContact CZ-CB 3.45Å; Y543-H546 PolarHBondContact N-O 2.91Å; Y543-H546 CarbonylContact O-C 3.53Å; Y543-H546 VanDerWaalsContact O-C 3.25Å; Y543-H546 PolarHBondContact O-N 3.43Å; Y543-P744 HydrophobicContact CD2-CG 3.75Å; Y543-P744 HydrophobicContact CE2-CG 3.96Å
544	P	84.9	Confident	81.6	Confident	3 Å²	3	64.7 Å²	64.7	2%	0.019	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.4	120	169.7	-26.6	34.7	0	0	0	112.8	C320 Y547 A743 T747 T748 Y754	C320-P544 HydrophobicContact CB-CG 4.2Å; P544-Y547 VanDerWaalsContact CA-CZ 3.47Å; P544-Y547 WeakPolarHBondContact CA-OH 3.4Å; P544-A743 HydrophobicContact CB-CB 4.06Å; P544-A743 HydrophobicContact CG-CB 4.28Å; P544-T747 WeakPolarHBondContact O-CB 3.33Å; P544-T747 PolarHBondContact O-OG1 3.33Å; P544-T748 HydrophobicContact CB-CG2 3.78Å; P544-Y754 HydrophobicContact CG-CD1 3.94Å; P544-Y754 HydrophobicContact CG-CE1 4.31Å; P544-Y754 HydrophobicContact CG-CG 4.12Å
545	G	81	Confident	81.2	Confident	51 Å²	51	66.7 Å²	66.7	53%	0.526	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.1	-26.1	-176.2	0	0	0	0	0	114.8	Y543	Y543-G545 PolarHBondContact O-N 3.19Å; Y543-G545 VanDerWaalsContact O-N 3.14Å
546	H	84.6	Confident	80.5	Confident	123 Å²	123	65.3 Å²	65.3	57%	0.569	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138	70.4	177.3	-157.5	75.3	0	0	0	110.2	Y543	Y543-H546 HydrophobicContact CD1-CB 4.38Å; Y543-H546 HydrophobicContact CD2-CB 4.28Å; Y543-H546 HydrophobicContact CE1-CB 3.83Å; Y543-H546 HydrophobicContact CE2-CB 3.71Å; Y543-H546 VanDerWaalsContact CZ-CB 3.45Å; Y543-H546 PolarHBondContact N-O 2.91Å; Y543-H546 CarbonylContact O-C 3.53Å; Y543-H546 VanDerWaalsContact O-C 3.25Å; Y543-H546 PolarHBondContact O-N 3.43Å
547	Y	83.2	Confident	80	Confident	61 Å²	61	60.9 Å²	60.9	24%	0.239	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	138.6	174.5	-63.7	-66.3	0	0	0	110.4	V541 P544 S549 R554	V541-Y547 HydrophobicContact CG1-CD1 3.97Å; V541-Y547 HydrophobicContact CG1-CE1 4.26Å; V541-Y547 WeakPolarHBondContact O-CA 3.08Å; V541-Y547 WeakPolarHBondContact O-CD1 3.47Å; P544-Y547 VanDerWaalsContact CA-CZ 3.47Å; P544-Y547 WeakPolarHBondContact CA-OH 3.4Å; Y547-S549 PolarHBondContact O-N 3.21Å; Y547-R554 HydrophobicContact CD1-CG 4.5Å; Y547-R554 VanDerWaalsContact CE2-CZ 3.47Å; Y547-R554 VanDerWaalsContact CE2-NH1 3.33Å; Y547-R554 HydrophobicContact CG-CG 4.21Å; Y547-R554 PolarHBondContact OH-NH2 3.36Å
548	T	84.2	Confident	79.7	Confident	61 Å²	61	62.6 Å²	62.6	37%	0.374	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-75.8	124.1	170.3	51.3	0	0	0	0	108.9	M540 V541 N555	M540-T548 PolarHBondContact O-OG1 3.12Å; V541-T548 PolarHBondContact O-N 3.36Å; V541-T548 VanDerWaalsContact O-N 3.08Å; V541-T548 PolarHBondContact O-OG1 3.47Å; T548-N555 PolarHBondContact O-N 3.44Å; T548-N555 PolarHBondContact OG1-ND2 2.95Å; T548-N555 VanDerWaalsContact OG1-ND2 3.11Å
549	S	78.7	Confident	79.3	Confident	82 Å²	82	62.9 Å²	62.9	57%	0.573	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	138.9	176.3	58.4	0	0	0	0	111.1	Y547 L553	Y547-S549 PolarHBondContact O-N 3.21Å; S549-L553 CarbonylContact C-O 3.55Å; S549-L553 WeakPolarHBondContact CA-O 3.42Å; S549-L553 WeakPolarHBondContact CB-O 3.3Å
550	F	73.9	Confident	78.6	Confident	121 Å²	121	60.9 Å²	60.9	53%	0.531	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.5	172	-167.8	-109.7	0	0	0	107.7	G552 L553 N555	F550-G552 PolarHBondContact O-N 2.94Å; F550-L553 PolarHBondContact N-O 3.44Å; F550-L553 PolarHBondContact O-N 3.5Å; F550-N555 VanDerWaalsContact CB-OD1 3.27Å; F550-N555 WeakPolarHBondContact CB-OD1 3.49Å
551	F	71	Confident	77.9	Confident	170 Å²	170	55.2 Å²	55.2	75%	0.746	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	34.4	-169.3	-65.7	-72.7	0	0	0	114.3	L553	F551-L553 PolarHBondContact O-N 2.98Å
552	G	71.6	Confident	77.6	Confident	69 Å²	69	55.3 Å²	55.3	71%	0.711	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.5	-0.8	-177.4	0	0	0	0	0	114.6	F550	F550-G552 PolarHBondContact O-N 2.94Å
553	L	71.3	Confident	77.5	Confident	59 Å²	59	54.5 Å²	54.5	31%	0.309	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	138.3	176	-57.5	169.6	0	0	0	109.9	F452 S549 F550 F551 N555	F452-L553 HydrophobicContact CD1-CD1 4.1Å; F452-L553 HydrophobicContact CD1-CD2 3.93Å; F452-L553 HydrophobicContact CD1-CG 4.39Å; F452-L553 HydrophobicContact CE1-CB 4.19Å; F452-L553 HydrophobicContact CE1-CD1 4.35Å; F452-L553 HydrophobicContact CE1-CD2 3.35Å; F452-L553 HydrophobicContact CE1-CG 4.15Å; F452-L553 HydrophobicContact CZ-CB 4.36Å; F452-L553 HydrophobicContact CZ-CD2 4.1Å; S549-L553 CarbonylContact C-O 3.55Å; S549-L553 WeakPolarHBondContact CA-O 3.42Å; S549-L553 WeakPolarHBondContact CB-O 3.3Å; F550-L553 PolarHBondContact N-O 3.44Å; F550-L553 PolarHBondContact O-N 3.5Å; F551-L553 PolarHBondContact O-N 2.98Å; L553-N555 PolarHBondContact O-N 3.44Å
554	R	78.2	Confident	77.4	Confident	29 Å²	29	52 Å²	52	11%	0.109	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	129.5	174.2	175	172.6	168.9	-175.1	-6.9	110.1	P321 T322 D324 Y547	P321-R554 PolarHBondContact O-NH2 3.19Å; T322-R554 PolarHBondContact O-NH2 3.45Å; T322-R554 VanDerWaalsContact O-NH2 3.14Å; D324-R554 IonicContact OD1-NH1 3.59Å; D324-R554 PolarHBondContact OD1-NH1 2.97Å; Y547-R554 HydrophobicContact CD1-CG 4.5Å; Y547-R554 VanDerWaalsContact CE2-CZ 3.47Å; Y547-R554 VanDerWaalsContact CE2-NH1 3.33Å; Y547-R554 HydrophobicContact CG-CG 4.21Å; Y547-R554 PolarHBondContact OH-NH2 3.36Å
555	N	79.6	Confident	77.3	Confident	43 Å²	43	52.7 Å²	52.7	23%	0.23	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-58.1	142.4	177.5	-75.8	-14.4	0	0	0	112.2	M540 T548 F550 L553 A557	M540-N555 VanDerWaalsContact O-CB 3.31Å; M540-N555 WeakPolarHBondContact O-CB 3.25Å; M540-N555 PolarHBondContact O-ND2 3.13Å; T548-N555 PolarHBondContact O-N 3.44Å; T548-N555 PolarHBondContact OG1-ND2 2.95Å; T548-N555 VanDerWaalsContact OG1-ND2 3.11Å; F550-N555 VanDerWaalsContact CB-OD1 3.27Å; F550-N555 WeakPolarHBondContact CB-OD1 3.49Å; L553-N555 PolarHBondContact O-N 3.44Å; N555-A557 PolarHBondContact O-N 3.21Å
556	E	75.8	Confident	77.3	Confident	24 Å²	24	50.6 Å²	50.6	11%	0.112	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-63.6	122.3	-177.8	-70	-161.2	160.7	0	0	112.1	R451 K537 G538	R451-E556 IonicContact NH1-OE2 2.7Å; K537-E556 VanDerWaalsContact CE-OE2 3.3Å; K537-E556 WeakPolarHBondContact CE-OE2 3.28Å; K537-E556 IonicContact NZ-OE2 3.36Å; G538-E556 PolarHBondContact N-O 2.75Å
557	A	78.1	Confident	77.4	Confident	32 Å²	32	44.8 Å²	44.8	26%	0.264	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-76.5	157.3	165	0	0	0	0	0	110.9	K537 V541 N555	K537-A557 VanDerWaalsContact CE-O 3.22Å; K537-A557 WeakPolarHBondContact CE-O 3.33Å; V541-A557 HydrophobicContact CG1-CB 4.42Å; V541-A557 HydrophobicContact CG2-CB 4.33Å; N555-A557 PolarHBondContact O-N 3.21Å
558	C	79	Confident	77.5	Confident	38 Å²	38	42.1 Å²	42.1	26%	0.257	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-57.4	149.1	164	-64.6	0	0	0	0	109.5	C563	C558-C563 VanDerWaalsContact CA-SG 3.56Å; C558-C563 HydrophobicContact CB-CB 4.04Å; C558-C563 WeakPolarHBondContact CB-SG 3.15Å; C558-C563 WeakPolarHBondContact SG-CB 3.4Å; C558-C563 CovalentContact SG-SG 2.03Å; C558-C563 PolarHBondContact SG-SG 2.88Å
559	D	72	Confident	77.4	Confident	33 Å²	33	42.5 Å²	42.5	18%	0.176	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-56.9	157.2	167.7	-162.1	-14.4	0	0	0	109.7	E469 G561 G562	E469-D559 WeakPolarHBondContact CG-OD2 3.19Å; E469-D559 VanDerWaalsContact OE2-OD1 3.13Å; D559-G561 PolarHBondContact O-N 3.03Å; D559-G561 VanDerWaalsContact O-N 3.07Å; D559-G562 PolarHBondContact O-N 3.45Å
560	N	67.9	Low	77.6	Confident	49 Å²	49	40 Å²	40	26%	0.262	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-36.7	-175	-62.8	-34.5	0	0	0	111	T322 W332 L337 G562	T322-N560 WeakPolarHBondContact CG2-OD1 3.19Å; W332-N560 HydrophobicContact CH2-CB 3.9Å; W332-N560 HydrophobicContact CZ2-CB 4.2Å; W332-N560 VanDerWaalsContact CZ2-OD1 3.23Å; W332-N560 WeakPolarHBondContact CZ2-OD1 3.42Å; W332-N560 HydrophobicContact CZ3-CB 4.27Å; L337-N560 HydrophobicContact CD1-CB 3.34Å; L337-N560 VanDerWaalsContact CD2-C 3.45Å; L337-N560 HydrophobicContact CD2-CB 4.24Å; L337-N560 WeakPolarHBondContact CD2-O 3.43Å; L337-N560 HydrophobicContact CG-CB 4.37Å; N560-G562 PolarHBondContact O-N 3.29Å
561	G	65.7	Low	78.2	Confident	7 Å²	7	34.3 Å²	34.3	7%	0.072	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-4.4	-179	0	0	0	0	0	115.5	S344 D559 I565	S344-G561 PolarHBondContact OG-O 2.99Å; D559-G561 PolarHBondContact O-N 3.03Å; D559-G561 VanDerWaalsContact O-N 3.07Å; G561-I565 WeakPolarHBondContact O-CD1 3.47Å
562	G	77.2	Confident	78.8	Confident	21 Å²	21	29.4 Å²	29.4	22%	0.216	18%	0.181	C	C	.	.			trans	96	153.4	-174.4	0	0	0	0	0	112.9	D559 N560 L564	D559-G562 PolarHBondContact O-N 3.45Å; N560-G562 PolarHBondContact O-N 3.29Å; G562-L564 PolarHBondContact O-N 2.95Å
563	C	83.4	Confident	79.2	Confident	7 Å²	7	28.3 Å²	28.3	5%	0.047	16%	0.16	C	C	.	.	H	α-helix	trans	-66.3	-18	-180	-84	0	0	0	0	113.7	C558 L567	C558-C563 VanDerWaalsContact CA-SG 3.56Å; C558-C563 HydrophobicContact CB-CB 4.04Å; C558-C563 WeakPolarHBondContact CB-SG 3.15Å; C558-C563 WeakPolarHBondContact SG-CB 3.4Å; C558-C563 CovalentContact SG-SG 2.03Å; C558-C563 PolarHBondContact SG-SG 2.88Å; C563-L567 VanDerWaalsContact O-CB 3.31Å; C563-L567 WeakPolarHBondContact O-CB 3.38Å; C563-L567 PolarHBondContact O-N 3.49Å
564	L	84.3	Confident	79.6	Confident	9 Å²	9	26 Å²	26	5%	0.047	15%	0.148	C	C	.	.	H	α-helix	trans	-71.3	-40.5	-178.8	-163.5	77.9	0	0	0	112.2	D348 G562 E566 L567 A568 A652 I711 R715	D348-L564 HydrophobicContact CB-CD2 3.62Å; G562-L564 PolarHBondContact O-N 2.95Å; L564-E566 VanDerWaalsContact C-N 3.32Å; L564-L567 HydrophobicContact CD1-CD2 4.47Å; L564-L567 WeakPolarHBondContact O-CB 3.48Å; L564-L567 PolarHBondContact O-N 3.03Å; L564-A568 WeakPolarHBondContact O-CB 3.48Å; L564-A568 PolarHBondContact O-N 3.25Å; L564-A652 HydrophobicContact CD1-CB 3.82Å; L564-A652 HydrophobicContact CG-CB 4.42Å; L564-I711 HydrophobicContact CD1-CG2 4.05Å; L564-R715 HydrophobicContact CD1-CB 4.14Å
565	I	82.5	Confident	80	Confident	17 Å²	17	24.6 Å²	24.6	9%	0.087	14%	0.143	C	C	.	.	H	α-helix	trans	-64.5	-43.3	174.9	-58.8	175.4	0	0	0	109.8	Y340 L343 G561 L567 A568 Q569	Y340-I565 WeakPolarHBondContact O-CD1 3.33Å; L343-I565 HydrophobicContact CD2-CG2 4.37Å; G561-I565 WeakPolarHBondContact O-CD1 3.47Å; I565-L567 VanDerWaalsContact C-N 3.29Å; I565-L567 PolarHBondContact O-N 3.46Å; I565-A568 PolarHBondContact O-N 3.04Å; I565-Q569 WeakPolarHBondContact O-CB 3.19Å; I565-Q569 PolarHBondContact O-N 3.42Å
566	E	81.7	Confident	80.1	Confident	8 Å²	8	24.2 Å²	24.2	4%	0.037	14%	0.142	C	C	.	.	H	α-helix	trans	-60	-43	177	-174.9	179.7	176.3	0	0	111.3	R451 V533 K537 L564 Q569 Q570	R451-E566 IonicContact CZ-OE1 2.87Å; R451-E566 IonicContact NH1-OE1 3.03Å; R451-E566 PolarHBondContact NH1-OE1 3.38Å; R451-E566 IonicContact NH2-OE1 3.97Å; R451-E566 PolarHBondContact NH2-OE1 3.24Å; V533-E566 HydrophobicContact CG1-CB 4.38Å; V533-E566 HydrophobicContact CG1-CG 4.07Å; K537-E566 IonicContact NZ-OE1 3.64Å; K537-E566 PolarHBondContact NZ-OE1 3.33Å; K537-E566 IonicContact NZ-OE2 3.28Å; K537-E566 PolarHBondContact NZ-OE2 3.44Å; L564-E566 VanDerWaalsContact C-N 3.32Å; E566-Q569 PolarHBondContact O-N 3.39Å; E566-Q570 VanDerWaalsContact O-CB 3.31Å; E566-Q570 WeakPolarHBondContact O-CB 3.48Å; E566-Q570 PolarHBondContact O-N 2.87Å
567	L	85.9	Confident	80.4	Confident	1 Å²	1	24 Å²	24	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-60.9	-47	174	179.4	63.1	0	0	0	111.6	I530 V533 A534 C563 L564 I565 Q570 L571 F649 A652	I530-L567 HydrophobicContact CG2-CD1 3.33Å; V533-L567 HydrophobicContact CG1-CB 4.21Å; A534-L567 HydrophobicContact CB-CD1 4.05Å; A534-L567 HydrophobicContact CB-CD2 3.97Å; C563-L567 VanDerWaalsContact O-CB 3.31Å; C563-L567 WeakPolarHBondContact O-CB 3.38Å; C563-L567 PolarHBondContact O-N 3.49Å; L564-L567 HydrophobicContact CD1-CD2 4.47Å; L564-L567 WeakPolarHBondContact O-CB 3.48Å; L564-L567 PolarHBondContact O-N 3.03Å; I565-L567 VanDerWaalsContact C-N 3.29Å; I565-L567 PolarHBondContact O-N 3.46Å; L567-Q570 PolarHBondContact O-N 3.19Å; L567-L571 WeakPolarHBondContact O-CB 3.36Å; L567-L571 PolarHBondContact O-N 3.45Å; L567-F649 HydrophobicContact CD1-CD1 4.45Å; L567-A652 HydrophobicContact CD2-CB 3.59Å; L567-A652 HydrophobicContact CG-CB 4.01Å
568	A	85.7	Confident	80.5	Confident	4 Å²	4	24.1 Å²	24.1	3%	0.033	14%	0.141	C	C	.	.	H	α-helix	trans	-63.6	-41.7	178.3	0	0	0	0	0	112	L564 I565 L571 L572 F653	L564-A568 WeakPolarHBondContact O-CB 3.48Å; L564-A568 PolarHBondContact O-N 3.25Å; I565-A568 PolarHBondContact O-N 3.04Å; A568-L571 PolarHBondContact O-N 2.93Å; A568-L572 WeakPolarHBondContact O-CB 3.12Å; A568-L572 PolarHBondContact O-N 3.09Å; A568-F653 HydrophobicContact CB-CB 4.48Å
569	Q	80.9	Confident	80.7	Confident	69 Å²	69	22.7 Å²	22.7	32%	0.322	13%	0.131	S	C	.	.	H	α-helix	trans	-63.8	-46.4	175.3	179.7	-178.4	-14	0	0	111.1	I565 E566 L571 L572 V573	I565-Q569 WeakPolarHBondContact O-CB 3.19Å; I565-Q569 PolarHBondContact O-N 3.42Å; E566-Q569 PolarHBondContact O-N 3.39Å; Q569-L571 VanDerWaalsContact C-N 3.34Å; Q569-L571 PolarHBondContact O-N 2.97Å; Q569-L572 PolarHBondContact O-N 3.43Å; Q569-V573 HydrophobicContact CG-CG2 4.49Å; Q569-V573 WeakPolarHBondContact O-CB 3.3Å; Q569-V573 VanDerWaalsContact O-CG2 3.31Å; Q569-V573 WeakPolarHBondContact O-CG2 3.44Å; Q569-V573 PolarHBondContact O-N 3.37Å
570	Q	83.1	Confident	81.3	Confident	31 Å²	31	25.9 Å²	25.9	15%	0.145	15%	0.147	C	C	.	.	H	α-helix	trans	-64.1	-41	179	-168.8	-179.6	2.1	0	0	111.2	S529 E566 L567 V573 I574	S529-Q570 PolarHBondContact O-NE2 3.24Å; S529-Q570 PolarHBondContact OG-NE2 2.93Å; E566-Q570 VanDerWaalsContact O-CB 3.31Å; E566-Q570 WeakPolarHBondContact O-CB 3.48Å; E566-Q570 PolarHBondContact O-N 2.87Å; L567-Q570 PolarHBondContact O-N 3.19Å; Q570-V573 PolarHBondContact O-N 3.11Å; Q570-I574 HydrophobicContact CG-CD1 3.78Å; Q570-I574 HydrophobicContact CG-CG1 4.45Å; Q570-I574 WeakPolarHBondContact O-CB 3.32Å; Q570-I574 VanDerWaalsContact O-CG1 3.26Å; Q570-I574 WeakPolarHBondContact O-CG1 3.49Å; Q570-I574 PolarHBondContact O-N 3.07Å
571	L	86	Confident	82.1	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.2	-45.6	174	-173.7	69.8	0	0	0	111.3	I530 L567 A568 Q569 I574 M575 F645 F649 F653	I530-L571 HydrophobicContact CD1-CD1 4.25Å; L567-L571 WeakPolarHBondContact O-CB 3.36Å; L567-L571 PolarHBondContact O-N 3.45Å; A568-L571 PolarHBondContact O-N 2.93Å; Q569-L571 VanDerWaalsContact C-N 3.34Å; Q569-L571 PolarHBondContact O-N 2.97Å; L571-I574 PolarHBondContact O-N 3.3Å; L571-M575 WeakPolarHBondContact O-CB 3.4Å; L571-M575 PolarHBondContact O-N 3.39Å; L571-F645 HydrophobicContact CD1-CB 3.97Å; L571-F645 HydrophobicContact CD1-CD1 3.68Å; L571-F645 HydrophobicContact CD1-CG 4.13Å; L571-F649 HydrophobicContact CD1-CB 4.44Å; L571-F649 HydrophobicContact CD1-CD2 4.35Å; L571-F649 HydrophobicContact CD2-CB 4.1Å; L571-F653 HydrophobicContact CD2-CB 3.88Å; L571-F653 HydrophobicContact CD2-CD1 4.2Å
572	L	83.9	Confident	82.9	Confident	67 Å²	67	27 Å²	27	35%	0.351	15%	0.152	S	C	.	.	H	α-helix	trans	-60.3	-48.1	177.3	-177.7	69.7	0	0	0	111.2	A568 Q569 V576 F653 F659	A568-L572 WeakPolarHBondContact O-CB 3.12Å; A568-L572 PolarHBondContact O-N 3.09Å; Q569-L572 PolarHBondContact O-N 3.43Å; L572-V576 HydrophobicContact CD1-CG2 3.65Å; L572-V576 HydrophobicContact CG-CG2 4.46Å; L572-V576 WeakPolarHBondContact O-CB 3.39Å; L572-V576 WeakPolarHBondContact O-CG2 3.39Å; L572-V576 PolarHBondContact O-N 3.36Å; L572-F653 HydrophobicContact CD1-CE1 4.15Å; L572-F653 HydrophobicContact CD1-CZ 4.01Å; L572-F659 HydrophobicContact CD1-CD2 4.48Å; L572-F659 HydrophobicContact CD1-CE2 4.19Å; L572-F659 HydrophobicContact CD1-CZ 4.25Å
573	V	80.1	Confident	83.4	Confident	47 Å²	47	26.8 Å²	26.8	29%	0.285	15%	0.146	S	C	.	.	H	α-helix	trans	-64.1	-44.4	179.4	171.6	0	0	0	0	111.4	A477 Q569 Q570 G577	A477-V573 HydrophobicContact CB-CG1 4.28Å; Q569-V573 HydrophobicContact CG-CG2 4.49Å; Q569-V573 WeakPolarHBondContact O-CB 3.3Å; Q569-V573 VanDerWaalsContact O-CG2 3.31Å; Q569-V573 WeakPolarHBondContact O-CG2 3.44Å; Q569-V573 PolarHBondContact O-N 3.37Å; Q570-V573 PolarHBondContact O-N 3.11Å; V573-G577 WeakPolarHBondContact O-CA 3.02Å; V573-G577 PolarHBondContact O-N 3.15Å
574	I	81.4	Confident	83.6	Confident	10 Å²	10	29.8 Å²	29.8	5%	0.051	17%	0.166	C	C	.	.	H	α-helix	trans	-71.6	-48.2	-178.8	-68.4	173	0	0	0	110.8	F526 I530 Q570 L571 K578 F645	F526-I574 HydrophobicContact CD1-CG2 4.42Å; I530-I574 HydrophobicContact CD1-CD1 4.03Å; I530-I574 HydrophobicContact CG1-CD1 3.97Å; Q570-I574 HydrophobicContact CG-CD1 3.78Å; Q570-I574 HydrophobicContact CG-CG1 4.45Å; Q570-I574 WeakPolarHBondContact O-CB 3.32Å; Q570-I574 VanDerWaalsContact O-CG1 3.26Å; Q570-I574 WeakPolarHBondContact O-CG1 3.49Å; Q570-I574 PolarHBondContact O-N 3.07Å; L571-I574 PolarHBondContact O-N 3.3Å; I574-K578 WeakPolarHBondContact O-CB 3.4Å; I574-K578 PolarHBondContact O-N 2.86Å; I574-F645 HydrophobicContact CG2-CE1 4.09Å; I574-F645 HydrophobicContact CG2-CE2 4.38Å; I574-F645 HydrophobicContact CG2-CZ 3.71Å
575	M	84.6	Confident	83.7	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-65.3	-62.3	-177.4	-174.5	-178.8	68.4	0	0	110.1	L571 G577 K578 Q579 F645 I646 F653 A656 F659	L571-M575 WeakPolarHBondContact O-CB 3.4Å; L571-M575 PolarHBondContact O-N 3.39Å; M575-G577 PolarHBondContact O-N 3.36Å; M575-K578 PolarHBondContact O-N 3.28Å; M575-Q579 VanDerWaalsContact C-OE1 3.22Å; M575-Q579 WeakPolarHBondContact O-CB 3.26Å; M575-Q579 WeakPolarHBondContact O-CG 3.39Å; M575-Q579 PolarHBondContact O-N 3.45Å; M575-Q579 PolarHBondContact O-OE1 3.41Å; M575-F645 HydrophobicContact SD-CB 4.41Å; M575-I646 HydrophobicContact SD-CG2 4.43Å; M575-F653 HydrophobicContact CE-CE1 4.26Å; M575-A656 HydrophobicContact CE-CB 4.26Å; M575-A656 HydrophobicContact SD-CB 4.26Å; M575-F659 HydrophobicContact CE-CB 3.63Å; M575-F659 HydrophobicContact CE-CD2 4.24Å; M575-F659 HydrophobicContact CE-CG 4.2Å
576	V	83.7	Confident	83.7	Confident	34 Å²	34	33.5 Å²	33.5	21%	0.206	18%	0.183	C	C	.	.	H	α-helix	trans	-67.6	-40.1	-176.9	-179.9	0	0	0	0	111	L572 Q579 I580 F659	L572-V576 HydrophobicContact CD1-CG2 3.65Å; L572-V576 HydrophobicContact CG-CG2 4.46Å; L572-V576 WeakPolarHBondContact O-CB 3.39Å; L572-V576 WeakPolarHBondContact O-CG2 3.39Å; L572-V576 PolarHBondContact O-N 3.36Å; V576-Q579 PolarHBondContact O-N 2.89Å; V576-I580 HydrophobicContact CG1-CD1 3.64Å; V576-I580 HydrophobicContact CG1-CG1 4.24Å; V576-I580 WeakPolarHBondContact O-CB 3.46Å; V576-I580 VanDerWaalsContact O-CG1 3.26Å; V576-I580 WeakPolarHBondContact O-CG1 3.44Å; V576-I580 PolarHBondContact O-N 2.89Å; V576-F659 HydrophobicContact CG2-CB 4.31Å; V576-F659 HydrophobicContact CG2-CD1 4.01Å; V576-F659 HydrophobicContact CG2-CG 4.13Å
577	G	81	Confident	83.8	Confident	21 Å²	21	36.6 Å²	36.6	22%	0.216	20%	0.199	C	C	.	.	H	α-helix	trans	-63.9	-45.4	178.4	0	0	0	0	0	112.3	V573 M575 Q579 I580 I581	V573-G577 WeakPolarHBondContact O-CA 3.02Å; V573-G577 PolarHBondContact O-N 3.15Å; M575-G577 PolarHBondContact O-N 3.36Å; G577-Q579 VanDerWaalsContact C-N 3.35Å; G577-Q579 PolarHBondContact O-N 2.93Å; G577-I580 PolarHBondContact O-N 3.41Å; G577-I581 WeakPolarHBondContact O-CB 3.49Å; G577-I581 WeakPolarHBondContact O-CD1 3.41Å; G577-I581 VanDerWaalsContact O-CG1 3.23Å; G577-I581 WeakPolarHBondContact O-CG1 3.24Å; G577-I581 PolarHBondContact O-N 3.39Å
578	K	79.9	Confident	83.9	Confident	33 Å²	33	41.2 Å²	41.2	14%	0.143	22%	0.223	C	C	.	.	H	α-helix	trans	-60.3	-46.4	175.7	-178	-170.4	173	-173.3	0	110.9	F526 I574 M575 I581 S582	F526-K578 HydrophobicContact CE1-CD 3.82Å; F526-K578 HydrophobicContact CZ-CD 4.03Å; I574-K578 WeakPolarHBondContact O-CB 3.4Å; I574-K578 PolarHBondContact O-N 2.86Å; M575-K578 PolarHBondContact O-N 3.28Å; K578-I581 PolarHBondContact O-N 2.79Å; K578-S582 WeakPolarHBondContact O-CB 3.4Å; K578-S582 PolarHBondContact O-N 2.83Å
579	Q	84	Confident	83.8	Confident	9 Å²	9	44.6 Å²	44.6	4%	0.042	24%	0.24	C	C	.	.	H	α-helix	trans	-65.7	-41.7	-177.4	-75.9	147.1	-2.1	0	0	112.2	M575 V576 G577 I581 S582 N583 N663	M575-Q579 VanDerWaalsContact C-OE1 3.22Å; M575-Q579 WeakPolarHBondContact O-CB 3.26Å; M575-Q579 WeakPolarHBondContact O-CG 3.39Å; M575-Q579 PolarHBondContact O-N 3.45Å; M575-Q579 PolarHBondContact O-OE1 3.41Å; V576-Q579 PolarHBondContact O-N 2.89Å; G577-Q579 VanDerWaalsContact C-N 3.35Å; G577-Q579 PolarHBondContact O-N 2.93Å; Q579-I581 VanDerWaalsContact C-N 3.33Å; Q579-I581 PolarHBondContact O-N 3.12Å; Q579-S582 PolarHBondContact O-N 2.78Å; Q579-N583 WeakPolarHBondContact O-CB 3.37Å; Q579-N583 PolarHBondContact O-N 2.9Å; Q579-N583 PolarHBondContact O-ND2 3.4Å; Q579-N583 PolarHBondContact O-OD1 3.37Å; Q579-N663 WeakPolarHBondContact CG-ND2 3.46Å
580	I	85.3	Confident	83.8	Confident	100 Å²	100	42 Å²	42	51%	0.513	23%	0.23	S	C	.	.	H	α-helix	trans	-61.8	-44.1	173.4	-68.9	170.5	0	0	0	110.7	V576 G577 C584	V576-I580 HydrophobicContact CG1-CD1 3.64Å; V576-I580 HydrophobicContact CG1-CG1 4.24Å; V576-I580 WeakPolarHBondContact O-CB 3.46Å; V576-I580 VanDerWaalsContact O-CG1 3.26Å; V576-I580 WeakPolarHBondContact O-CG1 3.44Å; V576-I580 PolarHBondContact O-N 2.89Å; G577-I580 PolarHBondContact O-N 3.41Å; I580-C584 VanDerWaalsContact O-CB 3.26Å; I580-C584 WeakPolarHBondContact O-CB 3.36Å; I580-C584 PolarHBondContact O-N 2.84Å; I580-C584 PolarHBondContact O-SG 3.44Å
581	I	83.8	Confident	83.9	Confident	57 Å²	57	46 Å²	46	29%	0.292	25%	0.246	S	C	.	.	H	α-helix	trans	-65.4	-42.7	179.4	-69.6	165.5	0	0	0	110.5	L481 M485 G577 K578 Q579 C584 Q585	L481-I581 HydrophobicContact CD2-CD1 3.7Å; M485-I581 HydrophobicContact CE-CG2 4.14Å; G577-I581 WeakPolarHBondContact O-CB 3.49Å; G577-I581 WeakPolarHBondContact O-CD1 3.41Å; G577-I581 VanDerWaalsContact O-CG1 3.23Å; G577-I581 WeakPolarHBondContact O-CG1 3.24Å; G577-I581 PolarHBondContact O-N 3.39Å; K578-I581 PolarHBondContact O-N 2.79Å; Q579-I581 VanDerWaalsContact C-N 3.33Å; Q579-I581 PolarHBondContact O-N 3.12Å; I581-C584 PolarHBondContact O-N 2.8Å; I581-Q585 HydrophobicContact CG2-CG 4.3Å; I581-Q585 WeakPolarHBondContact O-CB 3.26Å; I581-Q585 VanDerWaalsContact O-CG 3.27Å; I581-Q585 WeakPolarHBondContact O-CG 3.15Å; I581-Q585 PolarHBondContact O-N 2.82Å
582	S	83.3	Confident	83.9	Confident	21 Å²	21	50 Å²	50	15%	0.147	27%	0.268	C	S	.	.	H	α-helix	trans	-61.5	-55.9	178.2	-151	0	0	0	0	110.3	K578 Q579 C584 Q585 E586 E638	K578-S582 WeakPolarHBondContact O-CB 3.4Å; K578-S582 PolarHBondContact O-N 2.83Å; Q579-S582 PolarHBondContact O-N 2.78Å; S582-C584 PolarHBondContact O-N 3.38Å; S582-C584 VanDerWaalsContact O-N 3.15Å; S582-Q585 CarbonylContact O-C 3.59Å; S582-Q585 WeakPolarHBondContact O-CA 3.45Å; S582-Q585 WeakPolarHBondContact O-CB 3.29Å; S582-Q585 PolarHBondContact O-N 3.49Å; S582-E586 VanDerWaalsContact O-CG 3.26Å; S582-E586 WeakPolarHBondContact O-CG 3.33Å; S582-E586 PolarHBondContact O-N 3.28Å; S582-E638 WeakPolarHBondContact CB-OE1 3.37Å; S582-E638 VanDerWaalsContact CB-OE2 3.31Å; S582-E638 WeakPolarHBondContact CB-OE2 3.34Å; S582-E638 PolarHBondContact OG-OE2 2.99Å
583	N	87.7	Confident	83.9	Confident	18 Å²	18	52.4 Å²	52.4	10%	0.096	27%	0.272	C	S	.	.	H	α-helix	trans	-55.3	-39.7	177.1	-62.8	-6	0	0	0	112	Q579 I587 N663 E667 L670	Q579-N583 WeakPolarHBondContact O-CB 3.37Å; Q579-N583 PolarHBondContact O-N 2.9Å; Q579-N583 PolarHBondContact O-ND2 3.4Å; Q579-N583 PolarHBondContact O-OD1 3.37Å; N583-I587 WeakPolarHBondContact O-CD1 3.38Å; N583-I587 VanDerWaalsContact O-CG1 3.26Å; N583-I587 WeakPolarHBondContact O-CG1 3.45Å; N583-I587 PolarHBondContact O-N 2.8Å; N583-I587 VanDerWaalsContact O-N 3.12Å; N583-N663 PolarHBondContact ND2-OD1 2.88Å; N583-E667 PolarHBondContact OD1-OE2 3.48Å; N583-E667 VanDerWaalsContact OD1-OE2 3.1Å; N583-L670 HydrophobicContact CB-CD1 3.93Å
584	C	87.7	Confident	83.8	Confident	70 Å²	70	51.2 Å²	51.2	47%	0.473	27%	0.265	S	S	.	.	H	α-helix	trans	-64.5	-45.2	174.3	-73.7	0	0	0	0	112	I580 I581 S582 I587 L588	I580-C584 VanDerWaalsContact O-CB 3.26Å; I580-C584 WeakPolarHBondContact O-CB 3.36Å; I580-C584 PolarHBondContact O-N 2.84Å; I580-C584 PolarHBondContact O-SG 3.44Å; I581-C584 PolarHBondContact O-N 2.8Å; S582-C584 PolarHBondContact O-N 3.38Å; S582-C584 VanDerWaalsContact O-N 3.15Å; C584-I587 PolarHBondContact O-N 3.4Å; C584-L588 WeakPolarHBondContact O-CB 3.32Å; C584-L588 PolarHBondContact O-N 3.41Å
585	Q	85.1	Confident	83.9	Confident	77 Å²	77	58.6 Å²	58.6	36%	0.36	29%	0.292	S	S	.	.	H	α-helix	trans	-63.3	-41.6	177.4	-77.8	178.2	-8.2	0	0	111.2	I581 S582 I587 L588 L589	I581-Q585 HydrophobicContact CG2-CG 4.3Å; I581-Q585 WeakPolarHBondContact O-CB 3.26Å; I581-Q585 VanDerWaalsContact O-CG 3.27Å; I581-Q585 WeakPolarHBondContact O-CG 3.15Å; I581-Q585 PolarHBondContact O-N 2.82Å; S582-Q585 CarbonylContact O-C 3.59Å; S582-Q585 WeakPolarHBondContact O-CA 3.45Å; S582-Q585 WeakPolarHBondContact O-CB 3.29Å; S582-Q585 PolarHBondContact O-N 3.49Å; Q585-I587 VanDerWaalsContact C-N 3.33Å; Q585-I587 PolarHBondContact O-N 2.86Å; Q585-L588 PolarHBondContact O-N 2.91Å; Q585-L589 HydrophobicContact CB-CD1 3.74Å; Q585-L589 HydrophobicContact CB-CG 4.1Å; Q585-L589 HydrophobicContact CG-CD1 4.12Å; Q585-L589 HydrophobicContact CG-CG 4.43Å; Q585-L589 WeakPolarHBondContact O-CA 3.41Å; Q585-L589 WeakPolarHBondContact O-CB 3.31Å; Q585-L589 WeakPolarHBondContact O-CG 3.49Å; Q585-L589 PolarHBondContact O-N 3.47Å
586	E	82.4	Confident	83.8	Confident	26 Å²	26	64.2 Å²	64.2	12%	0.121	32%	0.317	C	S	.	.	H	α-helix	trans	-62.8	-36.5	176.9	-65.3	-136.5	120.4	0	0	113.2	S582 P590 K674	S582-E586 VanDerWaalsContact O-CG 3.26Å; S582-E586 WeakPolarHBondContact O-CG 3.33Å; S582-E586 PolarHBondContact O-N 3.28Å; E586-P590 WeakPolarHBondContact O-CD 3.33Å; E586-P590 WeakPolarHBondContact O-CG 3.46Å; E586-K674 IonicContact OE1-NZ 3.78Å; E586-K674 PolarHBondContact OE1-NZ 3.48Å
587	I	85.5	Confident	83.4	Confident	73 Å²	73	65.2 Å²	65.2	37%	0.374	32%	0.319	S	S	.	.	H	α-helix	trans	-80.7	-39.1	177.9	-65.2	166.1	0	0	0	111.3	N583 C584 Q585 L670	N583-I587 WeakPolarHBondContact O-CD1 3.38Å; N583-I587 VanDerWaalsContact O-CG1 3.26Å; N583-I587 WeakPolarHBondContact O-CG1 3.45Å; N583-I587 PolarHBondContact O-N 2.8Å; N583-I587 VanDerWaalsContact O-N 3.12Å; C584-I587 PolarHBondContact O-N 3.4Å; Q585-I587 VanDerWaalsContact C-N 3.33Å; Q585-I587 PolarHBondContact O-N 2.86Å; I587-L670 HydrophobicContact CD1-CD1 4.29Å; I587-L670 HydrophobicContact CD1-CD2 3.82Å; I587-L670 HydrophobicContact CG1-CD1 4.44Å; I587-L670 HydrophobicContact CG1-CD2 3.73Å
588	L	86.5	Confident	83.1	Confident	98 Å²	98	67.8 Å²	67.8	51%	0.513	32%	0.324	S	S	.	.	H	α-helix	trans	-90.7	-42.8	-168.6	-172.2	63	0	0	0	112.5	C584 Q585 K591 L592	C584-L588 WeakPolarHBondContact O-CB 3.32Å; C584-L588 PolarHBondContact O-N 3.41Å; Q585-L588 PolarHBondContact O-N 2.91Å; L588-K591 PolarHBondContact O-N 3.48Å; L588-L592 HydrophobicContact CD1-CD1 4.13Å; L588-L592 HydrophobicContact CD1-CD2 4.47Å; L588-L592 HydrophobicContact CD1-CG 4Å; L588-L592 HydrophobicContact CD2-CD1 4.06Å; L588-L592 HydrophobicContact CG-CD1 3.63Å; L588-L592 HydrophobicContact CG-CG 3.96Å; L588-L592 WeakPolarHBondContact O-CB 3.39Å; L588-L592 VanDerWaalsContact O-CG 3.3Å; L588-L592 WeakPolarHBondContact O-CG 2.96Å; L588-L592 PolarHBondContact O-N 3.32Å
589	L	83.8	Confident	82.9	Confident	75 Å²	75	73.7 Å²	73.7	39%	0.393	35%	0.347	S	S	.	.	H	α-helix	trans	-60.6	-43.2	-177.4	-65.9	175.7	0	0	0	111.9	Q585 K591 L592 R593	Q585-L589 HydrophobicContact CB-CD1 3.74Å; Q585-L589 HydrophobicContact CB-CG 4.1Å; Q585-L589 HydrophobicContact CG-CD1 4.12Å; Q585-L589 HydrophobicContact CG-CG 4.43Å; Q585-L589 WeakPolarHBondContact O-CA 3.41Å; Q585-L589 WeakPolarHBondContact O-CB 3.31Å; Q585-L589 WeakPolarHBondContact O-CG 3.49Å; Q585-L589 PolarHBondContact O-N 3.47Å; L589-K591 PolarHBondContact O-N 3.33Å; L589-L592 PolarHBondContact O-N 3.25Å; L589-R593 VanDerWaalsContact O-CB 3.27Å; L589-R593 WeakPolarHBondContact O-CB 3.2Å; L589-R593 VanDerWaalsContact O-CG 3.3Å; L589-R593 WeakPolarHBondContact O-CG 3.09Å; L589-R593 PolarHBondContact O-N 3.21Å
590	P	82.1	Confident	82.5	Confident	15 Å²	15	82.5 Å²	82.5	10%	0.097	38%	0.38	C	S	.	.	H	α-helix	trans	-64.2	-42.4	177.8	-27.8	39.1	0	0	0	112.8	E586 L592 R593 T594 I627 E678	E586-P590 WeakPolarHBondContact O-CD 3.33Å; E586-P590 WeakPolarHBondContact O-CG 3.46Å; P590-L592 PolarHBondContact O-N 3.24Å; P590-R593 PolarHBondContact O-N 3.21Å; P590-T594 WeakPolarHBondContact O-CB 3.27Å; P590-T594 PolarHBondContact O-N 2.78Å; P590-T594 PolarHBondContact O-OG1 2.97Å; P590-I627 HydrophobicContact CB-CD1 3.37Å; P590-I627 HydrophobicContact CG-CD1 4.37Å; P590-I627 WeakPolarHBondContact O-CD1 3.41Å; P590-E678 HydrophobicContact CB-CB 4.35Å; P590-E678 WeakPolarHBondContact CB-OE2 3.39Å
591	K	84.2	Confident	81.7	Confident	115 Å²	115	78.9 Å²	78.9	50%	0.5	36%	0.36	S	S	.	.	H	α-helix	trans	-64.3	-43.1	177.2	-69.2	-179.2	-178.3	172.7	0	112.1	L588 L589 W595	L588-K591 PolarHBondContact O-N 3.48Å; L589-K591 PolarHBondContact O-N 3.33Å; K591-W595 WeakPolarHBondContact O-CB 3.3Å; K591-W595 PolarHBondContact O-N 2.88Å
592	L	87	Confident	80.6	Confident	85 Å²	85	77.4 Å²	77.4	45%	0.445	36%	0.359	S	S	.	.	H	α-helix	trans	-65.5	-45.9	176.8	-72.4	178.6	0	0	0	111.9	L588 L589 P590 W595 F596	L588-L592 HydrophobicContact CD1-CD1 4.13Å; L588-L592 HydrophobicContact CD1-CD2 4.47Å; L588-L592 HydrophobicContact CD1-CG 4Å; L588-L592 HydrophobicContact CD2-CD1 4.06Å; L588-L592 HydrophobicContact CG-CD1 3.63Å; L588-L592 HydrophobicContact CG-CG 3.96Å; L588-L592 WeakPolarHBondContact O-CB 3.39Å; L588-L592 VanDerWaalsContact O-CG 3.3Å; L588-L592 WeakPolarHBondContact O-CG 2.96Å; L588-L592 PolarHBondContact O-N 3.32Å; L589-L592 PolarHBondContact O-N 3.25Å; P590-L592 PolarHBondContact O-N 3.24Å; L592-W595 PolarHBondContact O-N 3.49Å; L592-F596 VanDerWaalsContact O-CB 3.29Å; L592-F596 WeakPolarHBondContact O-CB 3.3Å; L592-F596 PolarHBondContact O-N 3.27Å
593	R	83.9	Confident	79.6	Confident	116 Å²	116	77.7 Å²	77.7	44%	0.438	36%	0.358	S	S	.	.	H	α-helix	trans	-63.1	-44.7	177.3	-76.7	-178.2	-179.2	-170.6	3.5	111.1	L589 P590 F596 H597 I627 E630	L589-R593 VanDerWaalsContact O-CB 3.27Å; L589-R593 WeakPolarHBondContact O-CB 3.2Å; L589-R593 VanDerWaalsContact O-CG 3.3Å; L589-R593 WeakPolarHBondContact O-CG 3.09Å; L589-R593 PolarHBondContact O-N 3.21Å; P590-R593 PolarHBondContact O-N 3.21Å; R593-F596 PolarHBondContact O-N 3.23Å; R593-H597 WeakPolarHBondContact O-CB 3.3Å; R593-H597 PolarHBondContact O-N 3.42Å; R593-I627 HydrophobicContact CB-CD1 4.13Å; R593-I627 HydrophobicContact CB-CG1 4.37Å; R593-E630 IonicContact CZ-OE1 2.74Å; R593-E630 IonicContact NH1-OE1 2.65Å; R593-E630 PolarHBondContact NH1-OE1 3.45Å; R593-E630 IonicContact NH1-OE2 2.81Å; R593-E630 IonicContact NH2-OE1 2.65Å
594	T	77.6	Confident	78.1	Confident	23 Å²	23	80.8 Å²	80.8	14%	0.141	38%	0.375	C	S	.	.	H	α-helix	trans	-63.3	-43.8	176.8	-57.4	0	0	0	0	111.1	P590 H597 K598 I627	P590-T594 WeakPolarHBondContact O-CB 3.27Å; P590-T594 PolarHBondContact O-N 2.78Å; P590-T594 PolarHBondContact O-OG1 2.97Å; T594-H597 PolarHBondContact O-N 3.48Å; T594-K598 HydrophobicContact CG2-CD 4.13Å; T594-K598 WeakPolarHBondContact O-CB 3.49Å; T594-K598 VanDerWaalsContact O-CG 3.27Å; T594-K598 WeakPolarHBondContact O-CG 3.26Å; T594-K598 PolarHBondContact O-N 3.05Å; T594-I627 VanDerWaalsContact OG1-CD1 3.29Å; T594-I627 WeakPolarHBondContact OG1-CD1 3.29Å
595	W	82.3	Confident	76.4	Confident	165 Å²	165	87.1 Å²	87.1	63%	0.625	40%	0.395	S	S	*	.	H	α-helix	trans	-62.4	-46.6	176.1	176.3	81.6	0	0	0	111.7	K591 L592 H597 K598 Y599	K591-W595 WeakPolarHBondContact O-CB 3.3Å; K591-W595 PolarHBondContact O-N 2.88Å; L592-W595 PolarHBondContact O-N 3.49Å; W595-H597 PolarHBondContact O-N 3.32Å; W595-K598 PolarHBondContact O-N 2.92Å; W595-Y599 WeakPolarHBondContact O-CB 3.39Å; W595-Y599 PolarHBondContact O-N 3.37Å
596	F	83.4	Confident	74.6	Confident	117 Å²	117	94.3 Å²	94.3	51%	0.513	42%	0.419	S	S	.	.	H	α-helix	trans	-64.6	-39	177	-170.6	-98.6	0	0	0	112	L592 R593 Y599 R600	L592-F596 VanDerWaalsContact O-CB 3.29Å; L592-F596 WeakPolarHBondContact O-CB 3.3Å; L592-F596 PolarHBondContact O-N 3.27Å; R593-F596 PolarHBondContact O-N 3.23Å; F596-Y599 PolarHBondContact O-N 3.43Å; F596-R600 VanDerWaalsContact O-CB 3.3Å; F596-R600 WeakPolarHBondContact O-CB 3.29Å; F596-R600 PolarHBondContact O-N 2.78Å
597	H	75.2	Confident	72.7	Confident	55 Å²	55	96.7 Å²	96.7	26%	0.255	43%	0.432	S	S	.	.	H	α-helix	trans	-63.4	-47	175.6	-167.7	82.1	0	0	0	111.6	R593 T594 W595 Y599 R600 K601	R593-H597 WeakPolarHBondContact O-CB 3.3Å; R593-H597 PolarHBondContact O-N 3.42Å; T594-H597 PolarHBondContact O-N 3.48Å; W595-H597 PolarHBondContact O-N 3.32Å; H597-Y599 VanDerWaalsContact C-N 3.33Å; H597-Y599 PolarHBondContact O-N 3.06Å; H597-R600 PolarHBondContact O-N 3.36Å; H597-K601 WeakPolarHBondContact CE1-CE 3.38Å; H597-K601 PolarHBondContact CE1-NZ 2.96Å; H597-K601 WeakPolarHBondContact NE2-CD 3.37Å; H597-K601 WeakPolarHBondContact NE2-CE 3.42Å; H597-K601 PolarHBondContact NE2-NZ 3.22Å; H597-K601 VanDerWaalsContact NE2-NZ 3.12Å; H597-K601 WeakPolarHBondContact O-CB 3.5Å; H597-K601 PolarHBondContact O-N 3.48Å; H597-K601 VanDerWaalsContact O-N 3.09Å
598	K	73.9	Confident	70.9	Confident	75 Å²	75	95.3 Å²	95.3	33%	0.326	43%	0.427	S	S	.	.	H	α-helix	trans	-60.6	-42.7	175.5	-74.8	174.7	-179.6	179.3	0	111.6	T594 W595 G602 L603	T594-K598 HydrophobicContact CG2-CD 4.13Å; T594-K598 WeakPolarHBondContact O-CB 3.49Å; T594-K598 VanDerWaalsContact O-CG 3.27Å; T594-K598 WeakPolarHBondContact O-CG 3.26Å; T594-K598 PolarHBondContact O-N 3.05Å; W595-K598 PolarHBondContact O-N 2.92Å; K598-G602 PolarHBondContact O-N 3.41Å; K598-L603 PolarHBondContact O-N 2.88Å; K598-L603 VanDerWaalsContact O-N 3.11Å
599	Y	77.6	Confident	68.7	Low	157 Å²	157	93.9 Å²	93.9	62%	0.616	43%	0.429	S	S	*	.	H	α-helix	trans	-65.1	-49.6	177.6	-172.9	-98.3	0	0	0	111.9	W595 F596 H597 K601 G602	W595-Y599 WeakPolarHBondContact O-CB 3.39Å; W595-Y599 PolarHBondContact O-N 3.37Å; F596-Y599 PolarHBondContact O-N 3.43Å; H597-Y599 VanDerWaalsContact C-N 3.33Å; H597-Y599 PolarHBondContact O-N 3.06Å; Y599-K601 VanDerWaalsContact C-N 3.29Å; Y599-K601 PolarHBondContact O-N 3.42Å; Y599-G602 PolarHBondContact O-N 3.2Å
600	R	75.1	Confident	66.5	Low	194 Å²	194	95.5 Å²	95.5	73%	0.732	45%	0.447	S	S	*	.	H	α-helix	trans	-62.9	-33.4	-178.4	-174.9	173.4	178.4	156.1	-1.1	113	F596 H597	F596-R600 VanDerWaalsContact O-CB 3.3Å; F596-R600 WeakPolarHBondContact O-CB 3.29Å; F596-R600 PolarHBondContact O-N 2.78Å; H597-R600 PolarHBondContact O-N 3.36Å
601	K	67	Low	64.7	Low	25 Å²	25	98.4 Å²	98.4	11%	0.109	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	0.1	-179.5	-68.5	-167.6	174.7	177.3	0	114.7	D49 H597 Y599 L603 Y624	D49-K601 WeakPolarHBondContact OD2-CE 3.36Å; D49-K601 IonicContact OD2-NZ 3.33Å; D49-K601 PolarHBondContact OD2-NZ 2.88Å; H597-K601 WeakPolarHBondContact CE1-CE 3.38Å; H597-K601 PolarHBondContact CE1-NZ 2.96Å; H597-K601 WeakPolarHBondContact NE2-CD 3.37Å; H597-K601 WeakPolarHBondContact NE2-CE 3.42Å; H597-K601 PolarHBondContact NE2-NZ 3.22Å; H597-K601 VanDerWaalsContact NE2-NZ 3.12Å; H597-K601 WeakPolarHBondContact O-CB 3.5Å; H597-K601 PolarHBondContact O-N 3.48Å; H597-K601 VanDerWaalsContact O-N 3.09Å; Y599-K601 VanDerWaalsContact C-N 3.29Å; Y599-K601 PolarHBondContact O-N 3.42Å; K601-L603 HydrophobicContact CB-CD1 3.76Å; K601-L603 HydrophobicContact CB-CG 4Å; K601-L603 HydrophobicContact CD-CD1 4.15Å; K601-L603 PolarHBondContact O-N 3.43Å; K601-Y624 HydrophobicContact CD-CE1 4.41Å; K601-Y624 PolarHBondContact NZ-OH 3.09Å
602	G	62.6	Low	62.5	Low	25 Å²	25	96.7 Å²	96.7	26%	0.258	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	66	17.2	-178.7	0	0	0	0	0	114.3	K598 Y599 N604	K598-G602 PolarHBondContact O-N 3.41Å; Y599-G602 PolarHBondContact O-N 3.2Å; G602-N604 PolarHBondContact O-N 3.49Å
603	L	61.4	Low	60.4	Low	27 Å²	27	100.1 Å²	100.1	14%	0.141	49%	0.486	C	S	.	.			trans	-77.2	26.7	-178	-71.9	163.4	0	0	0	112.9	K598 K601 K625	K598-L603 PolarHBondContact O-N 2.88Å; K598-L603 VanDerWaalsContact O-N 3.11Å; K601-L603 HydrophobicContact CB-CD1 3.76Å; K601-L603 HydrophobicContact CB-CG 4Å; K601-L603 HydrophobicContact CD-CD1 4.15Å; K601-L603 PolarHBondContact O-N 3.43Å; L603-K625 HydrophobicContact CD1-CG 4.29Å
604	N	55.3	Low	58.7	Low	84 Å²	84	98.8 Å²	98.8	45%	0.449	49%	0.487	S	S	.	.			trans	-72.2	132.6	178.7	-89.5	-18.8	0	0	0	110.2	G602 R606 N607	G602-N604 PolarHBondContact O-N 3.49Å; N604-R606 PolarHBondContact O-N 3.28Å; N604-N607 PolarHBondContact O-N 3.2Å; N604-N607 VanDerWaalsContact O-N 3.09Å
605	K	53.3	Low	56.9	Low	203 Å²	203	100.2 Å²	100.2	88%	0.883	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.6	-20.7	-177.9	-92.2	-175.2	172.4	-175.8	0	115.4
606	R	46.7	Very low	54.9	Low	228 Å²	228	98.1 Å²	98.1	86%	0.86	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-27.5	-179.7	-89	-178.8	165.6	146.5	-3	114.8	N604	N604-R606 PolarHBondContact O-N 3.28Å
607	N	42	Very low	53.4	Low	75 Å²	75	94.2 Å²	94.2	40%	0.401	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-10.5	-179.1	-69.2	5.5	0	0	0	113.4	E90 N604	E90-N607 VanDerWaalsContact CD-ND2 3.32Å; E90-N607 PolarHBondContact OE1-ND2 3.4Å; E90-N607 PolarHBondContact OE2-ND2 2.93Å; N604-N607 PolarHBondContact O-N 3.2Å; N604-N607 VanDerWaalsContact O-N 3.09Å
608	V	47.1	Very low	53.1	Low	44 Å²	44	92.6 Å²	92.6	27%	0.267	49%	0.49	S	S	.	.	S	Bend	trans	-89.4	-7.9	177	-175.2	0	0	0	0	111.6	S610 T611	V608-S610 PolarHBondContact O-N 3.5Å; V608-S610 VanDerWaalsContact O-N 3.1Å; V608-T611 CarbonylContact O-C 3.5Å; V608-T611 PolarHBondContact O-N 3.48Å; V608-T611 PolarHBondContact O-OG1 2.94Å
609	A	41	Very low	53.4	Low	68 Å²	68	90.3 Å²	90.3	56%	0.562	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-15.5	-178.6	0	0	0	0	0	114.4	S612	A609-S612 PolarHBondContact O-OG 3.35Å
610	S	38.6	Very low	53.7	Low	109 Å²	109	83 Å²	83	76%	0.762	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-1.4	173.6	39	0	0	0	0	114.1	V608	V608-S610 PolarHBondContact O-N 3.5Å; V608-S610 VanDerWaalsContact O-N 3.1Å
611	T	42.7	Very low	54.1	Low	77 Å²	77	74.8 Å²	74.8	47%	0.472	42%	0.423	S	S	.	.	S	Bend	trans	-122.1	38.4	168.9	35.8	0	0	0	0	109.9	V608 D613 L614	V608-T611 CarbonylContact O-C 3.5Å; V608-T611 PolarHBondContact O-N 3.48Å; V608-T611 PolarHBondContact O-OG1 2.94Å; T611-D613 PolarHBondContact O-N 3.02Å; T611-D613 VanDerWaalsContact O-N 3.1Å; T611-L614 PolarHBondContact O-N 3.4Å
612	S	39.3	Very low	54.8	Low	79 Å²	79	77.6 Å²	77.6	55%	0.552	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-17	-172.1	32.5	0	0	0	0	114.7	A609	A609-S612 PolarHBondContact O-OG 3.35Å
613	D	42	Very low	56	Low	157 Å²	157	76.6 Å²	76.6	84%	0.84	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-13.8	174.2	-65.3	-27.2	0	0	0	113.9	T611	T611-D613 PolarHBondContact O-N 3.02Å; T611-D613 VanDerWaalsContact O-N 3.1Å
614	L	47.7	Very low	57.3	Low	87 Å²	87	75.5 Å²	75.5	46%	0.455	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-21	-171.2	-149.8	76	0	0	0	114	T611 A617 H618	T611-L614 PolarHBondContact O-N 3.4Å; L614-A617 PolarHBondContact O-N 3.3Å; L614-H618 PolarHBondContact O-ND1 3.48Å
615	S	41.7	Very low	58.6	Low	54 Å²	54	72.9 Å²	72.9	38%	0.378	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-28.9	-173.5	169.1	0	0	0	0	114.2	A617	S615-A617 VanDerWaalsContact C-N 3.34Å
616	S	40.4	Very low	60.2	Low	121 Å²	121	64.6 Å²	64.6	85%	0.846	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-9.2	178	-48.3	0	0	0	0	112.5
617	A	51.8	Low	62.1	Low	34 Å²	34	54.6 Å²	54.6	28%	0.281	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-14.9	-166.1	0	0	0	0	0	115	G32 L614 S615	G32-A617 WeakPolarHBondContact CA-O 3.34Å; G32-A617 PolarHBondContact N-O 3.47Å; L614-A617 PolarHBondContact O-N 3.3Å; S615-A617 VanDerWaalsContact C-N 3.34Å
618	H	67.6	Low	64.3	Low	21 Å²	21	54.3 Å²	54.3	10%	0.097	34%	0.335	C	S	.	.			trans	-126.3	94.6	-169.2	-63.2	104.4	0	0	0	113.4	E85 L614 F620 I621	E85-H618 IonicContact OE1-CE1 3.53Å; L614-H618 PolarHBondContact O-ND1 3.48Å; H618-F620 VanDerWaalsContact C-N 3.26Å; H618-F620 HydrophobicContact CB-CD1 4.15Å; H618-F620 HydrophobicContact CB-CE1 3.56Å; H618-F620 HydrophobicContact CB-CE2 4.31Å; H618-F620 HydrophobicContact CB-CZ 3.63Å; H618-F620 AromaticContact CD2-CE1 3.52Å; H618-F620 AromaticContact CD2-CZ 3.78Å; H618-F620 AromaticContact CG-CE1 3.82Å; H618-F620 AromaticContact CG-CZ 3.82Å; H618-F620 PolarHBondContact O-N 3.35Å; H618-I621 HydrophobicContact CB-CD1 3.83Å; H618-I621 HydrophobicContact CB-CG1 4.02Å; H618-I621 PolarHBondContact O-N 2.93Å; H618-I621 VanDerWaalsContact O-N 3.09Å
619	I	81.1	Confident	66.3	Low	28 Å²	28	55.1 Å²	55.1	14%	0.144	33%	0.333	C	S	.	.	H	α-helix	trans	-56.3	-36.6	-176.8	-66.3	167.6	0	0	0	112.6	Y33 I621 E622 D623	Y33-I619 HydrophobicContact CD1-CD1 3.79Å; Y33-I619 HydrophobicContact CD2-CD1 3.99Å; Y33-I619 HydrophobicContact CE1-CD1 3.25Å; Y33-I619 HydrophobicContact CE2-CD1 3.5Å; Y33-I619 VanDerWaalsContact CE2-CD1 3.5Å; Y33-I619 HydrophobicContact CG-CD1 4.14Å; I619-I621 PolarHBondContact O-N 3.49Å; I619-E622 PolarHBondContact O-N 2.88Å; I619-E622 VanDerWaalsContact O-N 3.15Å; I619-D623 PolarHBondContact O-N 3.43Å
620	F	83.3	Confident	68.4	Low	2 Å²	2	57.9 Å²	57.9	1%	0.009	34%	0.335	C	S	.	.	H	α-helix	trans	-62.6	-29.2	179.6	60.2	-95.6	0	0	0	113.2	I42 V45 E85 Y96 Y218 I220 H618 Y624	I42-F620 HydrophobicContact CD1-CD1 4.19Å; V45-F620 HydrophobicContact CG2-CB 4.02Å; E85-F620 VanDerWaalsContact OE2-CZ 3.31Å; E85-F620 WeakPolarHBondContact OE2-CZ 3.26Å; Y96-F620 AromaticContact CD1-CD2 3.64Å; Y96-F620 HydrophobicContact CD1-CD2 3.64Å; Y96-F620 AromaticContact CD1-CE2 3.99Å; Y96-F620 HydrophobicContact CD1-CE2 3.99Å; Y96-F620 HydrophobicContact CD2-CE2 4.16Å; Y96-F620 HydrophobicContact CE1-CD2 4.05Å; Y96-F620 HydrophobicContact CE1-CE2 4.47Å; Y96-F620 AromaticContact CG-CD2 3.96Å; Y96-F620 HydrophobicContact CG-CD2 3.96Å; Y96-F620 AromaticContact CG-CE2 3.82Å; Y96-F620 HydrophobicContact CG-CE2 3.82Å; Y218-F620 PolarHBondContact OH-O 2.84Å; I220-F620 HydrophobicContact CG2-CB 4.15Å; H618-F620 VanDerWaalsContact C-N 3.26Å; H618-F620 HydrophobicContact CB-CD1 4.15Å; H618-F620 HydrophobicContact CB-CE1 3.56Å; H618-F620 HydrophobicContact CB-CE2 4.31Å; H618-F620 HydrophobicContact CB-CZ 3.63Å; H618-F620 AromaticContact CD2-CE1 3.52Å; H618-F620 AromaticContact CD2-CZ 3.78Å; H618-F620 AromaticContact CG-CE1 3.82Å; H618-F620 AromaticContact CG-CZ 3.82Å; H618-F620 PolarHBondContact O-N 3.35Å; F620-Y624 PolarHBondContact O-N 3.43Å
621	I	84.1	Confident	70.6	Confident	23 Å²	23	53.7 Å²	53.7	12%	0.118	31%	0.308	C	S	.	.	H	α-helix	trans	-70.6	-39.5	176.7	-57.8	-180	0	0	0	110.5	V87 Y96 H618 I619	V87-I621 HydrophobicContact CG2-CD1 3.95Å; Y96-I621 HydrophobicContact CE2-CG1 4.38Å; H618-I621 HydrophobicContact CB-CD1 3.83Å; H618-I621 HydrophobicContact CB-CG1 4.02Å; H618-I621 PolarHBondContact O-N 2.93Å; H618-I621 VanDerWaalsContact O-N 3.09Å; I619-I621 PolarHBondContact O-N 3.49Å
622	E	82.2	Confident	72.9	Confident	84 Å²	84	50.5 Å²	50.5	39%	0.393	29%	0.288	S	S	.	.	H	α-helix	trans	-68.2	-42	175.5	-70.4	-57	132.4	0	0	111.3	I619 Y624 K625	I619-E622 PolarHBondContact O-N 2.88Å; I619-E622 VanDerWaalsContact O-N 3.15Å; E622-Y624 VanDerWaalsContact C-N 3.28Å; E622-Y624 PolarHBondContact O-N 2.61Å; E622-K625 WeakPolarHBondContact O-CB 3.28Å; E622-K625 PolarHBondContact O-N 3.22Å; E622-K625 IonicContact OE1-NZ 3.3Å; E622-K625 PolarHBondContact OE1-NZ 2.97Å; E622-K625 IonicContact OE2-NZ 2.77Å
623	D	87.3	Confident	75.2	Confident	4 Å²	4	49 Å²	49	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-63.6	-33.7	177.3	-76	-7.2	0	0	0	112.2	Y218 I220 H221 R241 I619 K625 L626 R680	Y218-D623 HydrophobicContact CD2-CB 4.3Å; Y218-D623 HydrophobicContact CE2-CB 3.83Å; I220-D623 WeakPolarHBondContact CA-OD2 3.42Å; H221-D623 IonicContact CD2-OD1 3.74Å; H221-D623 PolarHBondContact CD2-OD1 3.31Å; H221-D623 IonicContact CD2-OD2 2.9Å; H221-D623 IonicContact CG-OD1 2.65Å; H221-D623 IonicContact CG-OD2 2.64Å; H221-D623 PolarHBondContact N-OD2 3.49Å; R241-D623 IonicContact NH1-OD1 2.93Å; I619-D623 PolarHBondContact O-N 3.43Å; D623-K625 PolarHBondContact O-N 3.3Å; D623-L626 VanDerWaalsContact O-CB 3.32Å; D623-L626 WeakPolarHBondContact O-CB 3.35Å; D623-L626 PolarHBondContact O-N 2.97Å; D623-L626 VanDerWaalsContact O-N 3.09Å; D623-R680 WeakPolarHBondContact O-CG 3.46Å
624	Y	87.2	Confident	77.4	Confident	3 Å²	3	44.6 Å²	44.6	1%	0.012	25%	0.249	C	C	.	.	H	α-helix	trans	-61.9	-31.3	174	-172.7	-134.3	0	0	0	112.9	V47 D49 T94 Y96 A216 Y218 K601 F620 E622 L626 R680	V47-Y624 HydrophobicContact CB-CD2 4.36Å; V47-Y624 HydrophobicContact CB-CE2 3.92Å; V47-Y624 HydrophobicContact CG1-CD1 4.35Å; V47-Y624 HydrophobicContact CG1-CD2 4.29Å; V47-Y624 HydrophobicContact CG1-CE1 3.77Å; V47-Y624 HydrophobicContact CG1-CE2 3.74Å; V47-Y624 WeakPolarHBondContact CG1-OH 3.49Å; V47-Y624 HydrophobicContact CG2-CD2 4.19Å; V47-Y624 HydrophobicContact CG2-CE2 4.27Å; D49-Y624 PolarHBondContact OD1-OH 3.32Å; D49-Y624 PolarHBondContact OD2-OH 3.48Å; D49-Y624 VanDerWaalsContact OD2-OH 3.05Å; T94-Y624 HydrophobicContact CG2-CE1 4.01Å; Y96-Y624 HydrophobicContact CE1-CD1 4.18Å; Y96-Y624 HydrophobicContact CE1-CG 4.29Å; Y96-Y624 WeakPolarHBondContact OH-CD1 3.46Å; A216-Y624 HydrophobicContact CB-CD2 4.19Å; A216-Y624 HydrophobicContact CB-CE2 3.74Å; Y218-Y624 AromaticContact CE1-CD2 3.87Å; Y218-Y624 HydrophobicContact CE1-CD2 3.87Å; K601-Y624 HydrophobicContact CD-CE1 4.41Å; K601-Y624 PolarHBondContact NZ-OH 3.09Å; F620-Y624 PolarHBondContact O-N 3.43Å; E622-Y624 VanDerWaalsContact C-N 3.28Å; E622-Y624 PolarHBondContact O-N 2.61Å; Y624-L626 PolarHBondContact O-N 3.01Å; Y624-R680 PolarHBondContact O-NH2 3.16Å
625	K	83.6	Confident	79.4	Confident	29 Å²	29	41.4 Å²	41.4	13%	0.126	23%	0.232	C	C	.	.	H	α-helix	trans	-72.2	-18.1	177.6	-61.9	168.7	-171.1	170.5	0	112.5	L603 E622 D623	L603-K625 HydrophobicContact CD1-CG 4.29Å; E622-K625 WeakPolarHBondContact O-CB 3.28Å; E622-K625 PolarHBondContact O-N 3.22Å; E622-K625 IonicContact OE1-NZ 3.3Å; E622-K625 PolarHBondContact OE1-NZ 2.97Å; E622-K625 IonicContact OE2-NZ 2.77Å; D623-K625 PolarHBondContact O-N 3.3Å
626	L	86.8	Confident	81.9	Confident	29 Å²	29	39.4 Å²	39.4	15%	0.152	22%	0.216	C	C	.	.	S	Bend	trans	-74.8	161.4	176.7	-57.7	174.8	0	0	0	111.6	D623 Y624 C677 R680	D623-L626 VanDerWaalsContact O-CB 3.32Å; D623-L626 WeakPolarHBondContact O-CB 3.35Å; D623-L626 PolarHBondContact O-N 2.97Å; D623-L626 VanDerWaalsContact O-N 3.09Å; Y624-L626 PolarHBondContact O-N 3.01Å; L626-C677 WeakPolarHBondContact CD2-O 3.48Å; L626-R680 HydrophobicContact CB-CG 3.84Å; L626-R680 PolarHBondContact O-NE 2.81Å; L626-R680 PolarHBondContact O-NH2 3.15Å
627	I	87	Confident	84.3	Confident	18 Å²	18	34.1 Å²	34.1	9%	0.092	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-79.8	139.2	-176.6	-69.5	156.9	0	0	0	110.2	P590 R593 T594 Y629 E678 T679 R680	P590-I627 HydrophobicContact CB-CD1 3.37Å; P590-I627 HydrophobicContact CG-CD1 4.37Å; P590-I627 WeakPolarHBondContact O-CD1 3.41Å; R593-I627 HydrophobicContact CB-CD1 4.13Å; R593-I627 HydrophobicContact CB-CG1 4.37Å; T594-I627 VanDerWaalsContact OG1-CD1 3.29Å; T594-I627 WeakPolarHBondContact OG1-CD1 3.29Å; I627-Y629 PolarHBondContact O-N 3.42Å; I627-E678 PolarHBondContact N-O 2.56Å; I627-E678 VanDerWaalsContact N-O 3.11Å; I627-T679 CarbonylContact O-C 3.43Å; I627-T679 WeakPolarHBondContact O-CA 3.23Å; I627-R680 PolarHBondContact O-N 2.53Å
628	P	88.4	Confident	86.2	Confident	70 Å²	70	33.1 Å²	33.1	46%	0.455	17%	0.167	S	C	.	.	P	Polyproline II helix	trans	-59.6	134.9	172.7	26.9	-35.7	0	0	0	110.5	E630	P628-E630 PolarHBondContact O-N 3.08Å
629	Y	88.8	Confident	87.4	Confident	60 Å²	60	32.1 Å²	32.1	24%	0.235	16%	0.163	C	C	.	.	P	Polyproline II helix	trans	-67.4	125.7	172.5	169.4	-103.8	0	0	0	110.1	I627 G631 L632 L675 P682	I627-Y629 PolarHBondContact O-N 3.42Å; Y629-G631 WeakPolarHBondContact CE2-O 3.29Å; Y629-L632 WeakPolarHBondContact OH-CG 3.31Å; Y629-L675 HydrophobicContact CD2-CD2 3.92Å; Y629-L675 HydrophobicContact CE2-CD2 3.82Å; Y629-P682 HydrophobicContact CD1-CB 3.58Å; Y629-P682 HydrophobicContact CD2-CB 4.1Å; Y629-P682 HydrophobicContact CE1-CB 3.68Å; Y629-P682 HydrophobicContact CE2-CB 4.22Å; Y629-P682 HydrophobicContact CG-CB 3.76Å
630	E	83.8	Confident	88	Confident	127 Å²	127	30.8 Å²	30.8	59%	0.593	16%	0.156	S	C	*	.			trans	-95.8	-3.2	-174.3	-66.1	-175.1	172.1	0	0	113.6	R593 P628	R593-E630 IonicContact CZ-OE1 2.74Å; R593-E630 IonicContact NH1-OE1 2.65Å; R593-E630 PolarHBondContact NH1-OE1 3.45Å; R593-E630 IonicContact NH1-OE2 2.81Å; R593-E630 IonicContact NH2-OE1 2.65Å; P628-E630 PolarHBondContact O-N 3.08Å
631	G	86.8	Confident	88.5	Confident	20 Å²	20	30.7 Å²	30.7	21%	0.206	16%	0.156	C	C	.	.			trans	113.4	-170.3	-177.5	0	0	0	0	0	113	Y629	Y629-G631 WeakPolarHBondContact CE2-O 3.29Å
632	L	89.1	Confident	88.9	Confident	10 Å²	10	29.7 Å²	29.7	5%	0.052	15%	0.15	C	C	.	.	S	Bend	trans	-110.5	6.6	173.7	-77.7	165.1	0	0	0	112.6	K270 I271 Y274 Y629 E635 Y636	K270-L632 HydrophobicContact CG-CD1 4.2Å; I271-L632 HydrophobicContact CB-CD1 4.48Å; I271-L632 HydrophobicContact CG1-CD1 3.78Å; I271-L632 HydrophobicContact CG1-CG 4.41Å; Y274-L632 HydrophobicContact CD1-CD2 3.78Å; Y274-L632 HydrophobicContact CD2-CD2 4.23Å; Y274-L632 HydrophobicContact CE1-CD2 4.24Å; Y274-L632 HydrophobicContact CG-CD1 4.48Å; Y274-L632 HydrophobicContact CG-CD2 3.78Å; Y629-L632 WeakPolarHBondContact OH-CG 3.31Å; L632-E635 WeakPolarHBondContact CA-OE2 3.25Å; L632-E635 HydrophobicContact CD2-CB 4.44Å; L632-Y636 HydrophobicContact CB-CD2 3.95Å; L632-Y636 HydrophobicContact CB-CE2 4Å; L632-Y636 HydrophobicContact CD1-CE2 4.27Å; L632-Y636 VanDerWaalsContact O-CD2 3.26Å; L632-Y636 WeakPolarHBondContact O-CD2 3.5Å; L632-Y636 PolarHBondContact O-N 3.28Å
633	F	88.8	Confident	89.5	Confident	47 Å²	47	25.7 Å²	25.7	21%	0.206	13%	0.132	C	C	.	.	H	α-helix	trans	-64.6	-47.7	-168.9	173	-100.6	0	0	0	111.3	I515 V518 L637 W693	I515-F633 HydrophobicContact CB-CE2 4.14Å; I515-F633 HydrophobicContact CG1-CD2 3.64Å; I515-F633 HydrophobicContact CG1-CE2 3.7Å; I515-F633 HydrophobicContact CG2-CE2 4.34Å; V518-F633 HydrophobicContact CB-CE1 4.21Å; V518-F633 HydrophobicContact CB-CE2 4.32Å; V518-F633 HydrophobicContact CB-CZ 3.5Å; V518-F633 HydrophobicContact CG1-CE1 3.71Å; V518-F633 HydrophobicContact CG1-CZ 3.37Å; V518-F633 HydrophobicContact CG2-CE1 4.5Å; V518-F633 HydrophobicContact CG2-CZ 4.09Å; F633-L637 HydrophobicContact CE1-CD2 3.99Å; F633-L637 HydrophobicContact CZ-CB 4.46Å; F633-L637 HydrophobicContact CZ-CD2 4.08Å; F633-L637 VanDerWaalsContact O-CB 3.27Å; F633-L637 WeakPolarHBondContact O-CB 3.14Å; F633-L637 PolarHBondContact O-N 3.44Å; F633-W693 HydrophobicContact CD2-CH2 4.49Å; F633-W693 AromaticContact CD2-CZ2 3.96Å; F633-W693 HydrophobicContact CD2-CZ2 3.96Å; F633-W693 AromaticContact CE2-CH2 3.94Å; F633-W693 HydrophobicContact CE2-CH2 3.94Å; F633-W693 AromaticContact CE2-CZ2 3.83Å; F633-W693 HydrophobicContact CE2-CZ2 3.83Å
634	D	87.4	Confident	89.9	Confident	66 Å²	66	25.5 Å²	25.5	35%	0.353	13%	0.131	S	C	.	.	H	α-helix	trans	-69.2	-38.4	-177.8	-67.5	-28.2	0	0	0	110.8	L637 E638	D634-L637 PolarHBondContact O-N 3.2Å; D634-E638 PolarHBondContact O-N 3.34Å
635	E	90.6	Very high	90.1	Very high	20 Å²	20	25.4 Å²	25.4	9%	0.093	13%	0.13	C	C	.	.	H	α-helix	trans	-61.6	-49.5	177.3	-67.1	78.3	-175.6	0	0	111.7	Y274 L632 E638 M639 K674	Y274-E635 HydrophobicContact CE2-CB 3.84Å; L632-E635 WeakPolarHBondContact CA-OE2 3.25Å; L632-E635 HydrophobicContact CD2-CB 4.44Å; E635-E638 PolarHBondContact O-N 2.92Å; E635-M639 WeakPolarHBondContact O-CG 3.35Å; E635-M639 PolarHBondContact O-N 3.48Å; E635-K674 IonicContact OE1-NZ 2.78Å; E635-K674 PolarHBondContact OE1-NZ 3.41Å
636	Y	93.4	Very high	90.6	Very high	11 Å²	11	24 Å²	24	4%	0.043	12%	0.124	C	C	.	.	H	α-helix	trans	-64.8	-42.4	174.1	-82.5	-68.2	0	0	0	112.1	Y274 W277 L632 E638 M639 V640 I690 W693	Y274-Y636 WeakPolarHBondContact CA-OH 3.47Å; Y274-Y636 WeakPolarHBondContact CB-OH 3.29Å; Y274-Y636 AromaticContact CD2-CD1 3.93Å; Y274-Y636 HydrophobicContact CD2-CD1 3.93Å; Y274-Y636 HydrophobicContact CD2-CD2 4.14Å; Y274-Y636 AromaticContact CD2-CE1 3.67Å; Y274-Y636 HydrophobicContact CD2-CE1 3.67Å; Y274-Y636 AromaticContact CD2-CE2 3.88Å; Y274-Y636 HydrophobicContact CD2-CE2 3.88Å; Y274-Y636 HydrophobicContact CD2-CG 4.16Å; Y274-Y636 AromaticContact CD2-CZ 3.64Å; Y274-Y636 HydrophobicContact CE2-CD1 4.37Å; Y274-Y636 HydrophobicContact CG-CE2 4.44Å; Y274-Y636 PolarHBondContact N-OH 3.18Å; W277-Y636 HydrophobicContact CE3-CD1 4.32Å; W277-Y636 HydrophobicContact CE3-CE1 4.2Å; W277-Y636 HydrophobicContact CZ3-CD1 4.42Å; L632-Y636 HydrophobicContact CB-CD2 3.95Å; L632-Y636 HydrophobicContact CB-CE2 4Å; L632-Y636 HydrophobicContact CD1-CE2 4.27Å; L632-Y636 VanDerWaalsContact O-CD2 3.26Å; L632-Y636 WeakPolarHBondContact O-CD2 3.5Å; L632-Y636 PolarHBondContact O-N 3.28Å; Y636-E638 VanDerWaalsContact C-N 3.28Å; Y636-E638 PolarHBondContact O-N 3.17Å; Y636-M639 PolarHBondContact O-N 3.24Å; Y636-V640 WeakPolarHBondContact O-CB 3.41Å; Y636-V640 VanDerWaalsContact O-CG2 3.24Å; Y636-V640 WeakPolarHBondContact O-CG2 3.21Å; Y636-V640 PolarHBondContact O-N 2.88Å; Y636-I690 HydrophobicContact CE1-CB 4.27Å; Y636-I690 HydrophobicContact CE1-CG2 3.95Å; Y636-I690 WeakPolarHBondContact OH-CG2 3.41Å; Y636-W693 AromaticContact CD1-CD1 3.96Å; Y636-W693 HydrophobicContact CD1-CG 4.43Å; Y636-W693 AromaticContact CD2-CD1 3.96Å; Y636-W693 AromaticContact CD2-NE1 3.59Å; Y636-W693 AromaticContact CG-CD1 3.72Å; Y636-W693 HydrophobicContact CG-CG 4.41Å; Y636-W693 AromaticContact CG-NE1 3.5Å
637	L	92	Very high	90.9	Very high	10 Å²	10	22.9 Å²	22.9	5%	0.052	12%	0.118	C	C	.	.	H	α-helix	trans	-59.2	-41.6	-179.8	178.1	65.4	0	0	0	111.2	V518 Q522 F633 D634 L641 W693	V518-L637 HydrophobicContact CG1-CD2 4.36Å; Q522-L637 HydrophobicContact CB-CD1 4.3Å; Q522-L637 HydrophobicContact CG-CD1 4.46Å; Q522-L637 HydrophobicContact CG-CD2 4.09Å; F633-L637 HydrophobicContact CE1-CD2 3.99Å; F633-L637 HydrophobicContact CZ-CB 4.46Å; F633-L637 HydrophobicContact CZ-CD2 4.08Å; F633-L637 VanDerWaalsContact O-CB 3.27Å; F633-L637 WeakPolarHBondContact O-CB 3.14Å; F633-L637 PolarHBondContact O-N 3.44Å; D634-L637 PolarHBondContact O-N 3.2Å; L637-L641 HydrophobicContact CD1-CD1 4.05Å; L637-L641 HydrophobicContact CD1-CG 4.25Å; L637-L641 HydrophobicContact CG-CD1 4.04Å; L637-L641 WeakPolarHBondContact O-CB 3.42Å; L637-L641 VanDerWaalsContact O-CG 3.25Å; L637-L641 WeakPolarHBondContact O-CG 3.42Å; L637-L641 PolarHBondContact O-N 2.86Å; L637-W693 HydrophobicContact CB-CH2 3.89Å; L637-W693 HydrophobicContact CD1-CH2 4.15Å; L637-W693 HydrophobicContact CD1-CZ3 4.45Å
638	E	89.8	Confident	91.3	Very high	13 Å²	13	22 Å²	22	6%	0.061	11%	0.114	C	C	.	.	H	α-helix	trans	-60.4	-51.3	176.7	-172.7	169.9	172	0	0	111.8	S582 D634 E635 Y636 V640 L641 Q642	S582-E638 WeakPolarHBondContact CB-OE1 3.37Å; S582-E638 VanDerWaalsContact CB-OE2 3.31Å; S582-E638 WeakPolarHBondContact CB-OE2 3.34Å; S582-E638 PolarHBondContact OG-OE2 2.99Å; D634-E638 PolarHBondContact O-N 3.34Å; E635-E638 PolarHBondContact O-N 2.92Å; Y636-E638 VanDerWaalsContact C-N 3.28Å; Y636-E638 PolarHBondContact O-N 3.17Å; E638-V640 PolarHBondContact O-N 3.19Å; E638-L641 PolarHBondContact O-N 2.84Å; E638-Q642 PolarHBondContact O-N 2.92Å
639	M	93.2	Very high	91.5	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-67.3	-35.8	-177.1	-62.5	-60.9	118.1	0	0	112.7	W277 L278 E635 Y636 Q642 F643 E667	W277-M639 HydrophobicContact CH2-CB 3.51Å; W277-M639 HydrophobicContact CZ3-CB 3.43Å; W277-M639 VanDerWaalsContact CZ3-CB 3.43Å; W277-M639 HydrophobicContact CZ3-CG 4Å; L278-M639 HydrophobicContact CD1-CG 3.99Å; L278-M639 HydrophobicContact CD1-SD 3.68Å; E635-M639 WeakPolarHBondContact O-CG 3.35Å; E635-M639 PolarHBondContact O-N 3.48Å; Y636-M639 PolarHBondContact O-N 3.24Å; M639-Q642 WeakPolarHBondContact O-CB 3.32Å; M639-Q642 PolarHBondContact O-N 3.49Å; M639-F643 PolarHBondContact O-N 2.86Å; M639-E667 HydrophobicContact CE-CB 4.4Å; M639-E667 HydrophobicContact CE-CG 3.54Å; M639-E667 VanDerWaalsContact CE-OE1 3.28Å; M639-E667 WeakPolarHBondContact CE-OE1 3.38Å; M639-E667 HydrophobicContact SD-CG 4.27Å
640	V	94.8	Very high	91.7	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-69.9	-38.7	176.5	171.4	0	0	0	0	111.2	F519 Y636 E638 F643 G644 W693 I696 L697 L700	F519-V640 HydrophobicContact CD2-CG1 4.31Å; F519-V640 HydrophobicContact CE2-CG1 3.96Å; Y636-V640 WeakPolarHBondContact O-CB 3.41Å; Y636-V640 VanDerWaalsContact O-CG2 3.24Å; Y636-V640 WeakPolarHBondContact O-CG2 3.21Å; Y636-V640 PolarHBondContact O-N 2.88Å; E638-V640 PolarHBondContact O-N 3.19Å; V640-F643 WeakPolarHBondContact O-CB 3.46Å; V640-F643 PolarHBondContact O-N 3.48Å; V640-G644 PolarHBondContact O-N 3.47Å; V640-W693 HydrophobicContact CB-CE3 4.27Å; V640-W693 HydrophobicContact CB-CZ3 4.23Å; V640-W693 HydrophobicContact CG1-CE3 4.3Å; V640-W693 HydrophobicContact CG1-CZ3 4.32Å; V640-W693 HydrophobicContact CG2-CD2 4.34Å; V640-W693 HydrophobicContact CG2-CE3 3.72Å; V640-W693 HydrophobicContact CG2-CZ3 4.13Å; V640-I696 HydrophobicContact CG1-CG2 3.65Å; V640-L697 HydrophobicContact CG1-CD2 4.37Å; V640-L697 HydrophobicContact CG2-CD2 4.18Å; V640-L700 HydrophobicContact CG1-CD1 3.81Å
641	L	92.4	Very high	91.9	Very high	1 Å²	1	10 Å²	10	1%	0.005	6%	0.055	C	C	.	.	H	α-helix	trans	-65.5	-39.6	172.8	-72.5	171.4	0	0	0	111.5	F526 Y527 L637 E638 F643 G644 F645	F526-L641 HydrophobicContact CD2-CD1 3.71Å; F526-L641 HydrophobicContact CD2-CD2 4.38Å; F526-L641 HydrophobicContact CE2-CD1 3.78Å; Y527-L641 HydrophobicContact CE2-CD2 3.79Å; Y527-L641 WeakPolarHBondContact OH-CA 3.04Å; Y527-L641 PolarHBondContact OH-O 3.47Å; L637-L641 HydrophobicContact CD1-CD1 4.05Å; L637-L641 HydrophobicContact CD1-CG 4.25Å; L637-L641 HydrophobicContact CG-CD1 4.04Å; L637-L641 WeakPolarHBondContact O-CB 3.42Å; L637-L641 VanDerWaalsContact O-CG 3.25Å; L637-L641 WeakPolarHBondContact O-CG 3.42Å; L637-L641 PolarHBondContact O-N 2.86Å; E638-L641 PolarHBondContact O-N 2.84Å; L641-F643 VanDerWaalsContact C-N 3.34Å; L641-F643 PolarHBondContact O-N 3.03Å; L641-G644 PolarHBondContact O-N 2.92Å; L641-F645 HydrophobicContact CB-CE2 4.38Å; L641-F645 WeakPolarHBondContact O-CD2 3.4Å; L641-F645 WeakPolarHBondContact O-CG 3.5Å; L641-F645 PolarHBondContact O-N 3.16Å
642	Q	94	Very high	92	Very high	1 Å²	1	9 Å²	9	1%	0.005	5%	0.045	C	C	.	.	H	α-helix	trans	-59.3	-45.1	171.4	-176.7	-179.2	-60.5	0	0	111.6	E638 M639 G644 F645 I646 A660 N663 N664	E638-Q642 PolarHBondContact O-N 2.92Å; M639-Q642 WeakPolarHBondContact O-CB 3.32Å; M639-Q642 PolarHBondContact O-N 3.49Å; Q642-G644 VanDerWaalsContact C-N 3.31Å; Q642-G644 PolarHBondContact O-N 3.39Å; Q642-F645 PolarHBondContact O-N 3.07Å; Q642-I646 PolarHBondContact O-N 3.22Å; Q642-I646 VanDerWaalsContact O-N 3.11Å; Q642-A660 HydrophobicContact CG-CB 4.03Å; Q642-A660 PolarHBondContact NE2-O 2.94Å; Q642-N663 PolarHBondContact OE1-ND2 3.01Å; Q642-N663 VanDerWaalsContact OE1-ND2 3.15Å; Q642-N664 PolarHBondContact NE2-OD1 3.38Å
643	F	95	Very high	92	Very high	0 Å²	0	9 Å²	9	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-58.3	-41.5	175.7	-176.6	-90.7	0	0	0	112.1	Y281 W362 F366 M639 V640 L641 I646 T647 L697 L700 V701	Y281-F643 HydrophobicContact CD2-CD2 4.43Å; Y281-F643 AromaticContact CE2-CD2 3.75Å; Y281-F643 HydrophobicContact CE2-CD2 3.75Å; Y281-F643 HydrophobicContact CE2-CE2 4.5Å; Y281-F643 WeakPolarHBondContact OH-CA 3.4Å; W362-F643 HydrophobicContact CH2-CD2 4.34Å; W362-F643 AromaticContact CH2-CE2 3.85Å; W362-F643 HydrophobicContact CH2-CE2 3.85Å; W362-F643 HydrophobicContact CZ3-CD2 4.44Å; W362-F643 AromaticContact CZ3-CE2 3.7Å; W362-F643 HydrophobicContact CZ3-CE2 3.7Å; W362-F643 HydrophobicContact CZ3-CZ 4.33Å; F366-F643 AromaticContact CD1-CE2 3.79Å; F366-F643 HydrophobicContact CD1-CE2 3.79Å; F366-F643 HydrophobicContact CD1-CZ 4.32Å; F366-F643 HydrophobicContact CE1-CD2 4.36Å; F366-F643 AromaticContact CE1-CE2 3.81Å; F366-F643 HydrophobicContact CE1-CE2 3.81Å; M639-F643 PolarHBondContact O-N 2.86Å; V640-F643 WeakPolarHBondContact O-CB 3.46Å; V640-F643 PolarHBondContact O-N 3.48Å; L641-F643 VanDerWaalsContact C-N 3.34Å; L641-F643 PolarHBondContact O-N 3.03Å; F643-I646 HydrophobicContact CD2-CD1 4.36Å; F643-I646 WeakPolarHBondContact O-CG1 3.48Å; F643-I646 PolarHBondContact O-N 3.44Å; F643-T647 HydrophobicContact CD1-CG2 4.22Å; F643-T647 HydrophobicContact CE1-CG2 3.8Å; F643-T647 HydrophobicContact CE2-CG2 4.15Å; F643-T647 HydrophobicContact CZ-CG2 3.77Å; F643-T647 WeakPolarHBondContact O-CB 3.48Å; F643-T647 WeakPolarHBondContact O-CG2 3.47Å; F643-T647 PolarHBondContact O-N 3.06Å; F643-T647 VanDerWaalsContact O-N 3.16Å; F643-T647 PolarHBondContact O-OG1 2.81Å; F643-L697 HydrophobicContact CB-CD2 4.02Å; F643-L697 HydrophobicContact CD1-CD2 3.44Å; F643-L697 VanDerWaalsContact CD1-CD2 3.44Å; F643-L697 HydrophobicContact CD2-CD2 4.25Å; F643-L697 HydrophobicContact CE1-CD2 3.9Å; F643-L697 HydrophobicContact CG-CD2 3.63Å; F643-L697 HydrophobicContact CZ-CD2 4.48Å; F643-L700 HydrophobicContact CD1-CB 4.23Å; F643-L700 HydrophobicContact CD1-CD1 4.06Å; F643-L700 HydrophobicContact CE1-CB 4.24Å; F643-V701 HydrophobicContact CE1-CG2 3.75Å; F643-V701 HydrophobicContact CZ-CG2 3.68Å
644	G	94.4	Very high	92.1	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-66.3	-38.9	175.2	0	0	0	0	0	113.1	Y527 V640 L641 Q642 I646 T647 I648	Y527-G644 VanDerWaalsContact OH-CA 3.27Å; Y527-G644 WeakPolarHBondContact OH-CA 3.29Å; V640-G644 PolarHBondContact O-N 3.47Å; L641-G644 PolarHBondContact O-N 2.92Å; Q642-G644 VanDerWaalsContact C-N 3.31Å; Q642-G644 PolarHBondContact O-N 3.39Å; G644-I646 PolarHBondContact O-N 2.95Å; G644-T647 PolarHBondContact O-N 3.42Å; G644-T647 PolarHBondContact O-OG1 3.48Å; G644-I648 VanDerWaalsContact O-CB 3.26Å; G644-I648 WeakPolarHBondContact O-CB 3.2Å; G644-I648 WeakPolarHBondContact O-CG1 3.46Å; G644-I648 PolarHBondContact O-N 3.41Å
645	F	92.4	Very high	92.2	Very high	1 Å²	1	4.7 Å²	4.7	0%	0.004	2%	0.023	C	C	.	.	H	α-helix	trans	-61.2	-42.6	176	-71	-52.1	0	0	0	112.4	F526 Y527 I530 L571 I574 M575 L641 Q642	F526-F645 HydrophobicContact CB-CZ 4.15Å; F526-F645 HydrophobicContact CD1-CZ 4.31Å; F526-F645 HydrophobicContact CG-CZ 4.49Å; Y527-F645 AromaticContact CD1-CD1 3.96Å; Y527-F645 HydrophobicContact CD1-CD1 3.96Å; Y527-F645 AromaticContact CD1-CE1 3.67Å; Y527-F645 HydrophobicContact CD1-CE1 3.67Å; Y527-F645 AromaticContact CE1-CD1 3.35Å; Y527-F645 HydrophobicContact CE1-CD1 3.35Å; Y527-F645 AromaticContact CE1-CE1 3.34Å; Y527-F645 HydrophobicContact CE1-CE1 3.34Å; Y527-F645 HydrophobicContact CE1-CG 4.04Å; Y527-F645 HydrophobicContact CE1-CZ 4.05Å; I530-F645 HydrophobicContact CD1-CD1 3.99Å; I530-F645 HydrophobicContact CD1-CE1 3.61Å; L571-F645 HydrophobicContact CD1-CB 3.97Å; L571-F645 HydrophobicContact CD1-CD1 3.68Å; L571-F645 HydrophobicContact CD1-CG 4.13Å; I574-F645 HydrophobicContact CG2-CE1 4.09Å; I574-F645 HydrophobicContact CG2-CE2 4.38Å; I574-F645 HydrophobicContact CG2-CZ 3.71Å; M575-F645 HydrophobicContact SD-CB 4.41Å; L641-F645 HydrophobicContact CB-CE2 4.38Å; L641-F645 WeakPolarHBondContact O-CD2 3.4Å; L641-F645 WeakPolarHBondContact O-CG 3.5Å; L641-F645 PolarHBondContact O-N 3.16Å; Q642-F645 PolarHBondContact O-N 3.07Å
646	I	93.6	Very high	92.3	Very high	0 Å²	0	3.7 Å²	3.7	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-77.7	-19.6	-178.3	65.8	170.7	0	0	0	114.1	Y281 L285 W362 M575 Q642 F643 G644 V650 A656 P657 A660	Y281-I646 HydrophobicContact CE2-CD1 4.06Å; Y281-I646 WeakPolarHBondContact OH-CD1 3.39Å; L285-I646 HydrophobicContact CD2-CD1 3.55Å; W362-I646 HydrophobicContact CH2-CD1 4.01Å; W362-I646 HydrophobicContact CZ3-CD1 4.27Å; M575-I646 HydrophobicContact SD-CG2 4.43Å; Q642-I646 PolarHBondContact O-N 3.22Å; Q642-I646 VanDerWaalsContact O-N 3.11Å; F643-I646 HydrophobicContact CD2-CD1 4.36Å; F643-I646 WeakPolarHBondContact O-CG1 3.48Å; F643-I646 PolarHBondContact O-N 3.44Å; G644-I646 PolarHBondContact O-N 2.95Å; I646-V650 WeakPolarHBondContact O-CB 3.42Å; I646-V650 VanDerWaalsContact O-CG2 3.32Å; I646-V650 WeakPolarHBondContact O-CG2 3.42Å; I646-A656 HydrophobicContact CG2-CB 4.12Å; I646-P657 HydrophobicContact CB-CG 4.39Å; I646-A660 HydrophobicContact CG2-CB 3.82Å
647	T	94.1	Very high	92.4	Very high	5 Å²	5	3.2 Å²	3.2	3%	0.031	2%	0.017	C	C	.	.	H	α-helix	trans	-99.5	-48	-177.4	50.3	0	0	0	0	111.4	W362 F643 G644 F649 A704 N708	W362-T647 HydrophobicContact CZ3-CG2 4.16Å; F643-T647 HydrophobicContact CD1-CG2 4.22Å; F643-T647 HydrophobicContact CE1-CG2 3.8Å; F643-T647 HydrophobicContact CE2-CG2 4.15Å; F643-T647 HydrophobicContact CZ-CG2 3.77Å; F643-T647 WeakPolarHBondContact O-CB 3.48Å; F643-T647 WeakPolarHBondContact O-CG2 3.47Å; F643-T647 PolarHBondContact O-N 3.06Å; F643-T647 VanDerWaalsContact O-N 3.16Å; F643-T647 PolarHBondContact O-OG1 2.81Å; G644-T647 PolarHBondContact O-N 3.42Å; G644-T647 PolarHBondContact O-OG1 3.48Å; T647-F649 PolarHBondContact O-N 2.94Å; T647-A704 WeakPolarHBondContact O-CB 3.26Å; T647-N708 PolarHBondContact O-ND2 2.9Å
648	I	94.4	Very high	92.5	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-70.2	-32	-173	-62.7	173.3	0	0	0	112.6	F523 F531 G644 L700 L703 A704 S707 N708	F523-I648 HydrophobicContact CE2-CD1 4.09Å; F531-I648 HydrophobicContact CE1-CG2 3.84Å; F531-I648 HydrophobicContact CZ-CG2 4.08Å; G644-I648 VanDerWaalsContact O-CB 3.26Å; G644-I648 WeakPolarHBondContact O-CB 3.2Å; G644-I648 WeakPolarHBondContact O-CG1 3.46Å; G644-I648 PolarHBondContact O-N 3.41Å; I648-L700 HydrophobicContact CD1-CD2 3.78Å; I648-L703 HydrophobicContact CD1-CD2 3.97Å; I648-A704 HydrophobicContact CG1-CB 4.3Å; I648-S707 VanDerWaalsContact CG2-OG 3.25Å; I648-S707 WeakPolarHBondContact CG2-OG 3.45Å; I648-S707 WeakPolarHBondContact O-CB 3.26Å; I648-S707 PolarHBondContact O-OG 3.4Å; I648-N708 PolarHBondContact O-OD1 3.37Å
649	F	93.1	Very high	92.6	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.037	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.1	19.3	-171.9	-54.9	-75	0	0	0	113.3	Y527 I530 F531 A534 L567 L571 T647 A651 A652 I711	Y527-F649 AromaticContact CD1-CE2 3.61Å; Y527-F649 HydrophobicContact CD1-CE2 3.61Å; Y527-F649 HydrophobicContact CD1-CZ 4.27Å; Y527-F649 HydrophobicContact CE1-CE2 4.06Å; I530-F649 HydrophobicContact CB-CE1 4.31Å; I530-F649 HydrophobicContact CB-CE2 4.46Å; I530-F649 HydrophobicContact CB-CZ 4.02Å; I530-F649 HydrophobicContact CG2-CD1 3.7Å; I530-F649 HydrophobicContact CG2-CD2 4.14Å; I530-F649 HydrophobicContact CG2-CE1 3.4Å; I530-F649 HydrophobicContact CG2-CE2 3.87Å; I530-F649 HydrophobicContact CG2-CG 4.06Å; I530-F649 HydrophobicContact CG2-CZ 3.48Å; I530-F649 VanDerWaalsContact CG2-CZ 3.48Å; F531-F649 AromaticContact CD1-CE1 3.85Å; F531-F649 HydrophobicContact CD1-CE1 3.85Å; F531-F649 AromaticContact CD1-CZ 3.74Å; F531-F649 HydrophobicContact CD1-CZ 3.74Å; F531-F649 AromaticContact CE1-CE1 3.85Å; F531-F649 HydrophobicContact CE1-CE1 3.85Å; F531-F649 AromaticContact CE1-CZ 3.52Å; F531-F649 HydrophobicContact CE1-CZ 3.52Å; F531-F649 HydrophobicContact CG-CZ 4.45Å; F531-F649 HydrophobicContact CZ-CZ 4.04Å; A534-F649 HydrophobicContact CB-CE1 4.49Å; L567-F649 HydrophobicContact CD1-CD1 4.45Å; L571-F649 HydrophobicContact CD1-CB 4.44Å; L571-F649 HydrophobicContact CD1-CD2 4.35Å; L571-F649 HydrophobicContact CD2-CB 4.1Å; T647-F649 PolarHBondContact O-N 2.94Å; F649-A651 VanDerWaalsContact C-N 3.26Å; F649-A651 PolarHBondContact O-N 3.49Å; F649-A652 WeakPolarHBondContact O-CB 3.26Å; F649-A652 PolarHBondContact O-N 2.91Å; F649-I711 HydrophobicContact CD1-CD1 3.91Å
650	V	92.3	Very high	92.7	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.037	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-31.1	-171.8	79.7	0	0	0	0	113.4	Y355 A356 M359 I646 A652 F653 N708	Y355-V650 HydrophobicContact CD1-CG2 3.93Å; Y355-V650 HydrophobicContact CE1-CG2 3.43Å; Y355-V650 VanDerWaalsContact CE1-CG2 3.43Å; A356-V650 HydrophobicContact CB-CG1 4.49Å; M359-V650 HydrophobicContact CB-CG1 3.82Å; M359-V650 HydrophobicContact CB-CG2 4.3Å; M359-V650 HydrophobicContact CE-CG2 4.23Å; M359-V650 HydrophobicContact CG-CB 4.45Å; M359-V650 HydrophobicContact CG-CG1 4.08Å; M359-V650 HydrophobicContact CG-CG2 3.69Å; M359-V650 HydrophobicContact SD-CG2 4.46Å; I646-V650 WeakPolarHBondContact O-CB 3.42Å; I646-V650 VanDerWaalsContact O-CG2 3.32Å; I646-V650 WeakPolarHBondContact O-CG2 3.42Å; V650-A652 PolarHBondContact O-N 2.89Å; V650-F653 CarbonylContact O-C 3.59Å; V650-F653 PolarHBondContact O-N 2.82Å; V650-N708 PolarHBondContact N-OD1 3.04Å
651	A	89.4	Confident	92.7	Very high	5 Å²	5	7.7 Å²	7.7	4%	0.041	4%	0.038	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-23.1	175.5	0	0	0	0	0	113	A356 F649 N708 I711 I712	A356-A651 HydrophobicContact CB-CB 4.26Å; F649-A651 VanDerWaalsContact C-N 3.26Å; F649-A651 PolarHBondContact O-N 3.49Å; A651-N708 HydrophobicContact CB-CB 4.44Å; A651-N708 PolarHBondContact N-OD1 3.38Å; A651-I711 HydrophobicContact CB-CB 4.41Å; A651-I711 HydrophobicContact CB-CG2 3.94Å; A651-I712 HydrophobicContact CB-CD1 4.29Å; A651-I712 HydrophobicContact CB-CG1 3.94Å
652	A	88.4	Confident	92.7	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-26	178.6	0	0	0	0	0	113.3	L564 L567 F649 V650	L564-A652 HydrophobicContact CD1-CB 3.82Å; L564-A652 HydrophobicContact CG-CB 4.42Å; L567-A652 HydrophobicContact CD2-CB 3.59Å; L567-A652 HydrophobicContact CG-CB 4.01Å; F649-A652 WeakPolarHBondContact O-CB 3.26Å; F649-A652 PolarHBondContact O-N 2.91Å; V650-A652 PolarHBondContact O-N 2.89Å
653	F	89	Confident	92.7	Very high	8 Å²	8	12 Å²	12	4%	0.035	6%	0.061	C	C	.	.			trans	-146.7	90.6	-176	-173.1	-131	0	0	0	112.3	F347 A568 L571 L572 M575 V650 L655 A656 F659	F347-F653 AromaticContact CD1-CD2 3.95Å; F347-F653 HydrophobicContact CD1-CD2 3.95Å; F347-F653 AromaticContact CE1-CD2 3.53Å; F347-F653 HydrophobicContact CE1-CD2 3.53Å; F347-F653 AromaticContact CE1-CE2 3.66Å; F347-F653 HydrophobicContact CE1-CE2 3.66Å; F347-F653 HydrophobicContact CZ-CD2 4.2Å; F347-F653 HydrophobicContact CZ-CE2 4.13Å; A568-F653 HydrophobicContact CB-CB 4.48Å; L571-F653 HydrophobicContact CD2-CB 3.88Å; L571-F653 HydrophobicContact CD2-CD1 4.2Å; L572-F653 HydrophobicContact CD1-CE1 4.15Å; L572-F653 HydrophobicContact CD1-CZ 4.01Å; M575-F653 HydrophobicContact CE-CE1 4.26Å; V650-F653 CarbonylContact O-C 3.59Å; V650-F653 PolarHBondContact O-N 2.82Å; F653-L655 HydrophobicContact CD2-CB 4.36Å; F653-L655 HydrophobicContact CE1-CB 4.16Å; F653-L655 HydrophobicContact CE2-CB 3.77Å; F653-L655 HydrophobicContact CE2-CD1 4.27Å; F653-L655 HydrophobicContact CE2-CG 4.45Å; F653-L655 HydrophobicContact CZ-CB 3.67Å; F653-L655 PolarHBondContact O-N 2.81Å; F653-L655 VanDerWaalsContact O-N 3.16Å; F653-A656 HydrophobicContact CD1-CB 3.62Å; F653-A656 HydrophobicContact CE1-CB 4.27Å; F653-A656 HydrophobicContact CG-CB 4.47Å; F653-A656 WeakPolarHBondContact O-CB 3.36Å; F653-A656 PolarHBondContact O-N 3.23Å; F653-A656 VanDerWaalsContact O-N 3.11Å; F653-F659 AromaticContact CE1-CD2 3.72Å; F653-F659 HydrophobicContact CE1-CD2 3.72Å; F653-F659 AromaticContact CE1-CE2 3.82Å; F653-F659 HydrophobicContact CE1-CE2 3.82Å; F653-F659 AromaticContact CZ-CD2 3.89Å; F653-F659 HydrophobicContact CZ-CD2 3.89Å; F653-F659 AromaticContact CZ-CE2 3.47Å; F653-F659 HydrophobicContact CZ-CE2 3.47Å; F653-F659 VanDerWaalsContact CZ-CE2 3.47Å
654	P	89.6	Confident	92.6	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-25.2	-177.1	-26.9	36.3	0	0	0	115	V295 Y355 A656 P657	V295-P654 HydrophobicContact CG1-CB 4.29Å; V295-P654 HydrophobicContact CG1-CG 4.34Å; Y355-P654 HydrophobicContact CD1-CB 3.8Å; Y355-P654 HydrophobicContact CD1-CG 4.35Å; Y355-P654 HydrophobicContact CE1-CB 3.83Å; Y355-P654 WeakPolarHBondContact CE1-O 3.31Å; Y355-P654 PolarHBondContact OH-O 2.76Å; Y355-P654 VanDerWaalsContact OH-O 3.09Å; P654-A656 VanDerWaalsContact C-N 3.28Å; P654-A656 PolarHBondContact O-N 3.4Å; P654-P657 WeakPolarHBondContact O-CD 3.1Å
655	L	91.1	Very high	92.4	Very high	23 Å²	23	16.5 Å²	16.5	12%	0.12	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-4.3	179.2	-66.5	176.4	0	0	0	113.7	I293 F296 F653 L658 F659	I293-L655 HydrophobicContact CG1-CD2 4.38Å; F296-L655 HydrophobicContact CB-CD2 3.84Å; F296-L655 HydrophobicContact CB-CG 4.2Å; F296-L655 HydrophobicContact CD1-CD1 4.06Å; F296-L655 HydrophobicContact CD1-CD2 4.22Å; F296-L655 HydrophobicContact CD1-CG 4.47Å; F296-L655 HydrophobicContact CD2-CD1 3.69Å; F296-L655 HydrophobicContact CD2-CD2 4.39Å; F296-L655 HydrophobicContact CD2-CG 3.91Å; F296-L655 HydrophobicContact CE1-CD1 4.06Å; F296-L655 HydrophobicContact CE2-CD1 3.7Å; F296-L655 HydrophobicContact CE2-CG 4.41Å; F296-L655 HydrophobicContact CG-CD1 3.87Å; F296-L655 HydrophobicContact CG-CD2 3.9Å; F296-L655 HydrophobicContact CG-CG 3.94Å; F296-L655 HydrophobicContact CZ-CD1 3.89Å; F653-L655 HydrophobicContact CD2-CB 4.36Å; F653-L655 HydrophobicContact CE1-CB 4.16Å; F653-L655 HydrophobicContact CE2-CB 3.77Å; F653-L655 HydrophobicContact CE2-CD1 4.27Å; F653-L655 HydrophobicContact CE2-CG 4.45Å; F653-L655 HydrophobicContact CZ-CB 3.67Å; F653-L655 PolarHBondContact O-N 2.81Å; F653-L655 VanDerWaalsContact O-N 3.16Å; L655-L658 HydrophobicContact CD2-CD2 4.43Å; L655-L658 WeakPolarHBondContact O-CB 3.36Å; L655-L658 PolarHBondContact O-N 2.82Å; L655-F659 HydrophobicContact CB-CD2 4.46Å; L655-F659 HydrophobicContact CB-CE2 4.06Å; L655-F659 VanDerWaalsContact O-CD2 3.31Å; L655-F659 WeakPolarHBondContact O-CD2 3.27Å; L655-F659 PolarHBondContact O-N 3.28Å
656	A	92.7	Very high	92.4	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-54.1	-44.6	-178.2	0	0	0	0	0	113.2	M575 I646 F653 P654 L658 F659 A660	M575-A656 HydrophobicContact CE-CB 4.26Å; M575-A656 HydrophobicContact SD-CB 4.26Å; I646-A656 HydrophobicContact CG2-CB 4.12Å; F653-A656 HydrophobicContact CD1-CB 3.62Å; F653-A656 HydrophobicContact CE1-CB 4.27Å; F653-A656 HydrophobicContact CG-CB 4.47Å; F653-A656 WeakPolarHBondContact O-CB 3.36Å; F653-A656 PolarHBondContact O-N 3.23Å; F653-A656 VanDerWaalsContact O-N 3.11Å; P654-A656 VanDerWaalsContact C-N 3.28Å; P654-A656 PolarHBondContact O-N 3.4Å; A656-L658 VanDerWaalsContact C-N 3.25Å; A656-L658 PolarHBondContact O-N 3.45Å; A656-F659 PolarHBondContact O-N 3.05Å; A656-A660 PolarHBondContact O-N 3Å
657	P	94.4	Very high	92.4	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-64.2	-24.9	178.4	-28.6	42.3	0	0	0	114.5	L285 A288 Y355 M359 I646 P654 L661	L285-P657 HydrophobicContact CD2-CB 4.25Å; A288-P657 HydrophobicContact CB-CB 3.9Å; A288-P657 HydrophobicContact CB-CG 4.3Å; Y355-P657 VanDerWaalsContact OH-CG 3.29Å; Y355-P657 WeakPolarHBondContact OH-CG 3.48Å; M359-P657 HydrophobicContact CE-CG 4.04Å; M359-P657 HydrophobicContact SD-CG 4.42Å; I646-P657 HydrophobicContact CB-CG 4.39Å; P654-P657 WeakPolarHBondContact O-CD 3.1Å; P657-L661 VanDerWaalsContact O-CB 3.31Å; P657-L661 WeakPolarHBondContact O-CB 3.33Å; P657-L661 PolarHBondContact O-N 3.37Å
658	L	94.1	Very high	92.3	Very high	46 Å²	46	20 Å²	20	24%	0.241	10%	0.095	C	C	.	.	H	α-helix	trans	-68.5	-46.6	174.7	176.7	61.9	0	0	0	111.3	A289 I293 L655 A656 A660 L661 L662	A289-L658 HydrophobicContact CB-CB 4.25Å; A289-L658 HydrophobicContact CB-CD1 4.37Å; I293-L658 HydrophobicContact CD1-CD1 4.06Å; I293-L658 HydrophobicContact CD1-CD2 4.08Å; I293-L658 HydrophobicContact CG1-CD2 4.11Å; L655-L658 HydrophobicContact CD2-CD2 4.43Å; L655-L658 WeakPolarHBondContact O-CB 3.36Å; L655-L658 PolarHBondContact O-N 2.82Å; A656-L658 VanDerWaalsContact C-N 3.25Å; A656-L658 PolarHBondContact O-N 3.45Å; L658-A660 VanDerWaalsContact C-N 3.32Å; L658-A660 PolarHBondContact O-N 3.01Å; L658-L661 WeakPolarHBondContact O-CB 2.98Å; L658-L661 PolarHBondContact O-N 3.04Å; L658-L662 HydrophobicContact CG-CD1 4.47Å; L658-L662 WeakPolarHBondContact O-CG 3.47Å; L658-L662 PolarHBondContact O-N 3.43Å
659	F	93.2	Very high	92.2	Very high	66 Å²	66	20.4 Å²	20.4	29%	0.289	10%	0.097	S	C	.	.	H	α-helix	trans	-64.2	-40.2	176.5	-68.8	-74.4	0	0	0	111.5	L572 M575 V576 F653 L655 A656 L661 L662 N663	L572-F659 HydrophobicContact CD1-CD2 4.48Å; L572-F659 HydrophobicContact CD1-CE2 4.19Å; L572-F659 HydrophobicContact CD1-CZ 4.25Å; M575-F659 HydrophobicContact CE-CB 3.63Å; M575-F659 HydrophobicContact CE-CD2 4.24Å; M575-F659 HydrophobicContact CE-CG 4.2Å; V576-F659 HydrophobicContact CG2-CB 4.31Å; V576-F659 HydrophobicContact CG2-CD1 4.01Å; V576-F659 HydrophobicContact CG2-CG 4.13Å; F653-F659 AromaticContact CE1-CD2 3.72Å; F653-F659 HydrophobicContact CE1-CD2 3.72Å; F653-F659 AromaticContact CE1-CE2 3.82Å; F653-F659 HydrophobicContact CE1-CE2 3.82Å; F653-F659 AromaticContact CZ-CD2 3.89Å; F653-F659 HydrophobicContact CZ-CD2 3.89Å; F653-F659 AromaticContact CZ-CE2 3.47Å; F653-F659 HydrophobicContact CZ-CE2 3.47Å; F653-F659 VanDerWaalsContact CZ-CE2 3.47Å; L655-F659 HydrophobicContact CB-CD2 4.46Å; L655-F659 HydrophobicContact CB-CE2 4.06Å; L655-F659 VanDerWaalsContact O-CD2 3.31Å; L655-F659 WeakPolarHBondContact O-CD2 3.27Å; L655-F659 PolarHBondContact O-N 3.28Å; A656-F659 PolarHBondContact O-N 3.05Å; F659-L661 PolarHBondContact O-N 3.43Å; F659-L662 PolarHBondContact O-N 3.34Å; F659-N663 WeakPolarHBondContact O-CB 3.04Å; F659-N663 PolarHBondContact O-N 2.9Å
660	A	94.6	Very high	92.2	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-59.8	-42.7	172.5	0	0	0	0	0	112.6	L285 Q642 I646 A656 L658 N663 N664	L285-A660 HydrophobicContact CD1-CB 4.05Å; L285-A660 HydrophobicContact CD2-CB 4.28Å; Q642-A660 HydrophobicContact CG-CB 4.03Å; Q642-A660 PolarHBondContact NE2-O 2.94Å; I646-A660 HydrophobicContact CG2-CB 3.82Å; A656-A660 PolarHBondContact O-N 3Å; L658-A660 VanDerWaalsContact C-N 3.32Å; L658-A660 PolarHBondContact O-N 3.01Å; A660-N663 PolarHBondContact O-N 3.32Å; A660-N664 WeakPolarHBondContact O-CB 3.12Å; A660-N664 PolarHBondContact O-N 2.91Å; A660-N664 PolarHBondContact O-OD1 3.47Å
661	L	94.6	Very high	92.2	Very high	5 Å²	5	21.2 Å²	21.2	3%	0.026	10%	0.101	C	C	.	.	H	α-helix	trans	-62.7	-46.5	177.2	178.9	68.2	0	0	0	111.6	T282 L285 L286 A289 P657 L658 F659 N663 N664 W665	T282-L661 HydrophobicContact CG2-CD1 3.86Å; T282-L661 VanDerWaalsContact O-CD1 3.28Å; T282-L661 WeakPolarHBondContact O-CD1 3.23Å; L285-L661 HydrophobicContact CB-CB 4.21Å; L285-L661 HydrophobicContact CB-CD1 3.93Å; L286-L661 HydrophobicContact CD1-CD2 4.03Å; A289-L661 HydrophobicContact CB-CD2 4.03Å; P657-L661 VanDerWaalsContact O-CB 3.31Å; P657-L661 WeakPolarHBondContact O-CB 3.33Å; P657-L661 PolarHBondContact O-N 3.37Å; L658-L661 WeakPolarHBondContact O-CB 2.98Å; L658-L661 PolarHBondContact O-N 3.04Å; F659-L661 PolarHBondContact O-N 3.43Å; L661-N663 VanDerWaalsContact C-N 3.35Å; L661-N664 PolarHBondContact O-N 3.37Å; L661-W665 HydrophobicContact CD1-CZ2 4.3Å; L661-W665 HydrophobicContact CD2-CH2 3.98Å; L661-W665 HydrophobicContact CD2-CZ2 4.32Å; L661-W665 HydrophobicContact CD2-CZ3 4.29Å; L661-W665 HydrophobicContact CG-CD2 4.49Å; L661-W665 HydrophobicContact CG-CE3 4.41Å; L661-W665 HydrophobicContact CG-CH2 4.24Å; L661-W665 HydrophobicContact CG-CZ2 4.32Å; L661-W665 HydrophobicContact CG-CZ3 4.28Å; L661-W665 PolarHBondContact O-N 3.27Å; L661-W665 VanDerWaalsContact O-N 3.09Å
662	L	93	Very high	92.4	Very high	81 Å²	81	21 Å²	21	42%	0.424	10%	0.099	S	C	.	.	H	α-helix	trans	-62.7	-42.7	177.8	-68.7	173.6	0	0	0	111.4	L658 F659 W665 I666	L658-L662 HydrophobicContact CG-CD1 4.47Å; L658-L662 WeakPolarHBondContact O-CG 3.47Å; L658-L662 PolarHBondContact O-N 3.43Å; F659-L662 PolarHBondContact O-N 3.34Å; L662-W665 HydrophobicContact CD2-CE3 4.01Å; L662-W665 HydrophobicContact CD2-CZ3 4Å; L662-W665 PolarHBondContact O-N 3.01Å; L662-I666 PolarHBondContact O-N 3.03Å
663	N	93	Very high	92.5	Very high	11 Å²	11	23.9 Å²	23.9	6%	0.059	11%	0.112	C	C	.	.	H	α-helix	trans	-61	-50.5	175.7	-169.8	58.5	0	0	0	110.9	Q579 N583 Q642 F659 A660 L661 W665 I666 E667	Q579-N663 WeakPolarHBondContact CG-ND2 3.46Å; N583-N663 PolarHBondContact ND2-OD1 2.88Å; Q642-N663 PolarHBondContact OE1-ND2 3.01Å; Q642-N663 VanDerWaalsContact OE1-ND2 3.15Å; F659-N663 WeakPolarHBondContact O-CB 3.04Å; F659-N663 PolarHBondContact O-N 2.9Å; A660-N663 PolarHBondContact O-N 3.32Å; L661-N663 VanDerWaalsContact C-N 3.35Å; N663-W665 VanDerWaalsContact C-N 3.27Å; N663-W665 PolarHBondContact O-N 3.46Å; N663-I666 WeakPolarHBondContact O-CA 3.41Å; N663-I666 WeakPolarHBondContact O-CB 3.43Å; N663-I666 PolarHBondContact O-N 3.31Å; N663-E667 WeakPolarHBondContact O-CB 3.23Å; N663-E667 PolarHBondContact O-N 2.88Å
664	N	93.4	Very high	92.6	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.2	-32	-178.8	-78.5	22.2	0	0	0	114	Y281 T282 L285 Q642 A660 L661 I666 E667 I668	Y281-N664 WeakPolarHBondContact CD1-ND2 3.38Å; Y281-N664 VanDerWaalsContact CE1-ND2 3.31Å; Y281-N664 WeakPolarHBondContact CE1-ND2 3.33Å; T282-N664 HydrophobicContact CG2-CB 3.94Å; T282-N664 VanDerWaalsContact OG1-CB 3.26Å; T282-N664 WeakPolarHBondContact OG1-CB 3.39Å; T282-N664 PolarHBondContact OG1-ND2 2.81Å; L285-N664 WeakPolarHBondContact CD1-ND2 3.36Å; Q642-N664 PolarHBondContact NE2-OD1 3.38Å; A660-N664 WeakPolarHBondContact O-CB 3.12Å; A660-N664 PolarHBondContact O-N 2.91Å; A660-N664 PolarHBondContact O-OD1 3.47Å; L661-N664 PolarHBondContact O-N 3.37Å; N664-I666 VanDerWaalsContact C-N 3.31Å; N664-E667 PolarHBondContact O-N 2.93Å; N664-I668 VanDerWaalsContact O-CG1 3.28Å; N664-I668 WeakPolarHBondContact O-CG1 3.26Å; N664-I668 PolarHBondContact O-N 3.19Å
665	W	91.2	Very high	92.8	Very high	96 Å²	96	25.9 Å²	25.9	36%	0.364	12%	0.121	S	C	.	.	H	α-helix	trans	-65.4	-37	174.6	-86.5	-29.3	0	0	0	112.6	T282 L661 L662 N663	T282-W665 HydrophobicContact CG2-CG 4.48Å; L661-W665 HydrophobicContact CD1-CZ2 4.3Å; L661-W665 HydrophobicContact CD2-CH2 3.98Å; L661-W665 HydrophobicContact CD2-CZ2 4.32Å; L661-W665 HydrophobicContact CD2-CZ3 4.29Å; L661-W665 HydrophobicContact CG-CD2 4.49Å; L661-W665 HydrophobicContact CG-CE3 4.41Å; L661-W665 HydrophobicContact CG-CH2 4.24Å; L661-W665 HydrophobicContact CG-CZ2 4.32Å; L661-W665 HydrophobicContact CG-CZ3 4.28Å; L661-W665 PolarHBondContact O-N 3.27Å; L661-W665 VanDerWaalsContact O-N 3.09Å; L662-W665 HydrophobicContact CD2-CE3 4.01Å; L662-W665 HydrophobicContact CD2-CZ3 4Å; L662-W665 PolarHBondContact O-N 3.01Å; N663-W665 VanDerWaalsContact C-N 3.27Å; N663-W665 PolarHBondContact O-N 3.46Å
666	I	91.7	Very high	92.8	Very high	69 Å²	69	24.8 Å²	24.8	35%	0.354	12%	0.115	S	C	.	.	H	α-helix	trans	-71.1	-48.3	174.1	-64.8	172.6	0	0	0	108.9	W251 L662 N663 N664 I668 R669 L670	W251-I666 HydrophobicContact CH2-CG2 4.11Å; W251-I666 HydrophobicContact CZ3-CG2 4.35Å; L662-I666 PolarHBondContact O-N 3.03Å; N663-I666 WeakPolarHBondContact O-CA 3.41Å; N663-I666 WeakPolarHBondContact O-CB 3.43Å; N663-I666 PolarHBondContact O-N 3.31Å; N664-I666 VanDerWaalsContact C-N 3.31Å; I666-I668 PolarHBondContact O-N 3.26Å; I666-R669 PolarHBondContact O-N 3.18Å; I666-L670 HydrophobicContact CG2-CD1 3.51Å; I666-L670 HydrophobicContact CG2-CG 3.84Å; I666-L670 PolarHBondContact O-N 2.87Å
667	E	92.5	Very high	92.6	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-54.7	-52.2	-176.4	-163.8	75.3	166.9	0	0	113.1	N583 M639 N663 N664 R669 L670 D671	N583-E667 PolarHBondContact OD1-OE2 3.48Å; N583-E667 VanDerWaalsContact OD1-OE2 3.1Å; M639-E667 HydrophobicContact CE-CB 4.4Å; M639-E667 HydrophobicContact CE-CG 3.54Å; M639-E667 VanDerWaalsContact CE-OE1 3.28Å; M639-E667 WeakPolarHBondContact CE-OE1 3.38Å; M639-E667 HydrophobicContact SD-CG 4.27Å; N663-E667 WeakPolarHBondContact O-CB 3.23Å; N663-E667 PolarHBondContact O-N 2.88Å; N664-E667 PolarHBondContact O-N 2.93Å; E667-R669 PolarHBondContact O-N 3.39Å; E667-L670 PolarHBondContact O-N 3.05Å; E667-D671 WeakPolarHBondContact O-CB 3.2Å; E667-D671 PolarHBondContact O-N 3.26Å
668	I	92.7	Very high	92.3	Very high	10 Å²	10	27 Å²	27	5%	0.051	13%	0.127	C	C	.	.	H	α-helix	trans	-51.8	-35.3	-179.9	-73.2	166.9	0	0	0	111.2	Q258 L278 T282 N664 I666 A672	Q258-I668 HydrophobicContact CG-CG2 4.36Å; L278-I668 HydrophobicContact CD2-CB 4.36Å; L278-I668 HydrophobicContact CD2-CG1 3.43Å; L278-I668 VanDerWaalsContact CD2-CG1 3.43Å; L278-I668 HydrophobicContact CG-CD1 4.17Å; L278-I668 HydrophobicContact CG-CG1 3.56Å; T282-I668 HydrophobicContact CG2-CD1 4.23Å; T282-I668 WeakPolarHBondContact OG1-CD1 3.35Å; N664-I668 VanDerWaalsContact O-CG1 3.28Å; N664-I668 WeakPolarHBondContact O-CG1 3.26Å; N664-I668 PolarHBondContact O-N 3.19Å; I666-I668 PolarHBondContact O-N 3.26Å; I668-A672 WeakPolarHBondContact O-CB 3.32Å; I668-A672 PolarHBondContact O-N 3.44Å
669	R	92.6	Very high	92.2	Very high	8 Å²	8	25.3 Å²	25.3	3%	0.03	12%	0.119	C	C	.	.	H	α-helix	trans	-89.1	-34.3	-177.3	-54.5	-57.4	170.3	172.1	-0.6	112.3	W248 W251 C253 W254 R256 I666 E667 K673	W248-R669 PolarHBondContact O-NH1 3.24Å; W251-R669 HydrophobicContact CE3-CB 4.45Å; W251-R669 HydrophobicContact CZ3-CB 4.48Å; C253-R669 PolarHBondContact O-NH1 3.4Å; C253-R669 PolarHBondContact O-NH2 3.18Å; W254-R669 PolarHBondContact O-NH2 3.27Å; R256-R669 PolarHBondContact O-NH2 2.93Å; R256-R669 VanDerWaalsContact O-NH2 3.11Å; I666-R669 PolarHBondContact O-N 3.18Å; E667-R669 PolarHBondContact O-N 3.39Å; R669-K673 VanDerWaalsContact O-CB 3.27Å; R669-K673 WeakPolarHBondContact O-CB 3.41Å; R669-K673 PolarHBondContact O-N 3.42Å
670	L	92	Very high	92.1	Very high	12 Å²	12	23.4 Å²	23.4	6%	0.063	11%	0.11	C	C	.	.	H	α-helix	trans	-62.1	-50.8	172.3	-73.2	-177	0	0	0	110.6	W251 N583 I587 I666 E667 A672 K673 K674	W251-L670 HydrophobicContact CH2-CD2 3.63Å; W251-L670 HydrophobicContact CH2-CG 4Å; W251-L670 HydrophobicContact CZ2-CD2 3.51Å; W251-L670 HydrophobicContact CZ2-CG 4.35Å; N583-L670 HydrophobicContact CB-CD1 3.93Å; I587-L670 HydrophobicContact CD1-CD1 4.29Å; I587-L670 HydrophobicContact CD1-CD2 3.82Å; I587-L670 HydrophobicContact CG1-CD1 4.44Å; I587-L670 HydrophobicContact CG1-CD2 3.73Å; I666-L670 HydrophobicContact CG2-CD1 3.51Å; I666-L670 HydrophobicContact CG2-CG 3.84Å; I666-L670 PolarHBondContact O-N 2.87Å; E667-L670 PolarHBondContact O-N 3.05Å; L670-A672 PolarHBondContact O-N 3.01Å; L670-K673 PolarHBondContact O-N 3.08Å; L670-K674 WeakPolarHBondContact O-CB 3.33Å; L670-K674 PolarHBondContact O-N 3.13Å
671	D	92.4	Very high	92	Very high	5 Å²	5	23.9 Å²	23.9	3%	0.027	11%	0.111	C	C	.	.	H	α-helix	trans	-60.1	-45.7	176.9	-77.9	-26.3	0	0	0	112.5	Y274 F275 E667 K673 K674 L675	Y274-D671 HydrophobicContact CE1-CB 4.45Å; Y274-D671 WeakPolarHBondContact CE1-OD2 3.34Å; Y274-D671 PolarHBondContact OH-OD2 3.28Å; F275-D671 HydrophobicContact CE1-CB 3.81Å; F275-D671 HydrophobicContact CZ-CB 3.75Å; E667-D671 WeakPolarHBondContact O-CB 3.2Å; E667-D671 PolarHBondContact O-N 3.26Å; D671-K673 VanDerWaalsContact C-N 3.29Å; D671-K673 PolarHBondContact O-N 3.19Å; D671-K674 PolarHBondContact O-N 3.07Å; D671-L675 WeakPolarHBondContact O-CB 3.24Å; D671-L675 WeakPolarHBondContact O-CG 3.44Å; D671-L675 PolarHBondContact O-N 3.23Å
672	A	93.4	Very high	91.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-59.3	-42.8	177.5	0	0	0	0	0	111.4	W248 A249 I668 L670 V676	W248-A672 HydrophobicContact CD2-CB 3.68Å; W248-A672 VanDerWaalsContact CE2-CB 3.47Å; W248-A672 HydrophobicContact CE3-CB 3.82Å; W248-A672 HydrophobicContact CG-CB 4.43Å; W248-A672 HydrophobicContact CH2-CB 3.65Å; W248-A672 HydrophobicContact CZ2-CB 3.5Å; W248-A672 VanDerWaalsContact CZ2-CB 3.5Å; W248-A672 HydrophobicContact CZ3-CB 3.79Å; A249-A672 HydrophobicContact CB-CB 4.12Å; I668-A672 WeakPolarHBondContact O-CB 3.32Å; I668-A672 PolarHBondContact O-N 3.44Å; L670-A672 PolarHBondContact O-N 3.01Å; A672-V676 WeakPolarHBondContact O-CB 3.45Å; A672-V676 VanDerWaalsContact O-CG2 3.24Å; A672-V676 WeakPolarHBondContact O-CG2 3.49Å; A672-V676 PolarHBondContact O-N 3.2Å; A672-V676 VanDerWaalsContact O-N 3.08Å
673	K	91.9	Very high	91.9	Very high	62 Å²	62	21.7 Å²	21.7	27%	0.27	10%	0.1	S	C	.	.	H	α-helix	trans	-70.5	-41.6	178.8	-176.2	174.7	177.1	173.9	0	112.2	A249 R669 L670 D671 L675 V676 C677	A249-K673 HydrophobicContact CB-CB 4.49Å; R669-K673 VanDerWaalsContact O-CB 3.27Å; R669-K673 WeakPolarHBondContact O-CB 3.41Å; R669-K673 PolarHBondContact O-N 3.42Å; L670-K673 PolarHBondContact O-N 3.08Å; D671-K673 VanDerWaalsContact C-N 3.29Å; D671-K673 PolarHBondContact O-N 3.19Å; K673-L675 VanDerWaalsContact C-N 3.33Å; K673-L675 PolarHBondContact O-N 3.29Å; K673-V676 PolarHBondContact O-N 3.01Å; K673-C677 HydrophobicContact CG-CB 4.46Å; K673-C677 VanDerWaalsContact O-CB 3.32Å; K673-C677 WeakPolarHBondContact O-CB 3.38Å; K673-C677 PolarHBondContact O-N 2.82Å
674	K	91.4	Very high	91.8	Very high	40 Å²	40	21.5 Å²	21.5	17%	0.174	10%	0.1	C	C	.	.	I	π-helix	trans	-53.7	-51.2	174.4	179.3	-175	179.5	-173.7	0	109.9	E586 E635 L670 D671 E678 T679	E586-K674 IonicContact OE1-NZ 3.78Å; E586-K674 PolarHBondContact OE1-NZ 3.48Å; E635-K674 IonicContact OE1-NZ 2.78Å; E635-K674 PolarHBondContact OE1-NZ 3.41Å; L670-K674 WeakPolarHBondContact O-CB 3.33Å; L670-K674 PolarHBondContact O-N 3.13Å; D671-K674 PolarHBondContact O-N 3.07Å; K674-E678 PolarHBondContact O-N 2.68Å; K674-T679 HydrophobicContact CG-CG2 4.05Å; K674-T679 PolarHBondContact O-N 3.4Å; K674-T679 PolarHBondContact O-OG1 3.19Å
675	L	91.9	Very high	91.6	Very high	10 Å²	10	25.1 Å²	25.1	5%	0.052	12%	0.117	C	C	.	.	I	π-helix	trans	-67.1	-38.8	-179.3	-71.4	173.8	0	0	0	114.6	F267 I271 F275 Y629 D671 K673 T679	F267-L675 HydrophobicContact CE1-CB 4.45Å; F267-L675 HydrophobicContact CE2-CB 4.43Å; F267-L675 HydrophobicContact CZ-CB 4.01Å; I271-L675 HydrophobicContact CG2-CD1 4.06Å; F275-L675 HydrophobicContact CE2-CD1 3.51Å; F275-L675 HydrophobicContact CZ-CD1 3.77Å; Y629-L675 HydrophobicContact CD2-CD2 3.92Å; Y629-L675 HydrophobicContact CE2-CD2 3.82Å; D671-L675 WeakPolarHBondContact O-CB 3.24Å; D671-L675 WeakPolarHBondContact O-CG 3.44Å; D671-L675 PolarHBondContact O-N 3.23Å; K673-L675 VanDerWaalsContact C-N 3.33Å; K673-L675 PolarHBondContact O-N 3.29Å; L675-T679 VanDerWaalsContact CA-OG1 3.31Å; L675-T679 WeakPolarHBondContact CA-OG1 3.32Å; L675-T679 PolarHBondContact O-OG1 3.45Å
676	V	92.2	Very high	91.5	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.106	C	C	.	.	I	π-helix	trans	-81.7	-37.8	-176.4	174.3	0	0	0	0	112.3	R241 L244 Y245 W248 A249 F267 A672 K673	R241-V676 HydrophobicContact CG-CG1 4.05Å; R241-V676 VanDerWaalsContact CZ-O 3.31Å; R241-V676 PolarHBondContact NE-O 2.78Å; R241-V676 PolarHBondContact NH2-O 2.92Å; L244-V676 HydrophobicContact CB-CG2 4.17Å; Y245-V676 HydrophobicContact CD2-CG1 4.25Å; W248-V676 HydrophobicContact CE3-CG2 4.3Å; W248-V676 HydrophobicContact CZ3-CG2 4.02Å; A249-V676 HydrophobicContact CB-CB 4.4Å; A249-V676 HydrophobicContact CB-CG2 4.32Å; F267-V676 HydrophobicContact CE2-CG2 4.17Å; F267-V676 HydrophobicContact CZ-CG2 4.02Å; A672-V676 WeakPolarHBondContact O-CB 3.45Å; A672-V676 VanDerWaalsContact O-CG2 3.24Å; A672-V676 WeakPolarHBondContact O-CG2 3.49Å; A672-V676 PolarHBondContact O-N 3.2Å; A672-V676 VanDerWaalsContact O-N 3.08Å; K673-V676 PolarHBondContact O-N 3.01Å
677	C	89.4	Confident	91.5	Very high	13 Å²	13	19.8 Å²	19.8	9%	0.088	10%	0.096	C	C	.	.	I	π-helix	trans	-109.1	-36.3	-168.7	-61.4	0	0	0	0	114.7	Y245 L626 K673	Y245-C677 VanDerWaalsContact CD2-SG 3.59Å; Y245-C677 VanDerWaalsContact CE2-SG 3.56Å; L626-C677 WeakPolarHBondContact CD2-O 3.48Å; K673-C677 HydrophobicContact CG-CB 4.46Å; K673-C677 VanDerWaalsContact O-CB 3.32Å; K673-C677 WeakPolarHBondContact O-CB 3.38Å; K673-C677 PolarHBondContact O-N 2.82Å
678	E	87.9	Confident	91.5	Very high	34 Å²	34	21.2 Å²	21.2	16%	0.159	10%	0.102	C	C	.	.	I	π-helix	trans	-109.6	-26.9	-163	-59.3	-172.7	168.8	0	0	113.6	P590 I627 K674	P590-E678 HydrophobicContact CB-CB 4.35Å; P590-E678 WeakPolarHBondContact CB-OE2 3.39Å; I627-E678 PolarHBondContact N-O 2.56Å; I627-E678 VanDerWaalsContact N-O 3.11Å; K674-E678 PolarHBondContact O-N 2.68Å
679	T	90.2	Very high	91.5	Very high	10 Å²	10	23.2 Å²	23.2	6%	0.061	11%	0.113	C	C	.	.	B	Isolated β-bridge	trans	-98	153.1	177.3	61.6	0	0	0	0	112.3	H221 I627 K674 L675	H221-T679 PolarHBondContact NE2-O 2.93Å; I627-T679 CarbonylContact O-C 3.43Å; I627-T679 WeakPolarHBondContact O-CA 3.23Å; K674-T679 HydrophobicContact CG-CG2 4.05Å; K674-T679 PolarHBondContact O-N 3.4Å; K674-T679 PolarHBondContact O-OG1 3.19Å; L675-T679 VanDerWaalsContact CA-OG1 3.31Å; L675-T679 WeakPolarHBondContact CA-OG1 3.32Å; L675-T679 PolarHBondContact O-OG1 3.45Å
680	R	91.4	Very high	91.5	Very high	26 Å²	26	23.3 Å²	23.3	10%	0.098	11%	0.114	C	C	.	.	P	Polyproline II helix	trans	-61.3	155	164	-64.9	175.9	-171	166.8	-1.9	110.4	D623 Y624 L626 I627 P682	D623-R680 WeakPolarHBondContact O-CG 3.46Å; Y624-R680 PolarHBondContact O-NH2 3.16Å; L626-R680 HydrophobicContact CB-CG 3.84Å; L626-R680 PolarHBondContact O-NE 2.81Å; L626-R680 PolarHBondContact O-NH2 3.15Å; I627-R680 PolarHBondContact O-N 2.53Å; R680-P682 WeakPolarHBondContact O-CD 3.38Å; R680-P682 VanDerWaalsContact O-N 3.15Å
681	R	93.6	Very high	91.4	Very high	10 Å²	10	23.6 Å²	23.6	4%	0.038	12%	0.12	C	C	.	.	B	Isolated β-bridge	trans	-58.9	119.4	178.9	-170	177.2	-176.2	163.9	4.1	109.9	H183 I220 H221 E222 Y266	H183-R681 PolarHBondContact CE1-NH1 3.21Å; H183-R681 VanDerWaalsContact CE1-NH1 3.28Å; I220-R681 WeakPolarHBondContact O-CD 3.09Å; I220-R681 PolarHBondContact O-NH1 2.87Å; H221-R681 PolarHBondContact NE2-N 3.2Å; E222-R681 IonicContact OE1-CZ 2.66Å; E222-R681 IonicContact OE1-NH1 3.41Å; E222-R681 PolarHBondContact OE1-NH1 3.29Å; E222-R681 IonicContact OE1-NH2 3.11Å; E222-R681 PolarHBondContact OE1-NH2 2.87Å; Y266-R681 PolarHBondContact O-NE 3.39Å; Y266-R681 PolarHBondContact O-NH2 3.37Å; Y266-R681 VanDerWaalsContact O-NH2 3.12Å
682	P	92.9	Very high	91.4	Very high	4 Å²	4	24.3 Å²	24.3	3%	0.026	13%	0.125	C	C	.	.	P	Polyproline II helix	trans	-66.9	149.3	174.5	28.4	-34	0	0	0	109.9	F267 I271 Y629 R680 A684	F267-P682 HydrophobicContact CB-CG 4.5Å; F267-P682 HydrophobicContact CD1-CG 3.49Å; F267-P682 VanDerWaalsContact CD1-CG 3.49Å; F267-P682 HydrophobicContact CE1-CG 4.07Å; F267-P682 HydrophobicContact CG-CG 4.37Å; I271-P682 HydrophobicContact CD1-CB 3.79Å; I271-P682 HydrophobicContact CD1-CG 3.36Å; Y629-P682 HydrophobicContact CD1-CB 3.58Å; Y629-P682 HydrophobicContact CD2-CB 4.1Å; Y629-P682 HydrophobicContact CE1-CB 3.68Å; Y629-P682 HydrophobicContact CE2-CB 4.22Å; Y629-P682 HydrophobicContact CG-CB 3.76Å; R680-P682 WeakPolarHBondContact O-CD 3.38Å; R680-P682 VanDerWaalsContact O-N 3.15Å; P682-A684 PolarHBondContact O-N 2.88Å
683	L	91.5	Very high	91.5	Very high	36 Å²	36	24.6 Å²	24.6	19%	0.188	13%	0.126	C	C	.	.	P	Polyproline II helix	trans	-66.3	133	170.3	-174.6	70.4	0	0	0	108.9	H183 Y187 E685	H183-L683 HydrophobicContact CB-CD1 4.35Å; Y187-L683 HydrophobicContact CD1-CD2 3.24Å; Y187-L683 HydrophobicContact CD2-CD2 4Å; Y187-L683 HydrophobicContact CE1-CD2 3.75Å; Y187-L683 HydrophobicContact CE2-CD2 4.45Å; Y187-L683 HydrophobicContact CG-CD1 4.21Å; Y187-L683 HydrophobicContact CG-CD2 3.37Å; Y187-L683 HydrophobicContact CG-CG 4.42Å; L683-E685 PolarHBondContact O-N 2.89Å
684	A	91.6	Very high	91.7	Very high	7 Å²	7	24.1 Å²	24.1	6%	0.058	12%	0.124	C	C	.	.			trans	-68.9	100.8	177.1	0	0	0	0	0	109.8	T180 Q184 F267 P682	T180-A684 HydrophobicContact CG2-CB 4.18Å; Q184-A684 HydrophobicContact CG-CB 4.26Å; Q184-A684 VanDerWaalsContact CG-O 3.24Å; Q184-A684 WeakPolarHBondContact CG-O 3.33Å; Q184-A684 PolarHBondContact NE2-O 3.49Å; F267-A684 WeakPolarHBondContact O-CA 3.4Å; P682-A684 PolarHBondContact O-N 2.88Å
685	E	88.5	Confident	91.9	Very high	75 Å²	75	31.7 Å²	31.7	35%	0.35	15%	0.151	S	C	.	.			trans	-92.4	133.9	175.8	-68.7	179.5	179.3	0	0	110.6	E269 K270 L683	E269-E685 PolarHBondContact N-O 3.3Å; K270-E685 HydrophobicContact CB-CB 4.14Å; K270-E685 WeakPolarHBondContact CB-O 3.46Å; K270-E685 HydrophobicContact CD-CB 3.97Å; K270-E685 WeakPolarHBondContact CD-OE2 3.46Å; K270-E685 WeakPolarHBondContact CE-OE2 3.34Å; K270-E685 PolarHBondContact N-O 3.44Å; K270-E685 VanDerWaalsContact N-O 3.07Å; K270-E685 IonicContact NZ-OE2 2.68Å; K270-E685 PolarHBondContact NZ-OE2 3.31Å; L683-E685 PolarHBondContact O-N 2.89Å
686	R	90	Very high	92.1	Very high	38 Å²	38	31.5 Å²	31.5	14%	0.143	15%	0.15	C	C	.	.			trans	-79.3	134.4	172.1	-64.4	-178.8	80.5	-162.2	-5.7	109.1	D382 V383 Y386 E390	D382-R686 PolarHBondContact O-NH2 3.29Å; V383-R686 HydrophobicContact CG1-CB 4.44Å; Y386-R686 HydrophobicContact CD2-CB 4.25Å; Y386-R686 HydrophobicContact CE1-CB 4.16Å; Y386-R686 HydrophobicContact CE2-CB 3.86Å; E390-R686 IonicContact OE2-CZ 2.59Å; E390-R686 IonicContact OE2-NH1 3.56Å; E390-R686 PolarHBondContact OE2-NH1 2.79Å; E390-R686 IonicContact OE2-NH2 2.71Å; E390-R686 PolarHBondContact OE2-NH2 3.46Å
687	A	91.1	Very high	92.3	Very high	16 Å²	16	31.5 Å²	31.5	13%	0.132	15%	0.15	C	C	.	.			trans	-143.7	149.3	174.1	0	0	0	0	0	108	K270 F273 V383	K270-A687 HydrophobicContact CB-CB 3.99Å; K270-A687 HydrophobicContact CG-CB 4.21Å; F273-A687 HydrophobicContact CD2-CB 4.48Å; F273-A687 WeakPolarHBondContact CE2-O 3.22Å; V383-A687 WeakPolarHBondContact CB-O 3.1Å; V383-A687 VanDerWaalsContact CG2-O 3.32Å; V383-A687 WeakPolarHBondContact CG2-O 3.32Å
688	Q	92	Very high	92.5	Very high	29 Å²	29	33.2 Å²	33.2	14%	0.136	16%	0.159	C	C	.	.	S	Bend	trans	-101.6	-17.8	179.1	63.4	174.8	11.3	0	0	113.5	F273 N374 V383 E387	F273-Q688 WeakPolarHBondContact CZ-O 3.48Å; N374-Q688 PolarHBondContact ND2-O 2.88Å; V383-Q688 WeakPolarHBondContact O-CB 3.36Å; E387-Q688 HydrophobicContact CG-CG 4.08Å; E387-Q688 VanDerWaalsContact OE1-CG 3.27Å; E387-Q688 WeakPolarHBondContact OE1-CG 3.41Å; E387-Q688 PolarHBondContact OE1-NE2 3.45Å; E387-Q688 PolarHBondContact OE2-NE2 3.11Å
689	N	92.6	Very high	92.8	Very high	52 Å²	52	36.4 Å²	36.4	28%	0.278	17%	0.172	S	C	.	.	S	Bend	trans	-159.2	-178.7	-179	57.7	36.7	0	0	0	109.6	N374 G691	N374-N689 WeakPolarHBondContact OD1-CA 3.24Å; N689-G691 PolarHBondContact O-N 3.31Å; N689-G691 WeakPolarHBondContact OD1-CA 3.44Å; N689-G691 PolarHBondContact OD1-N 3.22Å
690	I	92.6	Very high	93.1	Very high	10 Å²	10	35.9 Å²	35.9	5%	0.051	17%	0.169	C	C	.	.			trans	-75.7	7.4	173.5	60.6	172.3	0	0	0	113.1	F273 W277 W370 Y636 W693 F694 L697	F273-I690 HydrophobicContact CB-CG2 4.46Å; W277-I690 HydrophobicContact CB-CG2 4.33Å; W370-I690 HydrophobicContact CH2-CG2 4.48Å; W370-I690 HydrophobicContact CZ2-CG2 3.64Å; Y636-I690 HydrophobicContact CE1-CB 4.27Å; Y636-I690 HydrophobicContact CE1-CG2 3.95Å; Y636-I690 WeakPolarHBondContact OH-CG2 3.41Å; I690-W693 HydrophobicContact CB-CB 4.37Å; I690-W693 HydrophobicContact CD1-CB 3.99Å; I690-W693 HydrophobicContact CG1-CB 4.18Å; I690-F694 HydrophobicContact CD1-CB 4.21Å; I690-F694 HydrophobicContact CG1-CB 4.21Å; I690-L697 HydrophobicContact CD1-CD1 4.27Å
691	G	90.3	Very high	93.2	Very high	19 Å²	19	35 Å²	35	20%	0.196	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	-144.2	-179.5	0	0	0	0	0	113.9	N689 W693 F694	N689-G691 PolarHBondContact O-N 3.31Å; N689-G691 WeakPolarHBondContact OD1-CA 3.44Å; N689-G691 PolarHBondContact OD1-N 3.22Å; G691-W693 PolarHBondContact O-N 3.41Å; G691-W693 VanDerWaalsContact O-N 3.09Å; G691-F694 PolarHBondContact O-N 3.46Å
692	V	93.8	Very high	93.1	Very high	20 Å²	20	39.8 Å²	39.8	12%	0.121	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-20.2	-178.1	70.3	0	0	0	0	113.7	N512 I515 F694 R695 I696	N512-V692 HydrophobicContact CB-CB 4.13Å; N512-V692 HydrophobicContact CB-CG1 4.34Å; N512-V692 WeakPolarHBondContact OD1-CB 3.21Å; N512-V692 PolarHBondContact OD1-N 2.88Å; I515-V692 HydrophobicContact CB-CG1 3.6Å; I515-V692 HydrophobicContact CD1-CG1 4.08Å; I515-V692 HydrophobicContact CG1-CG1 4.45Å; I515-V692 HydrophobicContact CG2-CG1 3.29Å; V692-F694 PolarHBondContact O-N 2.97Å; V692-F694 VanDerWaalsContact O-N 3.15Å; V692-R695 PolarHBondContact O-N 3.42Å; V692-I696 HydrophobicContact CG1-CD1 4.24Å; V692-I696 HydrophobicContact CG2-CD1 4.4Å; V692-I696 PolarHBondContact O-N 3.01Å; V692-I696 VanDerWaalsContact O-N 3.1Å
693	W	95.4	Very high	93.2	Very high	6 Å²	6	41.4 Å²	41.4	2%	0.023	19%	0.193	C	C	.	.	H	α-helix	trans	-54.3	-34.7	177.7	-65.3	127.3	0	0	0	112.7	I515 F519 F633 Y636 L637 V640 I690 G691 R695 I696 L697	I515-W693 HydrophobicContact CB-CZ2 4.35Å; I515-W693 HydrophobicContact CD1-CZ2 4.33Å; I515-W693 HydrophobicContact CG1-CZ2 3.98Å; I515-W693 HydrophobicContact CG2-CD2 3.76Å; I515-W693 HydrophobicContact CG2-CE3 3.83Å; I515-W693 HydrophobicContact CG2-CH2 3.56Å; I515-W693 HydrophobicContact CG2-CZ2 3.45Å; I515-W693 VanDerWaalsContact CG2-CZ2 3.45Å; I515-W693 HydrophobicContact CG2-CZ3 3.74Å; F519-W693 HydrophobicContact CD2-CZ3 4.49Å; F633-W693 HydrophobicContact CD2-CH2 4.49Å; F633-W693 AromaticContact CD2-CZ2 3.96Å; F633-W693 HydrophobicContact CD2-CZ2 3.96Å; F633-W693 AromaticContact CE2-CH2 3.94Å; F633-W693 HydrophobicContact CE2-CH2 3.94Å; F633-W693 AromaticContact CE2-CZ2 3.83Å; F633-W693 HydrophobicContact CE2-CZ2 3.83Å; Y636-W693 AromaticContact CD1-CD1 3.96Å; Y636-W693 HydrophobicContact CD1-CG 4.43Å; Y636-W693 AromaticContact CD2-CD1 3.96Å; Y636-W693 AromaticContact CD2-NE1 3.59Å; Y636-W693 AromaticContact CG-CD1 3.72Å; Y636-W693 HydrophobicContact CG-CG 4.41Å; Y636-W693 AromaticContact CG-NE1 3.5Å; L637-W693 HydrophobicContact CB-CH2 3.89Å; L637-W693 HydrophobicContact CD1-CH2 4.15Å; L637-W693 HydrophobicContact CD1-CZ3 4.45Å; V640-W693 HydrophobicContact CB-CE3 4.27Å; V640-W693 HydrophobicContact CB-CZ3 4.23Å; V640-W693 HydrophobicContact CG1-CE3 4.3Å; V640-W693 HydrophobicContact CG1-CZ3 4.32Å; V640-W693 HydrophobicContact CG2-CD2 4.34Å; V640-W693 HydrophobicContact CG2-CE3 3.72Å; V640-W693 HydrophobicContact CG2-CZ3 4.13Å; I690-W693 HydrophobicContact CB-CB 4.37Å; I690-W693 HydrophobicContact CD1-CB 3.99Å; I690-W693 HydrophobicContact CG1-CB 4.18Å; G691-W693 PolarHBondContact O-N 3.41Å; G691-W693 VanDerWaalsContact O-N 3.09Å; W693-R695 PolarHBondContact O-N 3.35Å; W693-I696 HydrophobicContact CE3-CD1 3.7Å; W693-I696 HydrophobicContact CZ3-CD1 4.03Å; W693-I696 PolarHBondContact O-N 2.93Å; W693-L697 VanDerWaalsContact O-CG 3.31Å; W693-L697 WeakPolarHBondContact O-CG 3.44Å; W693-L697 PolarHBondContact O-N 3.45Å
694	F	95	Very high	93.3	Very high	51 Å²	51	39.9 Å²	39.9	22%	0.224	19%	0.185	C	C	.	.	H	α-helix	trans	-62.2	-44.9	175.9	-177.6	-97.9	0	0	0	112.5	L367 W370 K371 I690 G691 V692 I696 L697 D698	L367-F694 HydrophobicContact CB-CE2 4.21Å; L367-F694 HydrophobicContact CD2-CE2 4.23Å; W370-F694 AromaticContact CD1-CD2 3.87Å; K371-F694 HydrophobicContact CD-CZ 3.9Å; K371-F694 HydrophobicContact CG-CE1 4.35Å; K371-F694 HydrophobicContact CG-CE2 3.66Å; K371-F694 HydrophobicContact CG-CZ 3.52Å; I690-F694 HydrophobicContact CD1-CB 4.21Å; I690-F694 HydrophobicContact CG1-CB 4.21Å; G691-F694 PolarHBondContact O-N 3.46Å; V692-F694 PolarHBondContact O-N 2.97Å; V692-F694 VanDerWaalsContact O-N 3.15Å; F694-I696 VanDerWaalsContact C-N 3.29Å; F694-I696 PolarHBondContact O-N 2.97Å; F694-L697 PolarHBondContact O-N 3.32Å; F694-D698 PolarHBondContact O-N 3.13Å
695	R	95.7	Very high	93.4	Very high	199 Å²	199	39.7 Å²	39.7	75%	0.751	18%	0.184	S	C	*	.	H	α-helix	trans	-65.8	-35.1	177.8	-64.5	-174.3	-176.9	-175.3	2.2	111.6	V692 W693 F699	V692-R695 PolarHBondContact O-N 3.42Å; W693-R695 PolarHBondContact O-N 3.35Å; R695-F699 PolarHBondContact O-N 3.37Å
696	I	96.3	Very high	93.7	Very high	6 Å²	6	39 Å²	39	3%	0.031	18%	0.181	C	C	.	.	H	α-helix	trans	-64.4	-45.6	174.5	-69.3	167.1	0	0	0	110.7	I515 F519 V640 V692 W693 F694 F699 L700	I515-I696 HydrophobicContact CG2-CD1 3.97Å; F519-I696 HydrophobicContact CB-CD1 3.92Å; F519-I696 HydrophobicContact CD1-CD1 3.95Å; F519-I696 HydrophobicContact CD1-CG1 3.97Å; F519-I696 HydrophobicContact CD1-CG2 3.89Å; F519-I696 HydrophobicContact CD2-CD1 4.37Å; F519-I696 HydrophobicContact CD2-CG2 3.75Å; F519-I696 HydrophobicContact CE1-CB 4.47Å; F519-I696 HydrophobicContact CE1-CG1 4.26Å; F519-I696 HydrophobicContact CE1-CG2 3.55Å; F519-I696 HydrophobicContact CE2-CG2 3.39Å; F519-I696 HydrophobicContact CG-CD1 3.79Å; F519-I696 HydrophobicContact CG-CG1 4.27Å; F519-I696 HydrophobicContact CG-CG2 3.98Å; F519-I696 HydrophobicContact CZ-CG2 3.29Å; V640-I696 HydrophobicContact CG1-CG2 3.65Å; V692-I696 HydrophobicContact CG1-CD1 4.24Å; V692-I696 HydrophobicContact CG2-CD1 4.4Å; V692-I696 PolarHBondContact O-N 3.01Å; V692-I696 VanDerWaalsContact O-N 3.1Å; W693-I696 HydrophobicContact CE3-CD1 3.7Å; W693-I696 HydrophobicContact CZ3-CD1 4.03Å; W693-I696 PolarHBondContact O-N 2.93Å; F694-I696 VanDerWaalsContact C-N 3.29Å; F694-I696 PolarHBondContact O-N 2.97Å; I696-F699 WeakPolarHBondContact O-CB 3.49Å; I696-F699 PolarHBondContact O-N 3.31Å; I696-L700 HydrophobicContact CG2-CD1 4.24Å; I696-L700 WeakPolarHBondContact O-CG 3.47Å; I696-L700 PolarHBondContact O-N 2.94Å
697	L	96	Very high	93.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.1	-42.1	177.7	-69.2	167.8	0	0	0	112.1	W277 L367 V640 F643 I690 W693 F694 F699 L700 V701	W277-L697 HydrophobicContact CZ2-CD1 3.93Å; W277-L697 HydrophobicContact CZ2-CD2 4.42Å; L367-L697 HydrophobicContact CD2-CB 3.74Å; L367-L697 HydrophobicContact CD2-CD1 4.22Å; V640-L697 HydrophobicContact CG1-CD2 4.37Å; V640-L697 HydrophobicContact CG2-CD2 4.18Å; F643-L697 HydrophobicContact CB-CD2 4.02Å; F643-L697 HydrophobicContact CD1-CD2 3.44Å; F643-L697 VanDerWaalsContact CD1-CD2 3.44Å; F643-L697 HydrophobicContact CD2-CD2 4.25Å; F643-L697 HydrophobicContact CE1-CD2 3.9Å; F643-L697 HydrophobicContact CG-CD2 3.63Å; F643-L697 HydrophobicContact CZ-CD2 4.48Å; I690-L697 HydrophobicContact CD1-CD1 4.27Å; W693-L697 VanDerWaalsContact O-CG 3.31Å; W693-L697 WeakPolarHBondContact O-CG 3.44Å; W693-L697 PolarHBondContact O-N 3.45Å; F694-L697 PolarHBondContact O-N 3.32Å; L697-F699 VanDerWaalsContact C-N 3.35Å; L697-F699 PolarHBondContact O-N 3.31Å; L697-L700 PolarHBondContact O-N 2.85Å; L697-V701 WeakPolarHBondContact O-CG2 3.33Å; L697-V701 PolarHBondContact O-N 2.88Å
698	D	93.7	Very high	93.9	Very high	50 Å²	50	36.6 Å²	36.6	27%	0.267	17%	0.17	S	C	.	.	H	α-helix	trans	-60.1	-44	174	-177.2	47.5	0	0	0	111.6	L367 F694 L700 V701 R702	L367-D698 HydrophobicContact CD1-CB 4.28Å; F694-D698 PolarHBondContact O-N 3.13Å; D698-L700 VanDerWaalsContact C-N 3.34Å; D698-L700 PolarHBondContact O-N 3.23Å; D698-V701 PolarHBondContact O-N 3.21Å; D698-R702 WeakPolarHBondContact O-CG 3.44Å; D698-R702 PolarHBondContact O-N 3.01Å; D698-R702 IonicContact OD1-CZ 2.93Å; D698-R702 IonicContact OD1-NE 2.67Å; D698-R702 PolarHBondContact OD1-NE 3.49Å; D698-R702 IonicContact OD1-NH2 2.63Å; D698-R702 PolarHBondContact OD1-NH2 3.33Å; D698-R702 IonicContact OD2-CZ 3.49Å; D698-R702 IonicContact OD2-NE 3.1Å; D698-R702 PolarHBondContact OD2-NE 3.04Å; D698-R702 IonicContact OD2-NH2 3.28Å; D698-R702 PolarHBondContact OD2-NH2 2.84Å; D698-R702 VanDerWaalsContact OD2-NH2 3.12Å
699	F	94.6	Very high	94	Very high	100 Å²	100	35.2 Å²	35.2	44%	0.439	16%	0.163	S	C	.	.	H	α-helix	trans	-58	-44.1	173.3	168.6	-100.9	0	0	0	112.4	F523 R695 I696 L697 V701 R702 L703	F523-F699 HydrophobicContact CE2-CE1 4.34Å; F523-F699 HydrophobicContact CZ-CE1 4.47Å; R695-F699 PolarHBondContact O-N 3.37Å; I696-F699 WeakPolarHBondContact O-CB 3.49Å; I696-F699 PolarHBondContact O-N 3.31Å; L697-F699 VanDerWaalsContact C-N 3.35Å; L697-F699 PolarHBondContact O-N 3.31Å; F699-V701 PolarHBondContact O-N 2.95Å; F699-R702 PolarHBondContact O-N 3.47Å; F699-L703 HydrophobicContact CE1-CD2 4.15Å; F699-L703 HydrophobicContact CZ-CD2 4.11Å; F699-L703 WeakPolarHBondContact O-CB 3.19Å; F699-L703 PolarHBondContact O-N 2.75Å
700	L	95.8	Very high	94.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63	-40.8	178.2	-69.6	172.5	0	0	0	112.1	F519 F523 V640 F643 I648 I696 L697 D698 L703 A704	F519-L700 HydrophobicContact CZ-CD1 4.47Å; F519-L700 HydrophobicContact CZ-CD2 4.15Å; F519-L700 HydrophobicContact CZ-CG 4.39Å; F523-L700 HydrophobicContact CD2-CD2 4.09Å; F523-L700 HydrophobicContact CE2-CD2 3.73Å; V640-L700 HydrophobicContact CG1-CD1 3.81Å; F643-L700 HydrophobicContact CD1-CB 4.23Å; F643-L700 HydrophobicContact CD1-CD1 4.06Å; F643-L700 HydrophobicContact CE1-CB 4.24Å; I648-L700 HydrophobicContact CD1-CD2 3.78Å; I696-L700 HydrophobicContact CG2-CD1 4.24Å; I696-L700 WeakPolarHBondContact O-CG 3.47Å; I696-L700 PolarHBondContact O-N 2.94Å; L697-L700 PolarHBondContact O-N 2.85Å; D698-L700 VanDerWaalsContact C-N 3.34Å; D698-L700 PolarHBondContact O-N 3.23Å; L700-L703 PolarHBondContact O-N 2.67Å; L700-A704 VanDerWaalsContact O-CB 3.28Å; L700-A704 WeakPolarHBondContact O-CB 3.42Å; L700-A704 PolarHBondContact O-N 3.5Å
701	V	93.8	Very high	94	Very high	7 Å²	7	35.9 Å²	35.9	4%	0.042	16%	0.163	C	C	.	.	H	α-helix	trans	-63.9	-43.9	176.2	173.6	0	0	0	0	111.2	V364 L367 F643 L697 D698 F699 A704 V705	V364-V701 HydrophobicContact CG2-CG1 3.9Å; L367-V701 HydrophobicContact CD1-CB 4.29Å; L367-V701 HydrophobicContact CD1-CG2 3.68Å; L367-V701 HydrophobicContact CG-CG2 4.41Å; F643-V701 HydrophobicContact CE1-CG2 3.75Å; F643-V701 HydrophobicContact CZ-CG2 3.68Å; L697-V701 WeakPolarHBondContact O-CG2 3.33Å; L697-V701 PolarHBondContact O-N 2.88Å; D698-V701 PolarHBondContact O-N 3.21Å; F699-V701 PolarHBondContact O-N 2.95Å; V701-A704 WeakPolarHBondContact O-CB 3.24Å; V701-A704 PolarHBondContact O-N 3.43Å; V701-V705 PolarHBondContact O-N 3.46Å
702	R	92.6	Very high	94.1	Very high	111 Å²	111	35 Å²	35	42%	0.419	15%	0.154	S	C	.	.	H	α-helix	trans	-63.8	-42.7	176.6	-66.6	173.5	-169.5	-82.8	-6.5	111.9	D698 F699 A704 V705 F787	D698-R702 WeakPolarHBondContact O-CG 3.44Å; D698-R702 PolarHBondContact O-N 3.01Å; D698-R702 IonicContact OD1-CZ 2.93Å; D698-R702 IonicContact OD1-NE 2.67Å; D698-R702 PolarHBondContact OD1-NE 3.49Å; D698-R702 IonicContact OD1-NH2 2.63Å; D698-R702 PolarHBondContact OD1-NH2 3.33Å; D698-R702 IonicContact OD2-CZ 3.49Å; D698-R702 IonicContact OD2-NE 3.1Å; D698-R702 PolarHBondContact OD2-NE 3.04Å; D698-R702 IonicContact OD2-NH2 3.28Å; D698-R702 PolarHBondContact OD2-NH2 2.84Å; D698-R702 VanDerWaalsContact OD2-NH2 3.12Å; F699-R702 PolarHBondContact O-N 3.47Å; R702-A704 VanDerWaalsContact C-N 3.3Å; R702-A704 PolarHBondContact O-N 3.49Å; R702-V705 PolarHBondContact O-N 3.32Å; R702-F787 HydrophobicContact CB-CE1 4.42Å; R702-F787 HydrophobicContact CG-CE1 4.44Å
703	L	94.1	Very high	94	Very high	38 Å²	38	34.1 Å²	34.1	20%	0.199	15%	0.149	C	C	.	.	H	α-helix	trans	-65.7	-34.8	176.3	-176.5	62.5	0	0	0	112	F523 F531 I648 F699 L700 V705 I706 S707	F523-L703 HydrophobicContact CE1-CD2 4.47Å; F523-L703 HydrophobicContact CE2-CD2 3.97Å; F523-L703 HydrophobicContact CZ-CD2 3.45Å; F523-L703 VanDerWaalsContact CZ-CD2 3.45Å; F531-L703 HydrophobicContact CZ-CD2 4.28Å; I648-L703 HydrophobicContact CD1-CD2 3.97Å; F699-L703 HydrophobicContact CE1-CD2 4.15Å; F699-L703 HydrophobicContact CZ-CD2 4.11Å; F699-L703 WeakPolarHBondContact O-CB 3.19Å; F699-L703 PolarHBondContact O-N 2.75Å; L700-L703 PolarHBondContact O-N 2.67Å; L703-V705 VanDerWaalsContact C-N 3.32Å; L703-V705 PolarHBondContact O-N 3.35Å; L703-I706 PolarHBondContact O-N 3.17Å; L703-S707 WeakPolarHBondContact O-CB 3.48Å; L703-S707 PolarHBondContact O-N 3.28Å
704	A	94.8	Very high	93.8	Very high	4 Å²	4	35.9 Å²	35.9	3%	0.033	16%	0.157	C	C	.	.	H	α-helix	trans	-62.7	-36.4	177.6	0	0	0	0	0	112.8	T647 I648 L700 V701 R702 I706 N708	T647-A704 WeakPolarHBondContact O-CB 3.26Å; I648-A704 HydrophobicContact CG1-CB 4.3Å; L700-A704 VanDerWaalsContact O-CB 3.28Å; L700-A704 WeakPolarHBondContact O-CB 3.42Å; L700-A704 PolarHBondContact O-N 3.5Å; V701-A704 WeakPolarHBondContact O-CB 3.24Å; V701-A704 PolarHBondContact O-N 3.43Å; R702-A704 VanDerWaalsContact C-N 3.3Å; R702-A704 PolarHBondContact O-N 3.49Å; A704-I706 PolarHBondContact O-N 3.41Å; A704-N708 VanDerWaalsContact O-CB 3.29Å; A704-N708 WeakPolarHBondContact O-CB 3.03Å; A704-N708 PolarHBondContact O-N 3.11Å; A704-N708 PolarHBondContact O-ND2 2.86Å
705	V	93.3	Very high	93.5	Very high	3 Å²	3	35 Å²	35	2%	0.018	15%	0.152	C	C	.	.	H	α-helix	trans	-57.4	-50.9	173.8	174.3	0	0	0	0	110.5	V360 V701 R702 L703 A709 F782 A786 F787	V360-V705 HydrophobicContact CB-CG2 4.49Å; V360-V705 HydrophobicContact CG1-CG2 3.7Å; V360-V705 HydrophobicContact CG2-CG2 3.93Å; V701-V705 PolarHBondContact O-N 3.46Å; R702-V705 PolarHBondContact O-N 3.32Å; L703-V705 VanDerWaalsContact C-N 3.32Å; L703-V705 PolarHBondContact O-N 3.35Å; V705-A709 WeakPolarHBondContact O-CB 3.31Å; V705-A709 PolarHBondContact O-N 3.41Å; V705-A709 VanDerWaalsContact O-N 3.16Å; V705-F782 HydrophobicContact CG1-CE1 4.48Å; V705-A786 HydrophobicContact CB-CB 4.44Å; V705-A786 HydrophobicContact CG1-CB 3.46Å; V705-A786 VanDerWaalsContact CG1-CB 3.46Å; V705-A786 HydrophobicContact CG2-CB 4.11Å; V705-F787 HydrophobicContact CB-CE1 4.36Å; V705-F787 HydrophobicContact CB-CZ 4.43Å; V705-F787 HydrophobicContact CG1-CE1 4.43Å; V705-F787 HydrophobicContact CG1-CZ 4.33Å; V705-F787 HydrophobicContact CG2-CE1 4.39Å
706	I	93.4	Very high	93.2	Very high	59 Å²	59	25.9 Å²	25.9	30%	0.303	12%	0.119	S	C	.	.	H	α-helix	trans	-63.8	-52.6	-179.4	-60.3	172.3	0	0	0	109.7	L703 A704 N708 A709 F710	L703-I706 PolarHBondContact O-N 3.17Å; A704-I706 PolarHBondContact O-N 3.41Å; I706-N708 PolarHBondContact O-N 3.3Å; I706-A709 WeakPolarHBondContact O-CB 3.31Å; I706-A709 PolarHBondContact O-N 3.31Å; I706-F710 HydrophobicContact CG2-CD2 3.74Å; I706-F710 HydrophobicContact CG2-CE2 3.71Å; I706-F710 VanDerWaalsContact O-CD2 3.29Å; I706-F710 WeakPolarHBondContact O-CD2 3.09Å; I706-F710 PolarHBondContact O-N 3.49Å
707	S	94	Very high	92.7	Very high	3 Å²	3	27 Å²	27	2%	0.021	13%	0.127	C	C	.	.	H	α-helix	trans	-58.8	-48	-176.8	-179.3	0	0	0	0	112.5	I648 L703 A709 F710 I711	I648-S707 VanDerWaalsContact CG2-OG 3.25Å; I648-S707 WeakPolarHBondContact CG2-OG 3.45Å; I648-S707 WeakPolarHBondContact O-CB 3.26Å; I648-S707 PolarHBondContact O-OG 3.4Å; L703-S707 WeakPolarHBondContact O-CB 3.48Å; L703-S707 PolarHBondContact O-N 3.28Å; S707-A709 VanDerWaalsContact C-N 3.32Å; S707-A709 PolarHBondContact O-N 2.89Å; S707-F710 PolarHBondContact O-N 3.49Å; S707-I711 VanDerWaalsContact O-CG1 3.29Å; S707-I711 WeakPolarHBondContact O-CG1 3.23Å; S707-I711 PolarHBondContact O-N 3.5Å
708	N	93.4	Very high	92.4	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.011	14%	0.137	C	C	.	.	H	α-helix	trans	-63.9	-37.5	179	-72.6	-52.3	0	0	0	112	A356 T647 I648 V650 A651 A704 I706 F710 I711 I712	A356-N708 HydrophobicContact CB-CB 4.47Å; T647-N708 PolarHBondContact O-ND2 2.9Å; I648-N708 PolarHBondContact O-OD1 3.37Å; V650-N708 PolarHBondContact N-OD1 3.04Å; A651-N708 HydrophobicContact CB-CB 4.44Å; A651-N708 PolarHBondContact N-OD1 3.38Å; A704-N708 VanDerWaalsContact O-CB 3.29Å; A704-N708 WeakPolarHBondContact O-CB 3.03Å; A704-N708 PolarHBondContact O-N 3.11Å; A704-N708 PolarHBondContact O-ND2 2.86Å; I706-N708 PolarHBondContact O-N 3.3Å; N708-F710 PolarHBondContact O-N 2.91Å; N708-I711 PolarHBondContact O-N 3.03Å; N708-I712 WeakPolarHBondContact O-CB 3.33Å; N708-I712 WeakPolarHBondContact O-CD1 3.27Å; N708-I712 VanDerWaalsContact O-CG1 3.26Å; N708-I712 WeakPolarHBondContact O-CG1 3.16Å; N708-I712 PolarHBondContact O-N 3.41Å
709	A	93.5	Very high	92.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-59.6	-46.7	174.3	0	0	0	0	0	111.6	V705 I706 S707 A713 V779 F782	V705-A709 WeakPolarHBondContact O-CB 3.31Å; V705-A709 PolarHBondContact O-N 3.41Å; V705-A709 VanDerWaalsContact O-N 3.16Å; I706-A709 WeakPolarHBondContact O-CB 3.31Å; I706-A709 PolarHBondContact O-N 3.31Å; S707-A709 VanDerWaalsContact C-N 3.32Å; S707-A709 PolarHBondContact O-N 2.89Å; A709-A713 VanDerWaalsContact O-CB 3.28Å; A709-A713 WeakPolarHBondContact O-CB 3.49Å; A709-A713 PolarHBondContact O-N 3.47Å; A709-V779 HydrophobicContact CB-CB 4.48Å; A709-V779 HydrophobicContact CB-CG1 4.13Å; A709-V779 HydrophobicContact CB-CG2 4.36Å; A709-F782 HydrophobicContact CB-CB 4.26Å; A709-F782 HydrophobicContact CB-CD1 3.56Å; A709-F782 HydrophobicContact CB-CE1 4.18Å; A709-F782 HydrophobicContact CB-CG 4.1Å
710	F	93.4	Very high	92.2	Very high	73 Å²	73	22.7 Å²	22.7	32%	0.32	11%	0.107	S	C	.	.	H	α-helix	trans	-67.2	-39.2	177.5	-83.6	-83.1	0	0	0	112.8	F535 I706 S707 N708 A713 F714 V779	F535-F710 HydrophobicContact CD1-CB 4.12Å; F535-F710 HydrophobicContact CE1-CB 3.43Å; F535-F710 VanDerWaalsContact CE1-CB 3.43Å; F535-F710 HydrophobicContact CE1-CG 4.43Å; F535-F710 HydrophobicContact CZ-CB 4.08Å; I706-F710 HydrophobicContact CG2-CD2 3.74Å; I706-F710 HydrophobicContact CG2-CE2 3.71Å; I706-F710 VanDerWaalsContact O-CD2 3.29Å; I706-F710 WeakPolarHBondContact O-CD2 3.09Å; I706-F710 PolarHBondContact O-N 3.49Å; S707-F710 PolarHBondContact O-N 3.49Å; N708-F710 PolarHBondContact O-N 2.91Å; F710-A713 PolarHBondContact O-N 2.89Å; F710-F714 AromaticContact CD1-CD2 3.67Å; F710-F714 HydrophobicContact CD1-CD2 3.67Å; F710-F714 AromaticContact CD1-CE2 3.53Å; F710-F714 HydrophobicContact CD1-CE2 3.53Å; F710-F714 HydrophobicContact CE1-CD2 4.4Å; F710-F714 AromaticContact CE1-CE2 3.82Å; F710-F714 HydrophobicContact CE1-CE2 3.82Å; F710-F714 WeakPolarHBondContact O-CB 3.25Å; F710-F714 PolarHBondContact O-N 2.97Å; F710-V779 HydrophobicContact CD2-CG1 4.21Å; F710-V779 HydrophobicContact CE2-CG1 3.85Å; F710-V779 HydrophobicContact CZ-CG1 4.08Å
711	I	92.3	Very high	92	Very high	2 Å²	2	23.7 Å²	23.7	1%	0.01	11%	0.111	C	C	.	.	H	α-helix	trans	-61.6	-48	176.6	-69.7	167	0	0	0	110.1	F535 L564 F649 A651 S707 N708 A713 R715 S716	F535-I711 HydrophobicContact CE1-CG1 4.02Å; F535-I711 HydrophobicContact CZ-CG1 4.26Å; L564-I711 HydrophobicContact CD1-CG2 4.05Å; F649-I711 HydrophobicContact CD1-CD1 3.91Å; A651-I711 HydrophobicContact CB-CB 4.41Å; A651-I711 HydrophobicContact CB-CG2 3.94Å; S707-I711 VanDerWaalsContact O-CG1 3.29Å; S707-I711 WeakPolarHBondContact O-CG1 3.23Å; S707-I711 PolarHBondContact O-N 3.5Å; N708-I711 PolarHBondContact O-N 3.03Å; I711-A713 PolarHBondContact O-N 3.37Å; I711-R715 WeakPolarHBondContact O-CA 3.48Å; I711-R715 WeakPolarHBondContact O-CB 3.33Å; I711-R715 PolarHBondContact O-N 2.77Å; I711-S716 PolarHBondContact O-N 3.19Å; I711-S716 VanDerWaalsContact O-N 3.13Å
712	I	91.8	Very high	91.9	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.01	13%	0.131	C	C	.	.	H	α-helix	trans	-64.9	-40.9	178.4	-64.4	164.8	0	0	0	110.8	V353 A356 A651 N708 S716 F718 F778 F782	V353-I712 HydrophobicContact CG1-CD1 4.4Å; V353-I712 HydrophobicContact CG2-CG2 4.01Å; A356-I712 HydrophobicContact CB-CD1 3.8Å; A651-I712 HydrophobicContact CB-CD1 4.29Å; A651-I712 HydrophobicContact CB-CG1 3.94Å; N708-I712 WeakPolarHBondContact O-CB 3.33Å; N708-I712 WeakPolarHBondContact O-CD1 3.27Å; N708-I712 VanDerWaalsContact O-CG1 3.26Å; N708-I712 WeakPolarHBondContact O-CG1 3.16Å; N708-I712 PolarHBondContact O-N 3.41Å; I712-S716 WeakPolarHBondContact O-CB 3.31Å; I712-F718 HydrophobicContact CG2-CD1 4.39Å; I712-F778 HydrophobicContact CB-CE1 3.93Å; I712-F778 HydrophobicContact CB-CZ 4.34Å; I712-F778 HydrophobicContact CG2-CE1 3.58Å; I712-F778 HydrophobicContact CG2-CZ 3.63Å; I712-F782 HydrophobicContact CD1-CE2 4.28Å
713	A	92.2	Very high	91.9	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-70.4	-45.5	-177.9	0	0	0	0	0	113.1	A709 F710 I711 L719 R775 F778 V779	A709-A713 VanDerWaalsContact O-CB 3.28Å; A709-A713 WeakPolarHBondContact O-CB 3.49Å; A709-A713 PolarHBondContact O-N 3.47Å; F710-A713 PolarHBondContact O-N 2.89Å; I711-A713 PolarHBondContact O-N 3.37Å; A713-L719 HydrophobicContact CB-CD1 4.12Å; A713-R775 HydrophobicContact CB-CB 4.25Å; A713-R775 HydrophobicContact CB-CG 4.39Å; A713-R775 WeakPolarHBondContact O-CD 3.37Å; A713-R775 VanDerWaalsContact O-CG 3.32Å; A713-R775 WeakPolarHBondContact O-CG 3.42Å; A713-R775 PolarHBondContact O-NE 3.35Å; A713-F778 HydrophobicContact CB-CD1 4.14Å; A713-V779 HydrophobicContact CB-CG2 3.6Å
714	F	90.3	Very high	91.8	Very high	44 Å²	44	21.8 Å²	21.8	19%	0.193	11%	0.108	C	C	.	.	H	α-helix	trans	-104.2	-21.8	-167.9	-70.5	-84.2	0	0	0	114.9	F710 L772 R775 L776 V779	F710-F714 AromaticContact CD1-CD2 3.67Å; F710-F714 HydrophobicContact CD1-CD2 3.67Å; F710-F714 AromaticContact CD1-CE2 3.53Å; F710-F714 HydrophobicContact CD1-CE2 3.53Å; F710-F714 HydrophobicContact CE1-CD2 4.4Å; F710-F714 AromaticContact CE1-CE2 3.82Å; F710-F714 HydrophobicContact CE1-CE2 3.82Å; F710-F714 WeakPolarHBondContact O-CB 3.25Å; F710-F714 PolarHBondContact O-N 2.97Å; F714-L772 HydrophobicContact CE1-CD1 4.1Å; F714-R775 HydrophobicContact CZ-CB 4.39Å; F714-L776 HydrophobicContact CZ-CD2 4.17Å; F714-V779 HydrophobicContact CE2-CG2 4.48Å
715	R	89.6	Confident	91.7	Very high	32 Å²	32	26.9 Å²	26.9	12%	0.121	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110	-36	-177.5	-61.4	-56.3	-176.1	172.8	6.8	114.2	V533 A534 F535 K537 L564 I711	V533-R715 PolarHBondContact O-NH2 2.83Å; V533-R715 VanDerWaalsContact O-NH2 3.11Å; A534-R715 WeakPolarHBondContact O-CG 3.22Å; A534-R715 PolarHBondContact O-NE 3.4Å; A534-R715 PolarHBondContact O-NH2 3.11Å; F535-R715 VanDerWaalsContact C-NH2 3.33Å; F535-R715 PolarHBondContact O-NH2 3.31Å; K537-R715 PolarHBondContact O-NH1 3.01Å; K537-R715 PolarHBondContact O-NH2 2.88Å; L564-R715 HydrophobicContact CD1-CB 4.14Å; I711-R715 WeakPolarHBondContact O-CA 3.48Å; I711-R715 WeakPolarHBondContact O-CB 3.33Å; I711-R715 PolarHBondContact O-N 2.77Å
716	S	88.2	Confident	91.6	Very high	8 Å²	8	34.5 Å²	34.5	6%	0.056	16%	0.164	C	C	.	.	S	Bend	trans	-71.9	149.5	174.7	168.4	0	0	0	0	111.9	D348 I711 I712 F718	D348-S716 VanDerWaalsContact OD1-CB 3.23Å; D348-S716 WeakPolarHBondContact OD1-CB 3.44Å; D348-S716 PolarHBondContact OD1-OG 3.1Å; D348-S716 VanDerWaalsContact OD2-CA 3.22Å; D348-S716 WeakPolarHBondContact OD2-CA 3.43Å; D348-S716 PolarHBondContact OD2-OG 3.09Å; I711-S716 PolarHBondContact O-N 3.19Å; I711-S716 VanDerWaalsContact O-N 3.13Å; I712-S716 WeakPolarHBondContact O-CB 3.31Å; S716-F718 VanDerWaalsContact C-N 3.27Å; S716-F718 WeakPolarHBondContact OG-CB 3.5Å; S716-F718 PolarHBondContact OG-N 3.31Å
717	S	86.8	Confident	91.5	Very high	28 Å²	28	35.6 Å²	35.6	20%	0.196	17%	0.168	C	C	.	.	S	Bend	trans	-82.3	-1	171.2	58.6	0	0	0	0	113.9	D348 L719 P720 E721	D348-S717 PolarHBondContact OD2-N 3.12Å; D348-S717 PolarHBondContact OD2-OG 3.26Å; S717-L719 PolarHBondContact O-N 2.98Å; S717-P720 VanDerWaalsContact O-CD 3.25Å; S717-P720 WeakPolarHBondContact O-CD 3.31Å; S717-E721 WeakPolarHBondContact CB-OE1 3.48Å; S717-E721 WeakPolarHBondContact O-CB 3.41Å; S717-E721 VanDerWaalsContact O-CG 3.27Å; S717-E721 WeakPolarHBondContact O-CG 3.38Å; S717-E721 PolarHBondContact O-N 3.15Å; S717-E721 PolarHBondContact OG-OE1 3.17Å
718	F	89.6	Confident	91.2	Very high	50 Å²	50	38.9 Å²	38.9	22%	0.219	19%	0.188	C	C	.	.	H	α-helix	trans	-53.6	-52.6	-178	178.1	-106	0	0	0	114.2	P350 V353 I712 S716 E721 L722	P350-F718 HydrophobicContact CB-CE2 4.46Å; V353-F718 HydrophobicContact CG2-CB 4.48Å; V353-F718 HydrophobicContact CG2-CD1 4.12Å; V353-F718 HydrophobicContact CG2-CD2 4.17Å; V353-F718 HydrophobicContact CG2-CE1 4.42Å; V353-F718 HydrophobicContact CG2-CE2 4.46Å; V353-F718 HydrophobicContact CG2-CG 4Å; I712-F718 HydrophobicContact CG2-CD1 4.39Å; S716-F718 VanDerWaalsContact C-N 3.27Å; S716-F718 WeakPolarHBondContact OG-CB 3.5Å; S716-F718 PolarHBondContact OG-N 3.31Å; F718-E721 PolarHBondContact O-N 3.32Å; F718-L722 WeakPolarHBondContact O-CB 3.41Å; F718-L722 PolarHBondContact O-N 3.34Å
719	L	92.2	Very high	91	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.016	21%	0.208	C	C	.	.	H	α-helix	trans	-68.2	-45.5	-178.8	-68.1	179.8	0	0	0	113.4	A713 S717 E721 L722 M723 L771 R775 F778	A713-L719 HydrophobicContact CB-CD1 4.12Å; S717-L719 PolarHBondContact O-N 2.98Å; L719-E721 VanDerWaalsContact C-N 3.28Å; L719-E721 PolarHBondContact O-N 3.18Å; L719-L722 PolarHBondContact O-N 3.05Å; L719-M723 WeakPolarHBondContact O-CB 3.34Å; L719-M723 PolarHBondContact O-N 3.45Å; L719-L771 HydrophobicContact CB-CD1 4.39Å; L719-R775 HydrophobicContact CD1-CB 4.33Å; L719-R775 HydrophobicContact CD1-CG 3.76Å; L719-F778 HydrophobicContact CD1-CB 3.82Å; L719-F778 HydrophobicContact CD1-CD1 4.15Å; L719-F778 HydrophobicContact CD1-CG 3.93Å; L719-F778 HydrophobicContact CD2-CB 4.27Å; L719-F778 HydrophobicContact CD2-CD2 3.96Å; L719-F778 HydrophobicContact CD2-CG 4.1Å
720	P	91.7	Very high	90.8	Very high	8 Å²	8	50.3 Å²	50.3	5%	0.052	24%	0.24	C	C	.	.	H	α-helix	trans	-54.8	-41.1	171.6	-26.2	30.8	0	0	0	113.9	S717 Y724 F735 F757 L771	S717-P720 VanDerWaalsContact O-CD 3.25Å; S717-P720 WeakPolarHBondContact O-CD 3.31Å; P720-Y724 WeakPolarHBondContact O-CB 3.41Å; P720-Y724 PolarHBondContact O-N 3.27Å; P720-F735 HydrophobicContact CB-CE2 4.28Å; P720-F735 HydrophobicContact CB-CZ 4.08Å; P720-F757 HydrophobicContact CB-CZ 4.28Å; P720-L771 HydrophobicContact CB-CD1 4.46Å; P720-L771 HydrophobicContact CB-CD2 4.42Å; P720-L771 HydrophobicContact CG-CD1 4.1Å; P720-L771 HydrophobicContact CG-CD2 4.05Å
721	E	90.7	Very high	90.6	Very high	21 Å²	21	51.1 Å²	51.1	10%	0.098	25%	0.248	C	C	.	.	H	α-helix	trans	-67.2	-44.4	178.1	-76.2	171.2	-131.1	0	0	112.2	Y306 S717 F718 L719 M723 Y724 K725 L732 F735	Y306-E721 PolarHBondContact OH-OE1 3.24Å; Y306-E721 PolarHBondContact OH-OE2 3.3Å; S717-E721 WeakPolarHBondContact CB-OE1 3.48Å; S717-E721 WeakPolarHBondContact O-CB 3.41Å; S717-E721 VanDerWaalsContact O-CG 3.27Å; S717-E721 WeakPolarHBondContact O-CG 3.38Å; S717-E721 PolarHBondContact O-N 3.15Å; S717-E721 PolarHBondContact OG-OE1 3.17Å; F718-E721 PolarHBondContact O-N 3.32Å; L719-E721 VanDerWaalsContact C-N 3.28Å; L719-E721 PolarHBondContact O-N 3.18Å; E721-M723 VanDerWaalsContact C-N 3.31Å; E721-M723 PolarHBondContact O-N 3.49Å; E721-Y724 PolarHBondContact O-N 2.77Å; E721-K725 WeakPolarHBondContact O-CB 3.39Å; E721-K725 PolarHBondContact O-N 3.24Å; E721-L732 HydrophobicContact CB-CD2 3.9Å; E721-L732 HydrophobicContact CG-CD2 4Å; E721-F735 HydrophobicContact CB-CZ 4.46Å; E721-F735 HydrophobicContact CG-CD1 4.29Å; E721-F735 HydrophobicContact CG-CE1 3.69Å; E721-F735 HydrophobicContact CG-CE2 3.95Å; E721-F735 HydrophobicContact CG-CZ 3.49Å; E721-F735 VanDerWaalsContact CG-CZ 3.49Å
722	L	91.4	Very high	90.5	Very high	89 Å²	89	52.8 Å²	52.8	47%	0.466	26%	0.257	S	S	.	.	H	α-helix	trans	-60.7	-43.3	177	-176.4	63.7	0	0	0	111.3	F718 L719 K725 H726	F718-L722 WeakPolarHBondContact O-CB 3.41Å; F718-L722 PolarHBondContact O-N 3.34Å; L719-L722 PolarHBondContact O-N 3.05Å; L722-K725 PolarHBondContact O-N 3.24Å; L722-H726 WeakPolarHBondContact O-CB 3.45Å; L722-H726 PolarHBondContact O-N 3.19Å; L722-H726 VanDerWaalsContact O-N 3.11Å
723	M	93.2	Very high	90.5	Very high	13 Å²	13	55 Å²	55	6%	0.064	27%	0.27	C	S	.	.	H	α-helix	trans	-68.4	-41.5	178.3	-174.8	167.7	146.1	0	0	112	L719 E721 K725 H726 E727 F767 R770 L771 L774	L719-M723 WeakPolarHBondContact O-CB 3.34Å; L719-M723 PolarHBondContact O-N 3.45Å; E721-M723 VanDerWaalsContact C-N 3.31Å; E721-M723 PolarHBondContact O-N 3.49Å; M723-K725 VanDerWaalsContact C-N 3.32Å; M723-K725 PolarHBondContact O-N 2.95Å; M723-H726 PolarHBondContact O-N 3.32Å; M723-E727 WeakPolarHBondContact CE-OE2 3.45Å; M723-E727 HydrophobicContact CG-CG 4.29Å; M723-E727 WeakPolarHBondContact O-CB 3.24Å; M723-E727 PolarHBondContact O-N 3.43Å; M723-F767 HydrophobicContact CB-CZ 4.37Å; M723-F767 HydrophobicContact CE-CD1 4.05Å; M723-F767 HydrophobicContact CE-CD2 3.4Å; M723-F767 HydrophobicContact CE-CE1 4.03Å; M723-F767 HydrophobicContact CE-CE2 3.4Å; M723-F767 HydrophobicContact CE-CG 3.74Å; M723-F767 HydrophobicContact CE-CZ 3.71Å; M723-F767 WeakPolarHBondContact CE-O 3.45Å; M723-F767 HydrophobicContact CG-CE2 3.94Å; M723-F767 HydrophobicContact CG-CZ 4.03Å; M723-F767 HydrophobicContact SD-CE2 4.3Å; M723-F767 HydrophobicContact SD-CZ 4.21Å; M723-R770 HydrophobicContact CE-CB 3.58Å; M723-R770 HydrophobicContact SD-CB 4.48Å; M723-L771 HydrophobicContact CE-CB 4.08Å; M723-L771 HydrophobicContact SD-CB 3.84Å; M723-L771 HydrophobicContact SD-CD1 4.06Å; M723-L774 HydrophobicContact CB-CD2 4.04Å; M723-L774 HydrophobicContact CG-CD2 4.48Å; M723-L774 HydrophobicContact SD-CD2 4.15Å
724	Y	92.8	Very high	90.4	Very high	14 Å²	14	55.9 Å²	55.9	6%	0.055	28%	0.279	C	S	.	.	H	α-helix	trans	-60.8	-42.9	173.7	-178.3	-94.6	0	0	0	111.7	P720 E721 H726 V728 R729 D731 V733 F735 F738	P720-Y724 WeakPolarHBondContact O-CB 3.41Å; P720-Y724 PolarHBondContact O-N 3.27Å; E721-Y724 PolarHBondContact O-N 2.77Å; Y724-H726 PolarHBondContact O-N 3.41Å; Y724-V728 HydrophobicContact CD2-CB 3.76Å; Y724-V728 HydrophobicContact CD2-CG1 4.15Å; Y724-V728 HydrophobicContact CD2-CG2 3.76Å; Y724-V728 HydrophobicContact CE2-CB 3.69Å; Y724-V728 HydrophobicContact CE2-CG1 3.55Å; Y724-V728 HydrophobicContact CE2-CG2 4.01Å; Y724-V728 HydrophobicContact CG-CB 4.29Å; Y724-V728 WeakPolarHBondContact O-CB 3.34Å; Y724-V728 PolarHBondContact O-N 2.98Å; Y724-R729 HydrophobicContact CE1-CB 4.26Å; Y724-R729 PolarHBondContact O-N 3.16Å; Y724-R729 VanDerWaalsContact O-N 3.16Å; Y724-D731 WeakPolarHBondContact CE1-O 3.39Å; Y724-V733 PolarHBondContact OH-O 2.94Å; Y724-F735 HydrophobicContact CD1-CB 4.2Å; Y724-F735 AromaticContact CD1-CD2 3.95Å; Y724-F735 HydrophobicContact CD1-CD2 3.95Å; Y724-F735 HydrophobicContact CD2-CD2 4.05Å; Y724-F735 HydrophobicContact CE1-CB 4.12Å; Y724-F735 AromaticContact CG-CD2 3.64Å; Y724-F735 HydrophobicContact CG-CD2 3.64Å; Y724-F735 HydrophobicContact CG-CE2 4.38Å; Y724-F738 HydrophobicContact CD2-CB 4.21Å; Y724-F738 AromaticContact CD2-CD1 3.7Å; Y724-F738 HydrophobicContact CD2-CD1 3.7Å; Y724-F738 HydrophobicContact CD2-CD2 4.46Å; Y724-F738 HydrophobicContact CD2-CE1 4.18Å; Y724-F738 AromaticContact CD2-CG 3.86Å; Y724-F738 HydrophobicContact CD2-CG 3.86Å; Y724-F738 HydrophobicContact CE2-CB 3.69Å; Y724-F738 AromaticContact CE2-CD1 4Å; Y724-F738 HydrophobicContact CE2-CD1 4Å; Y724-F738 HydrophobicContact CE2-CD2 4.09Å; Y724-F738 AromaticContact CE2-CG 3.65Å; Y724-F738 HydrophobicContact CE2-CG 3.65Å
725	K	92.3	Very high	90.4	Very high	111 Å²	111	54.5 Å²	54.5	48%	0.483	27%	0.273	S	S	.	.	H	α-helix	trans	-60.1	-34.6	177.7	-165.4	177.8	-179.9	-179.5	0	112.3	E721 L722 M723 R729 N730	E721-K725 WeakPolarHBondContact O-CB 3.39Å; E721-K725 PolarHBondContact O-N 3.24Å; L722-K725 PolarHBondContact O-N 3.24Å; M723-K725 VanDerWaalsContact C-N 3.32Å; M723-K725 PolarHBondContact O-N 2.95Å; K725-R729 CarbonylContact C-O 3.48Å; K725-R729 WeakPolarHBondContact CA-O 3.26Å; K725-R729 CarbonylContact O-C 3.49Å; K725-R729 VanDerWaalsContact O-O 3.06Å; K725-N730 WeakPolarHBondContact CE-O 3.39Å; K725-N730 VanDerWaalsContact CG-O 3.31Å; K725-N730 WeakPolarHBondContact CG-O 3.44Å
726	H	91.3	Very high	90.4	Very high	162 Å²	162	53.6 Å²	53.6	75%	0.75	27%	0.271	S	S	*	.	H	α-helix	trans	-87	-43.8	-177.4	-171.7	66.4	0	0	0	113.6	L722 M723 Y724	L722-H726 WeakPolarHBondContact O-CB 3.45Å; L722-H726 PolarHBondContact O-N 3.19Å; L722-H726 VanDerWaalsContact O-N 3.11Å; M723-H726 PolarHBondContact O-N 3.32Å; Y724-H726 PolarHBondContact O-N 3.41Å
727	E	90.1	Very high	90.5	Very high	82 Å²	82	56.5 Å²	56.5	38%	0.383	29%	0.286	S	S	.	.	H	α-helix	trans	-91.5	-32.8	-173.1	-69.4	-163.8	146.7	0	0	114.1	M723 R770	M723-E727 WeakPolarHBondContact CE-OE2 3.45Å; M723-E727 HydrophobicContact CG-CG 4.29Å; M723-E727 WeakPolarHBondContact O-CB 3.24Å; M723-E727 PolarHBondContact O-N 3.43Å; E727-R770 WeakPolarHBondContact OE1-CD 3.32Å; E727-R770 IonicContact OE1-CZ 3.98Å; E727-R770 IonicContact OE1-NH1 3.52Å; E727-R770 PolarHBondContact OE1-NH1 3.34Å
728	V	88.6	Confident	90.6	Very high	73 Å²	73	59 Å²	59	44%	0.442	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	-54.1	-168.4	-175.4	0	0	0	0	111.7	Y724 F738	Y724-V728 HydrophobicContact CD2-CB 3.76Å; Y724-V728 HydrophobicContact CD2-CG1 4.15Å; Y724-V728 HydrophobicContact CD2-CG2 3.76Å; Y724-V728 HydrophobicContact CE2-CB 3.69Å; Y724-V728 HydrophobicContact CE2-CG1 3.55Å; Y724-V728 HydrophobicContact CE2-CG2 4.01Å; Y724-V728 HydrophobicContact CG-CB 4.29Å; Y724-V728 WeakPolarHBondContact O-CB 3.34Å; Y724-V728 PolarHBondContact O-N 2.98Å; V728-F738 HydrophobicContact CG2-CE2 4.32Å; V728-F738 HydrophobicContact CG2-CZ 4.34Å
729	R	88.4	Confident	90.7	Very high	115 Å²	115	57.4 Å²	57.4	43%	0.434	29%	0.288	S	S	.	.			trans	-156.9	137.2	-175	-174.1	-179.2	174.1	161.1	1.4	110.5	Y724 K725 D731	Y724-R729 HydrophobicContact CE1-CB 4.26Å; Y724-R729 PolarHBondContact O-N 3.16Å; Y724-R729 VanDerWaalsContact O-N 3.16Å; K725-R729 CarbonylContact C-O 3.48Å; K725-R729 WeakPolarHBondContact CA-O 3.26Å; K725-R729 CarbonylContact O-C 3.49Å; K725-R729 VanDerWaalsContact O-O 3.06Å; R729-D731 PolarHBondContact O-N 2.99Å
730	N	89.3	Confident	90.6	Very high	127 Å²	127	58.1 Å²	58.1	68%	0.679	29%	0.291	S	S	*	.	S	Bend	trans	-60.6	-11	179.2	-70.5	-22	0	0	0	115.5	K725	K725-N730 WeakPolarHBondContact CE-O 3.39Å; K725-N730 VanDerWaalsContact CG-O 3.31Å; K725-N730 WeakPolarHBondContact CG-O 3.44Å
731	D	89.8	Confident	90.6	Very high	89 Å²	89	58 Å²	58	48%	0.476	29%	0.292	S	S	.	.	S	Bend	trans	-119.6	161.2	177	-56.3	-38.1	0	0	0	110.4	Y724 R729 V733	Y724-D731 WeakPolarHBondContact CE1-O 3.39Å; R729-D731 PolarHBondContact O-N 2.99Å; D731-V733 HydrophobicContact CB-CG2 4.28Å; D731-V733 PolarHBondContact O-N 3.35Å
732	L	89.6	Confident	90.6	Very high	37 Å²	37	62.5 Å²	62.5	19%	0.194	31%	0.308	C	S	.	.			trans	-79.8	7.2	177.4	-67.2	171.3	0	0	0	114.3	Y306 V307 P308 E721 G734 F735	Y306-L732 HydrophobicContact CE2-CD1 4.06Å; V307-L732 HydrophobicContact CB-CB 4.26Å; P308-L732 HydrophobicContact CG-CB 4.17Å; P308-L732 HydrophobicContact CG-CD1 4.28Å; E721-L732 HydrophobicContact CB-CD2 3.9Å; E721-L732 HydrophobicContact CG-CD2 4Å; L732-G734 PolarHBondContact O-N 2.96Å; L732-F735 WeakPolarHBondContact O-CB 3.39Å; L732-F735 PolarHBondContact O-N 3.43Å
733	V	91.7	Very high	90.5	Very high	50 Å²	50	59 Å²	59	30%	0.303	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	120	-179.1	179.5	0	0	0	0	110.2	V307 E311 Y724 D731	V307-V733 HydrophobicContact CG1-CB 4.49Å; V307-V733 HydrophobicContact CG1-CG2 3.98Å; E311-V733 WeakPolarHBondContact OE1-CA 3.43Å; Y724-V733 PolarHBondContact OH-O 2.94Å; D731-V733 HydrophobicContact CB-CG2 4.28Å; D731-V733 PolarHBondContact O-N 3.35Å
734	G	90.4	Very high	90.4	Very high	17 Å²	17	58.9 Å²	58.9	18%	0.175	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.3	0	-176.5	0	0	0	0	0	114.1	E311 L732 T736 N737 F738	E311-G734 PolarHBondContact OE1-N 3.47Å; E311-G734 PolarHBondContact OE2-N 3.25Å; L732-G734 PolarHBondContact O-N 2.96Å; G734-T736 VanDerWaalsContact C-N 3.34Å; G734-T736 PolarHBondContact O-N 2.65Å; G734-N737 PolarHBondContact O-N 3.01Å; G734-F738 PolarHBondContact O-N 3.36Å; G734-F738 VanDerWaalsContact O-N 3.08Å
735	F	91.3	Very high	90	Very high	15 Å²	15	62.9 Å²	62.9	7%	0.066	32%	0.319	C	S	.	.	H	α-helix	trans	-59.4	-43.5	-179.6	177.6	-106.8	0	0	0	112.1	P308 P720 E721 Y724 L732 N737 F738 T739	P308-F735 HydrophobicContact CB-CD1 3.99Å; P308-F735 HydrophobicContact CG-CB 4.46Å; P308-F735 HydrophobicContact CG-CD1 3.87Å; P720-F735 HydrophobicContact CB-CE2 4.28Å; P720-F735 HydrophobicContact CB-CZ 4.08Å; E721-F735 HydrophobicContact CB-CZ 4.46Å; E721-F735 HydrophobicContact CG-CD1 4.29Å; E721-F735 HydrophobicContact CG-CE1 3.69Å; E721-F735 HydrophobicContact CG-CE2 3.95Å; E721-F735 HydrophobicContact CG-CZ 3.49Å; E721-F735 VanDerWaalsContact CG-CZ 3.49Å; Y724-F735 HydrophobicContact CD1-CB 4.2Å; Y724-F735 AromaticContact CD1-CD2 3.95Å; Y724-F735 HydrophobicContact CD1-CD2 3.95Å; Y724-F735 HydrophobicContact CD2-CD2 4.05Å; Y724-F735 HydrophobicContact CE1-CB 4.12Å; Y724-F735 AromaticContact CG-CD2 3.64Å; Y724-F735 HydrophobicContact CG-CD2 3.64Å; Y724-F735 HydrophobicContact CG-CE2 4.38Å; L732-F735 WeakPolarHBondContact O-CB 3.39Å; L732-F735 PolarHBondContact O-N 3.43Å; F735-N737 VanDerWaalsContact C-N 3.31Å; F735-N737 PolarHBondContact O-N 3.1Å; F735-F738 WeakPolarHBondContact O-CB 3.49Å; F735-F738 PolarHBondContact O-N 3.02Å; F735-F738 VanDerWaalsContact O-N 3.11Å; F735-T739 HydrophobicContact CD1-CG2 4.19Å; F735-T739 HydrophobicContact CD2-CG2 4.07Å; F735-T739 HydrophobicContact CE1-CG2 3.78Å; F735-T739 HydrophobicContact CE2-CG2 3.64Å; F735-T739 HydrophobicContact CG-CG2 4.34Å; F735-T739 HydrophobicContact CZ-CG2 3.48Å; F735-T739 VanDerWaalsContact CZ-CG2 3.48Å; F735-T739 WeakPolarHBondContact O-CG2 3.21Å; F735-T739 PolarHBondContact O-N 2.03Å; F735-T739 PolarHBondContact O-OG1 2.64Å
736	T	88.8	Confident	89.6	Confident	13 Å²	13	65.7 Å²	65.7	8%	0.08	34%	0.34	C	S	.	.	H	α-helix	trans	-57.1	-46.5	178.8	54.9	0	0	0	0	111.7	P308 E311 A312 G734 F738 T739 L740	P308-T736 HydrophobicContact CB-CG2 4.08Å; P308-T736 WeakPolarHBondContact O-CG2 3.48Å; E311-T736 HydrophobicContact CB-CG2 3.75Å; E311-T736 WeakPolarHBondContact CB-OG1 3.47Å; E311-T736 PolarHBondContact OE2-N 2.97Å; E311-T736 PolarHBondContact OE2-OG1 2.76Å; A312-T736 HydrophobicContact CB-CG2 4.22Å; G734-T736 VanDerWaalsContact C-N 3.34Å; G734-T736 PolarHBondContact O-N 2.65Å; T736-F738 VanDerWaalsContact C-N 3.32Å; T736-F738 PolarHBondContact O-N 3.42Å; T736-T739 PolarHBondContact O-N 2.66Å; T736-T739 PolarHBondContact O-OG1 3.29Å; T736-L740 VanDerWaalsContact O-CG 3.3Å; T736-L740 WeakPolarHBondContact O-CG 3.31Å
737	N	90	Very high	89.3	Confident	70 Å²	70	60.5 Å²	60.5	37%	0.374	32%	0.319	S	S	.	.	H	α-helix	trans	-63.1	-38.7	178.2	-168.6	26.7	0	0	0	112.1	G734 F735 R753	G734-N737 PolarHBondContact O-N 3.01Å; F735-N737 VanDerWaalsContact C-N 3.31Å; F735-N737 PolarHBondContact O-N 3.1Å; N737-R753 PolarHBondContact OD1-NH1 2.99Å; N737-R753 PolarHBondContact OD1-NH2 3.22Å
738	F	90.4	Very high	89	Confident	80 Å²	80	58.4 Å²	58.4	35%	0.351	31%	0.312	S	S	.	.	H	α-helix	trans	-69.4	-36.3	179.9	-177.5	-94.9	0	0	0	112.9	Y724 V728 G734 F735 T736 L740 F757 F767	Y724-F738 HydrophobicContact CD2-CB 4.21Å; Y724-F738 AromaticContact CD2-CD1 3.7Å; Y724-F738 HydrophobicContact CD2-CD1 3.7Å; Y724-F738 HydrophobicContact CD2-CD2 4.46Å; Y724-F738 HydrophobicContact CD2-CE1 4.18Å; Y724-F738 AromaticContact CD2-CG 3.86Å; Y724-F738 HydrophobicContact CD2-CG 3.86Å; Y724-F738 HydrophobicContact CE2-CB 3.69Å; Y724-F738 AromaticContact CE2-CD1 4Å; Y724-F738 HydrophobicContact CE2-CD1 4Å; Y724-F738 HydrophobicContact CE2-CD2 4.09Å; Y724-F738 AromaticContact CE2-CG 3.65Å; Y724-F738 HydrophobicContact CE2-CG 3.65Å; V728-F738 HydrophobicContact CG2-CE2 4.32Å; V728-F738 HydrophobicContact CG2-CZ 4.34Å; G734-F738 PolarHBondContact O-N 3.36Å; G734-F738 VanDerWaalsContact O-N 3.08Å; F735-F738 WeakPolarHBondContact O-CB 3.49Å; F735-F738 PolarHBondContact O-N 3.02Å; F735-F738 VanDerWaalsContact O-N 3.11Å; T736-F738 VanDerWaalsContact C-N 3.32Å; T736-F738 PolarHBondContact O-N 3.42Å; F738-L740 VanDerWaalsContact C-N 3.26Å; F738-L740 PolarHBondContact O-N 2.85Å; F738-F757 HydrophobicContact CD1-CE1 4.35Å; F738-F757 HydrophobicContact CE1-CD1 4.39Å; F738-F757 HydrophobicContact CE1-CE1 4.16Å; F738-F767 AromaticContact CE1-CD1 3.89Å; F738-F767 HydrophobicContact CE1-CD1 3.89Å; F738-F767 AromaticContact CE1-CD2 3.8Å; F738-F767 HydrophobicContact CE1-CD2 3.8Å; F738-F767 AromaticContact CE1-CE1 3.72Å; F738-F767 HydrophobicContact CE1-CE1 3.72Å; F738-F767 AromaticContact CE1-CE2 3.6Å; F738-F767 HydrophobicContact CE1-CE2 3.6Å; F738-F767 AromaticContact CE1-CG 3.94Å; F738-F767 HydrophobicContact CE1-CG 3.94Å; F738-F767 AromaticContact CE1-CZ 3.58Å; F738-F767 HydrophobicContact CE1-CZ 3.58Å; F738-F767 HydrophobicContact CZ-CB 4.44Å; F738-F767 HydrophobicContact CZ-CD1 4.22Å; F738-F767 AromaticContact CZ-CD2 3.57Å; F738-F767 HydrophobicContact CZ-CD2 3.57Å; F738-F767 HydrophobicContact CZ-CE1 4.42Å; F738-F767 AromaticContact CZ-CE2 3.77Å; F738-F767 HydrophobicContact CZ-CE2 3.77Å; F738-F767 AromaticContact CZ-CG 3.81Å; F738-F767 HydrophobicContact CZ-CG 3.81Å; F738-F767 HydrophobicContact CZ-CZ 4.22Å
739	T	90.3	Very high	88.7	Confident	16 Å²	16	59.5 Å²	59.5	10%	0.098	32%	0.323	C	S	.	.	H	α-helix	trans	-75.4	-10.4	-180	59.8	0	0	0	0	114.8	F735 T736 A756 F757	F735-T739 HydrophobicContact CD1-CG2 4.19Å; F735-T739 HydrophobicContact CD2-CG2 4.07Å; F735-T739 HydrophobicContact CE1-CG2 3.78Å; F735-T739 HydrophobicContact CE2-CG2 3.64Å; F735-T739 HydrophobicContact CG-CG2 4.34Å; F735-T739 HydrophobicContact CZ-CG2 3.48Å; F735-T739 VanDerWaalsContact CZ-CG2 3.48Å; F735-T739 WeakPolarHBondContact O-CG2 3.21Å; F735-T739 PolarHBondContact O-N 2.03Å; F735-T739 PolarHBondContact O-OG1 2.64Å; T736-T739 PolarHBondContact O-N 2.66Å; T736-T739 PolarHBondContact O-OG1 3.29Å; T739-A756 PolarHBondContact O-N 3.24Å; T739-F757 HydrophobicContact CG2-CE1 4.11Å; T739-F757 HydrophobicContact CG2-CZ 4.2Å
740	L	90.3	Very high	88.7	Confident	18 Å²	18	58 Å²	58	9%	0.094	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	114.1	-177	-65.7	173.8	0	0	0	110.8	M319 L334 T736 F738 R753 K755	M319-L740 HydrophobicContact CE-CD2 3.66Å; M319-L740 HydrophobicContact SD-CD1 4.38Å; M319-L740 HydrophobicContact SD-CD2 3.95Å; L334-L740 HydrophobicContact CD2-CD1 4.2Å; T736-L740 VanDerWaalsContact O-CG 3.3Å; T736-L740 WeakPolarHBondContact O-CG 3.31Å; F738-L740 VanDerWaalsContact C-N 3.26Å; F738-L740 PolarHBondContact O-N 2.85Å; L740-R753 HydrophobicContact CB-CB 4.32Å; L740-K755 HydrophobicContact CD2-CB 4.37Å
741	A	91	Very high	88.7	Confident	7 Å²	7	56.9 Å²	56.9	6%	0.058	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	151.7	172.8	0	0	0	0	0	111.3	R753 Y754 A756 R758	A741-R753 VanDerWaalsContact O-CA 3.29Å; A741-R753 WeakPolarHBondContact O-CA 3.3Å; A741-Y754 HydrophobicContact CB-CD1 4.43Å; A741-Y754 HydrophobicContact CB-CE1 3.92Å; A741-Y754 PolarHBondContact N-O 3.16Å; A741-Y754 WeakPolarHBondContact O-CD1 3.07Å; A741-Y754 PolarHBondContact O-N 3.29Å; A741-A756 HydrophobicContact CB-CB 4.44Å; A741-A756 WeakPolarHBondContact CB-O 3.33Å; A741-R758 HydrophobicContact CB-CB 4.41Å; A741-R758 WeakPolarHBondContact CB-O 3.37Å
742	W	91.1	Very high	88.7	Confident	115 Å²	115	52.7 Å²	52.7	44%	0.436	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	141.1	169.4	-71.7	105.6	0	0	0	110.8	P751 R753 Y754	W742-P751 HydrophobicContact CZ3-CB 4.21Å; W742-R753 HydrophobicContact CD2-CG 3.99Å; W742-R753 VanDerWaalsContact CE2-NE 3.25Å; W742-R753 VanDerWaalsContact CE2-NH2 3.29Å; W742-R753 HydrophobicContact CE3-CG 3.72Å; W742-R753 HydrophobicContact CH2-CG 4.37Å; W742-R753 HydrophobicContact CZ3-CG 3.92Å; W742-Y754 WeakPolarHBondContact O-CE1 3.41Å
743	A	90.6	Very high	88.8	Confident	14 Å²	14	52.5 Å²	52.5	12%	0.116	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-61.5	138.3	167.5	0	0	0	0	0	110	P544 T748 C752	P544-A743 HydrophobicContact CB-CB 4.06Å; P544-A743 HydrophobicContact CG-CB 4.28Å; A743-T748 HydrophobicContact CB-CG2 4.12Å; A743-C752 PolarHBondContact N-O 2.87Å
744	P	90.2	Very high	88.7	Confident	11 Å²	11	51.4 Å²	51.4	7%	0.071	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-57.3	144.6	178.3	-24.6	34	0	0	0	111.9	Y543 T747 N760	Y543-P744 HydrophobicContact CD2-CG 3.75Å; Y543-P744 HydrophobicContact CE2-CG 3.96Å; P744-T747 HydrophobicContact CB-CG2 3.94Å; P744-T747 PolarHBondContact O-N 2.93Å; P744-T747 PolarHBondContact O-OG1 3.27Å; P744-N760 WeakPolarHBondContact CA-O 3.14Å
745	P	85.6	Confident	88.6	Confident	98 Å²	98	58 Å²	58	64%	0.636	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	144.1	-177	24.4	-33.3	0	0	0	111.2	T747	P745-T747 VanDerWaalsContact C-N 3.25Å; P745-T747 PolarHBondContact O-N 2.93Å
746	N	83.5	Confident	88.4	Confident	171 Å²	171	58.3 Å²	58.3	91%	0.914	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	7.5	-179.2	-55.2	-24	0	0	0	116.8
747	T	83.8	Confident	88.4	Confident	53 Å²	53	59.2 Å²	59.2	33%	0.325	32%	0.318	S	S	.	.	S	Bend	trans	-89.8	-27	176.3	60.8	0	0	0	0	114	P544 P744 P745	P544-T747 WeakPolarHBondContact O-CB 3.33Å; P544-T747 PolarHBondContact O-OG1 3.33Å; P744-T747 HydrophobicContact CB-CG2 3.94Å; P744-T747 PolarHBondContact O-N 2.93Å; P744-T747 PolarHBondContact O-OG1 3.27Å; P745-T747 VanDerWaalsContact C-N 3.25Å; P745-T747 PolarHBondContact O-N 2.93Å
748	T	83.6	Confident	88.4	Confident	38 Å²	38	57.6 Å²	57.6	23%	0.233	31%	0.306	C	S	.	.	S	Bend	trans	-124.5	155	-176.2	57.6	0	0	0	0	111.1	P544 A743 Q750	P544-T748 HydrophobicContact CB-CG2 3.78Å; A743-T748 HydrophobicContact CB-CG2 4.12Å; T748-Q750 VanDerWaalsContact C-N 3.27Å; T748-Q750 PolarHBondContact O-N 3.48Å; T748-Q750 PolarHBondContact OG1-O 2.86Å
749	S	83.9	Confident	88.3	Confident	96 Å²	96	58 Å²	58	67%	0.671	31%	0.312	S	S	*	.	S	Bend	trans	-67	-26.8	-178.4	61.6	0	0	0	0	114	Y331	Y331-S749 WeakPolarHBondContact CE2-OG 3.36Å; Y331-S749 PolarHBondContact OH-N 3.38Å; Y331-S749 VanDerWaalsContact OH-N 3.14Å; Y331-S749 PolarHBondContact OH-OG 2.81Å
750	Q	86.7	Confident	88.2	Confident	82 Å²	82	61.3 Å²	61.3	38%	0.383	33%	0.329	S	S	.	.	S	Bend	trans	-139.4	154.2	171.8	60.2	177.3	11.1	0	0	109.8	Y331 T748 C752	Y331-Q750 HydrophobicContact CD1-CG 3.85Å; Y331-Q750 HydrophobicContact CD2-CG 3.91Å; Y331-Q750 HydrophobicContact CE1-CG 3.53Å; Y331-Q750 HydrophobicContact CE2-CG 3.59Å; Y331-Q750 HydrophobicContact CG-CG 4.05Å; Y331-Q750 PolarHBondContact OH-N 3.17Å; T748-Q750 VanDerWaalsContact C-N 3.27Å; T748-Q750 PolarHBondContact O-N 3.48Å; T748-Q750 PolarHBondContact OG1-O 2.86Å; Q750-C752 PolarHBondContact O-N 3.39Å
751	P	89.5	Confident	87.9	Confident	104 Å²	104	66 Å²	66	68%	0.675	35%	0.354	S	S	*	.			trans	-62.3	124.3	176.9	25.9	-34.5	0	0	0	109.9	W742	W742-P751 HydrophobicContact CZ3-CB 4.21Å
752	C	91.5	Very high	87.5	Confident	1 Å²	1	66 Å²	66	1%	0.007	36%	0.355	C	S	.	.			trans	-137.8	159.6	-179.3	65.2	0	0	0	0	110.5	C320 Y331 A743 Q750	C320-C752 WeakPolarHBondContact CA-SG 3.45Å; C320-C752 HydrophobicContact CB-CB 3.97Å; C320-C752 WeakPolarHBondContact CB-SG 3.34Å; C320-C752 WeakPolarHBondContact SG-CB 3.43Å; C320-C752 CovalentContact SG-SG 2.04Å; C320-C752 PolarHBondContact SG-SG 2.9Å; Y331-C752 HydrophobicContact CD1-CB 3.77Å; Y331-C752 HydrophobicContact CE1-CB 3.71Å; A743-C752 PolarHBondContact N-O 2.87Å; Q750-C752 PolarHBondContact O-N 3.39Å
753	R	91.5	Very high	87.4	Confident	33 Å²	33	67.2 Å²	67.2	13%	0.125	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	154	177	-68.5	-173.8	165	-160.2	-6.1	112.2	V318 M319 C320 N737 L740 A741 W742	V318-R753 PolarHBondContact O-N 3.2Å; M319-R753 CarbonylContact C-O 3.41Å; M319-R753 VanDerWaalsContact CA-O 3.31Å; M319-R753 WeakPolarHBondContact CA-O 3.49Å; M319-R753 HydrophobicContact SD-CB 4.21Å; C320-R753 PolarHBondContact N-O 3.38Å; C320-R753 PolarHBondContact SG-O 3.47Å; C320-R753 VanDerWaalsContact SG-O 3.39Å; N737-R753 PolarHBondContact OD1-NH1 2.99Å; N737-R753 PolarHBondContact OD1-NH2 3.22Å; L740-R753 HydrophobicContact CB-CB 4.32Å; A741-R753 VanDerWaalsContact O-CA 3.29Å; A741-R753 WeakPolarHBondContact O-CA 3.3Å; W742-R753 HydrophobicContact CD2-CG 3.99Å; W742-R753 VanDerWaalsContact CE2-NE 3.25Å; W742-R753 VanDerWaalsContact CE2-NH2 3.29Å; W742-R753 HydrophobicContact CE3-CG 3.72Å; W742-R753 HydrophobicContact CH2-CG 4.37Å; W742-R753 HydrophobicContact CZ3-CG 3.92Å
754	Y	88.8	Confident	87.3	Confident	28 Å²	28	71.4 Å²	71.4	11%	0.11	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	153.6	174.7	71.2	-73.7	0	0	0	110.3	P544 A741 W742 A756 R758	P544-Y754 HydrophobicContact CG-CD1 3.94Å; P544-Y754 HydrophobicContact CG-CE1 4.31Å; P544-Y754 HydrophobicContact CG-CG 4.12Å; A741-Y754 HydrophobicContact CB-CD1 4.43Å; A741-Y754 HydrophobicContact CB-CE1 3.92Å; A741-Y754 PolarHBondContact N-O 3.16Å; A741-Y754 WeakPolarHBondContact O-CD1 3.07Å; A741-Y754 PolarHBondContact O-N 3.29Å; W742-Y754 WeakPolarHBondContact O-CE1 3.41Å; Y754-A756 HydrophobicContact CD2-CB 3.76Å; Y754-A756 HydrophobicContact CE2-CB 3.3Å; Y754-A756 PolarHBondContact O-N 2.98Å; Y754-A756 VanDerWaalsContact O-N 3.15Å; Y754-R758 VanDerWaalsContact OH-CD 3.26Å; Y754-R758 WeakPolarHBondContact OH-CD 3.04Å
755	K	87.6	Confident	87.3	Confident	156 Å²	156	72.5 Å²	72.5	68%	0.678	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.3	102.1	-178.4	-173.9	176.7	-179	175	0	110.2	L740	L740-K755 HydrophobicContact CD2-CB 4.37Å
756	A	87.4	Confident	87.6	Confident	21 Å²	21	74.1 Å²	74.1	17%	0.174	39%	0.388	C	S	.	.	S	Bend	trans	-162.6	156	172.8	0	0	0	0	0	110.1	T739 A741 Y754 R758	T739-A756 PolarHBondContact O-N 3.24Å; A741-A756 HydrophobicContact CB-CB 4.44Å; A741-A756 WeakPolarHBondContact CB-O 3.33Å; Y754-A756 HydrophobicContact CD2-CB 3.76Å; Y754-A756 HydrophobicContact CE2-CB 3.3Å; Y754-A756 PolarHBondContact O-N 2.98Å; Y754-A756 VanDerWaalsContact O-N 3.15Å; A756-R758 VanDerWaalsContact C-N 3.33Å; A756-R758 HydrophobicContact CB-CG 4.32Å; A756-R758 PolarHBondContact O-N 3.47Å
757	F	89.3	Confident	88	Confident	32 Å²	32	66.9 Å²	66.9	14%	0.14	35%	0.348	C	S	.	.	S	Bend	trans	-94.9	60.5	173	-61.5	-69	0	0	0	110.7	P720 F738 T739 S765 F767 F768 L771	P720-F757 HydrophobicContact CB-CZ 4.28Å; F738-F757 HydrophobicContact CD1-CE1 4.35Å; F738-F757 HydrophobicContact CE1-CD1 4.39Å; F738-F757 HydrophobicContact CE1-CE1 4.16Å; T739-F757 HydrophobicContact CG2-CE1 4.11Å; T739-F757 HydrophobicContact CG2-CZ 4.2Å; F757-S765 PolarHBondContact O-N 3.46Å; F757-S765 PolarHBondContact O-OG 3.49Å; F757-F767 HydrophobicContact CB-CD1 4.49Å; F757-F767 AromaticContact CD1-CD1 3.53Å; F757-F767 HydrophobicContact CD1-CD1 3.53Å; F757-F767 AromaticContact CD1-CE1 3.73Å; F757-F767 HydrophobicContact CD1-CE1 3.73Å; F757-F767 AromaticContact CE1-CD1 3.79Å; F757-F767 HydrophobicContact CE1-CD1 3.79Å; F757-F767 AromaticContact CE1-CE1 3.46Å; F757-F767 HydrophobicContact CE1-CE1 3.46Å; F757-F767 VanDerWaalsContact CE1-CE1 3.46Å; F757-F767 HydrophobicContact CE1-CZ 4.47Å; F757-F767 HydrophobicContact CE2-CE1 4.47Å; F757-F767 AromaticContact CG-CD1 3.96Å; F757-F767 HydrophobicContact CG-CD1 3.96Å; F757-F767 HydrophobicContact CG-CE1 4.35Å; F757-F767 HydrophobicContact CZ-CD1 4.43Å; F757-F767 AromaticContact CZ-CE1 3.87Å; F757-F767 HydrophobicContact CZ-CE1 3.87Å; F757-F768 HydrophobicContact CB-CB 3.82Å; F757-F768 HydrophobicContact CB-CD2 4.26Å; F757-F768 HydrophobicContact CD2-CD2 4.45Å; F757-L771 HydrophobicContact CD2-CD2 3.83Å; F757-L771 HydrophobicContact CE2-CD2 3.37Å; F757-L771 HydrophobicContact CZ-CD2 3.98Å
758	R	90.8	Very high	88.4	Confident	36 Å²	36	66.3 Å²	66.3	14%	0.136	34%	0.341	C	S	.	.	B	Isolated β-bridge	trans	-117.8	150	-178.6	-74.2	176.8	173.1	154.1	0.2	111.4	G542 A741 Y754 A756 G762 E763 Y764	G542-R758 PolarHBondContact O-NH1 2.97Å; A741-R758 HydrophobicContact CB-CB 4.41Å; A741-R758 WeakPolarHBondContact CB-O 3.37Å; Y754-R758 VanDerWaalsContact OH-CD 3.26Å; Y754-R758 WeakPolarHBondContact OH-CD 3.04Å; A756-R758 VanDerWaalsContact C-N 3.33Å; A756-R758 HydrophobicContact CB-CG 4.32Å; A756-R758 PolarHBondContact O-N 3.47Å; R758-G762 VanDerWaalsContact CD-O 3.28Å; R758-G762 WeakPolarHBondContact CD-O 3.22Å; R758-E763 CarbonylContact C-O 3.58Å; R758-E763 WeakPolarHBondContact CA-O 3.3Å; R758-E763 WeakPolarHBondContact CB-O 3.29Å; R758-Y764 HydrophobicContact CG-CD1 3.77Å; R758-Y764 HydrophobicContact CG-CE1 4.1Å; R758-Y764 HydrophobicContact CG-CG 4.48Å; R758-Y764 VanDerWaalsContact NH2-CZ 3.32Å; R758-Y764 PolarHBondContact NH2-OH 3.17Å
759	D	87.9	Confident	88.9	Confident	89 Å²	89	71.8 Å²	71.8	48%	0.476	36%	0.358	S	S	.	.			trans	-77.9	172.1	172	-161.8	7.8	0	0	0	111	N761 G762 E763	D759-N761 PolarHBondContact O-N 3.35Å; D759-N761 VanDerWaalsContact O-N 3.09Å; D759-G762 PolarHBondContact O-N 3.11Å; D759-E763 PolarHBondContact N-O 2.73Å
760	N	86.9	Confident	89.4	Confident	85 Å²	85	73 Å²	73	46%	0.455	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-22.7	-179.2	-68	-26.9	0	0	0	113.4	P744 G762	P744-N760 WeakPolarHBondContact CA-O 3.14Å; N760-G762 VanDerWaalsContact C-N 3.3Å
761	N	84.6	Confident	89.8	Confident	116 Å²	116	69 Å²	69	62%	0.62	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-4.5	176	-64	-15.5	0	0	0	113.3	D759 E763	D759-N761 PolarHBondContact O-N 3.35Å; D759-N761 VanDerWaalsContact O-N 3.09Å; N761-E763 VanDerWaalsContact C-N 3.34Å
762	G	82.4	Confident	89.9	Confident	8 Å²	8	66.2 Å²	66.2	8%	0.082	31%	0.308	C	S	.	.	S	Bend	trans	85.9	-1.5	-176.8	0	0	0	0	0	114.8	R758 D759 N760	R758-G762 VanDerWaalsContact CD-O 3.28Å; R758-G762 WeakPolarHBondContact CD-O 3.22Å; D759-G762 PolarHBondContact O-N 3.11Å; N760-G762 VanDerWaalsContact C-N 3.3Å
763	E	89.3	Confident	90.1	Very high	140 Å²	140	69.1 Å²	69.1	65%	0.654	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-76.7	150.3	174.6	-63.1	-172.7	168.3	0	0	111.7	R758 D759 N761 S765	R758-E763 CarbonylContact C-O 3.58Å; R758-E763 WeakPolarHBondContact CA-O 3.3Å; R758-E763 WeakPolarHBondContact CB-O 3.29Å; D759-E763 PolarHBondContact N-O 2.73Å; N761-E763 VanDerWaalsContact C-N 3.34Å; E763-S765 PolarHBondContact O-N 2.7Å
764	Y	89.6	Confident	90.3	Very high	101 Å²	101	70.5 Å²	70.5	40%	0.396	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-69.7	130.1	176.7	-70.6	-66.5	0	0	0	111.3	R758 F768	R758-Y764 HydrophobicContact CG-CD1 3.77Å; R758-Y764 HydrophobicContact CG-CE1 4.1Å; R758-Y764 HydrophobicContact CG-CG 4.48Å; R758-Y764 VanDerWaalsContact NH2-CZ 3.32Å; R758-Y764 PolarHBondContact NH2-OH 3.17Å; Y764-F768 HydrophobicContact CD1-CB 4.34Å; Y764-F768 AromaticContact CD1-CD1 3.7Å; Y764-F768 HydrophobicContact CD1-CD1 3.7Å; Y764-F768 AromaticContact CD1-CD2 3.93Å; Y764-F768 HydrophobicContact CD1-CD2 3.93Å; Y764-F768 AromaticContact CD1-CE1 3.91Å; Y764-F768 HydrophobicContact CD1-CE1 3.91Å; Y764-F768 HydrophobicContact CD1-CE2 4.13Å; Y764-F768 AromaticContact CD1-CG 3.7Å; Y764-F768 HydrophobicContact CD1-CG 3.7Å; Y764-F768 HydrophobicContact CD1-CZ 4.12Å; Y764-F768 HydrophobicContact CD2-CD1 4.42Å; Y764-F768 HydrophobicContact CD2-CE1 4.3Å; Y764-F768 HydrophobicContact CE1-CD1 4.36Å; Y764-F768 HydrophobicContact CE1-CD2 4.23Å; Y764-F768 HydrophobicContact CE1-CE1 4.15Å; Y764-F768 AromaticContact CE1-CE2 4Å; Y764-F768 HydrophobicContact CE1-CE2 4Å; Y764-F768 HydrophobicContact CE1-CG 4.4Å; Y764-F768 AromaticContact CE1-CZ 3.96Å; Y764-F768 HydrophobicContact CE1-CZ 3.96Å; Y764-F768 HydrophobicContact CE2-CE1 4.49Å; Y764-F768 AromaticContact CG-CD1 3.73Å; Y764-F768 HydrophobicContact CG-CD1 3.73Å; Y764-F768 AromaticContact CG-CE1 3.99Å; Y764-F768 HydrophobicContact CG-CE1 3.99Å; Y764-F768 HydrophobicContact CG-CG 4.14Å
765	S	90.3	Very high	90.6	Very high	34 Å²	34	70.6 Å²	70.6	24%	0.238	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-67.3	159.2	176.3	63.9	0	0	0	0	112.2	F757 E763 F767 F768	F757-S765 PolarHBondContact O-N 3.46Å; F757-S765 PolarHBondContact O-OG 3.49Å; E763-S765 PolarHBondContact O-N 2.7Å; S765-F767 PolarHBondContact O-N 3.11Å; S765-F768 VanDerWaalsContact O-CB 3.3Å; S765-F768 WeakPolarHBondContact O-CB 3.39Å; S765-F768 PolarHBondContact O-N 2.86Å; S765-F768 PolarHBondContact OG-N 3.28Å
766	M	91.4	Very high	91	Very high	133 Å²	133	67.3 Å²	67.3	66%	0.655	33%	0.331	S	S	*	.	H	α-helix	trans	-58.7	-31.5	172.4	-167.9	179.7	-164.7	0	0	112.2	F768 W769 R770	M766-F768 VanDerWaalsContact C-N 3.3Å; M766-F768 PolarHBondContact O-N 3.11Å; M766-W769 PolarHBondContact O-N 3.08Å; M766-R770 PolarHBondContact O-N 3.43Å; M766-R770 VanDerWaalsContact O-N 3.09Å
767	F	91.7	Very high	91.4	Very high	19 Å²	19	68.6 Å²	68.6	8%	0.083	34%	0.342	C	S	.	.	H	α-helix	trans	-59	-40.1	174.2	-173.5	-85.6	0	0	0	111.7	M723 F738 F757 S765 W769 R770 L771	M723-F767 HydrophobicContact CB-CZ 4.37Å; M723-F767 HydrophobicContact CE-CD1 4.05Å; M723-F767 HydrophobicContact CE-CD2 3.4Å; M723-F767 HydrophobicContact CE-CE1 4.03Å; M723-F767 HydrophobicContact CE-CE2 3.4Å; M723-F767 HydrophobicContact CE-CG 3.74Å; M723-F767 HydrophobicContact CE-CZ 3.71Å; M723-F767 WeakPolarHBondContact CE-O 3.45Å; M723-F767 HydrophobicContact CG-CE2 3.94Å; M723-F767 HydrophobicContact CG-CZ 4.03Å; M723-F767 HydrophobicContact SD-CE2 4.3Å; M723-F767 HydrophobicContact SD-CZ 4.21Å; F738-F767 AromaticContact CE1-CD1 3.89Å; F738-F767 HydrophobicContact CE1-CD1 3.89Å; F738-F767 AromaticContact CE1-CD2 3.8Å; F738-F767 HydrophobicContact CE1-CD2 3.8Å; F738-F767 AromaticContact CE1-CE1 3.72Å; F738-F767 HydrophobicContact CE1-CE1 3.72Å; F738-F767 AromaticContact CE1-CE2 3.6Å; F738-F767 HydrophobicContact CE1-CE2 3.6Å; F738-F767 AromaticContact CE1-CG 3.94Å; F738-F767 HydrophobicContact CE1-CG 3.94Å; F738-F767 AromaticContact CE1-CZ 3.58Å; F738-F767 HydrophobicContact CE1-CZ 3.58Å; F738-F767 HydrophobicContact CZ-CB 4.44Å; F738-F767 HydrophobicContact CZ-CD1 4.22Å; F738-F767 AromaticContact CZ-CD2 3.57Å; F738-F767 HydrophobicContact CZ-CD2 3.57Å; F738-F767 HydrophobicContact CZ-CE1 4.42Å; F738-F767 AromaticContact CZ-CE2 3.77Å; F738-F767 HydrophobicContact CZ-CE2 3.77Å; F738-F767 AromaticContact CZ-CG 3.81Å; F738-F767 HydrophobicContact CZ-CG 3.81Å; F738-F767 HydrophobicContact CZ-CZ 4.22Å; F757-F767 HydrophobicContact CB-CD1 4.49Å; F757-F767 AromaticContact CD1-CD1 3.53Å; F757-F767 HydrophobicContact CD1-CD1 3.53Å; F757-F767 AromaticContact CD1-CE1 3.73Å; F757-F767 HydrophobicContact CD1-CE1 3.73Å; F757-F767 AromaticContact CE1-CD1 3.79Å; F757-F767 HydrophobicContact CE1-CD1 3.79Å; F757-F767 AromaticContact CE1-CE1 3.46Å; F757-F767 HydrophobicContact CE1-CE1 3.46Å; F757-F767 VanDerWaalsContact CE1-CE1 3.46Å; F757-F767 HydrophobicContact CE1-CZ 4.47Å; F757-F767 HydrophobicContact CE2-CE1 4.47Å; F757-F767 AromaticContact CG-CD1 3.96Å; F757-F767 HydrophobicContact CG-CD1 3.96Å; F757-F767 HydrophobicContact CG-CE1 4.35Å; F757-F767 HydrophobicContact CZ-CD1 4.43Å; F757-F767 AromaticContact CZ-CE1 3.87Å; F757-F767 HydrophobicContact CZ-CE1 3.87Å; S765-F767 PolarHBondContact O-N 3.11Å; F767-W769 PolarHBondContact O-N 2.86Å; F767-R770 PolarHBondContact O-N 3.03Å; F767-L771 HydrophobicContact CE1-CB 4.47Å; F767-L771 HydrophobicContact CE1-CD2 4.25Å; F767-L771 VanDerWaalsContact O-CB 3.24Å; F767-L771 WeakPolarHBondContact O-CB 3.17Å; F767-L771 PolarHBondContact O-N 2.98Å
768	F	92	Very high	91.6	Very high	40 Å²	40	69 Å²	69	18%	0.175	34%	0.344	C	S	.	.	H	α-helix	trans	-59.5	-48.1	176.7	175.2	-98.8	0	0	0	112.2	F757 Y764 S765 M766 L771 L772	F757-F768 HydrophobicContact CB-CB 3.82Å; F757-F768 HydrophobicContact CB-CD2 4.26Å; F757-F768 HydrophobicContact CD2-CD2 4.45Å; Y764-F768 HydrophobicContact CD1-CB 4.34Å; Y764-F768 AromaticContact CD1-CD1 3.7Å; Y764-F768 HydrophobicContact CD1-CD1 3.7Å; Y764-F768 AromaticContact CD1-CD2 3.93Å; Y764-F768 HydrophobicContact CD1-CD2 3.93Å; Y764-F768 AromaticContact CD1-CE1 3.91Å; Y764-F768 HydrophobicContact CD1-CE1 3.91Å; Y764-F768 HydrophobicContact CD1-CE2 4.13Å; Y764-F768 AromaticContact CD1-CG 3.7Å; Y764-F768 HydrophobicContact CD1-CG 3.7Å; Y764-F768 HydrophobicContact CD1-CZ 4.12Å; Y764-F768 HydrophobicContact CD2-CD1 4.42Å; Y764-F768 HydrophobicContact CD2-CE1 4.3Å; Y764-F768 HydrophobicContact CE1-CD1 4.36Å; Y764-F768 HydrophobicContact CE1-CD2 4.23Å; Y764-F768 HydrophobicContact CE1-CE1 4.15Å; Y764-F768 AromaticContact CE1-CE2 4Å; Y764-F768 HydrophobicContact CE1-CE2 4Å; Y764-F768 HydrophobicContact CE1-CG 4.4Å; Y764-F768 AromaticContact CE1-CZ 3.96Å; Y764-F768 HydrophobicContact CE1-CZ 3.96Å; Y764-F768 HydrophobicContact CE2-CE1 4.49Å; Y764-F768 AromaticContact CG-CD1 3.73Å; Y764-F768 HydrophobicContact CG-CD1 3.73Å; Y764-F768 AromaticContact CG-CE1 3.99Å; Y764-F768 HydrophobicContact CG-CE1 3.99Å; Y764-F768 HydrophobicContact CG-CG 4.14Å; S765-F768 VanDerWaalsContact O-CB 3.3Å; S765-F768 WeakPolarHBondContact O-CB 3.39Å; S765-F768 PolarHBondContact O-N 2.86Å; S765-F768 PolarHBondContact OG-N 3.28Å; M766-F768 VanDerWaalsContact C-N 3.3Å; M766-F768 PolarHBondContact O-N 3.11Å; F768-L771 PolarHBondContact O-N 3.39Å; F768-L772 WeakPolarHBondContact O-CB 3.3Å; F768-L772 PolarHBondContact O-N 3.28Å
769	W	94.3	Very high	91.8	Very high	153 Å²	153	67.7 Å²	67.7	58%	0.58	34%	0.34	S	S	*	.	H	α-helix	trans	-67.1	-39.6	-178.1	-70.4	109.2	0	0	0	112.4	M766 F767 L772 A773	M766-W769 PolarHBondContact O-N 3.08Å; F767-W769 PolarHBondContact O-N 2.86Å; W769-L772 HydrophobicContact CE3-CD2 4.04Å; W769-L772 HydrophobicContact CZ3-CD2 4Å; W769-L772 PolarHBondContact O-N 2.95Å; W769-A773 PolarHBondContact O-N 3.38Å
770	R	94.9	Very high	92.1	Very high	121 Å²	121	67.9 Å²	67.9	46%	0.457	34%	0.34	S	S	.	.	H	α-helix	trans	-63.8	-42.9	172.5	-73.5	-177.2	-175.4	-176.1	5.6	112	M723 E727 M766 F767 L772 A773 L774	M723-R770 HydrophobicContact CE-CB 3.58Å; M723-R770 HydrophobicContact SD-CB 4.48Å; E727-R770 WeakPolarHBondContact OE1-CD 3.32Å; E727-R770 IonicContact OE1-CZ 3.98Å; E727-R770 IonicContact OE1-NH1 3.52Å; E727-R770 PolarHBondContact OE1-NH1 3.34Å; M766-R770 PolarHBondContact O-N 3.43Å; M766-R770 VanDerWaalsContact O-N 3.09Å; F767-R770 PolarHBondContact O-N 3.03Å; R770-L772 VanDerWaalsContact C-N 3.33Å; R770-L772 PolarHBondContact O-N 3.41Å; R770-A773 PolarHBondContact O-N 3.26Å; R770-L774 PolarHBondContact O-N 2.77Å
771	L	93.4	Very high	92.5	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-63.3	-39.9	176.1	177.3	63.8	0	0	0	111.5	L719 P720 M723 F757 F767 F768 L774 R775	L719-L771 HydrophobicContact CB-CD1 4.39Å; P720-L771 HydrophobicContact CB-CD1 4.46Å; P720-L771 HydrophobicContact CB-CD2 4.42Å; P720-L771 HydrophobicContact CG-CD1 4.1Å; P720-L771 HydrophobicContact CG-CD2 4.05Å; M723-L771 HydrophobicContact CE-CB 4.08Å; M723-L771 HydrophobicContact SD-CB 3.84Å; M723-L771 HydrophobicContact SD-CD1 4.06Å; F757-L771 HydrophobicContact CD2-CD2 3.83Å; F757-L771 HydrophobicContact CE2-CD2 3.37Å; F757-L771 HydrophobicContact CZ-CD2 3.98Å; F767-L771 HydrophobicContact CE1-CB 4.47Å; F767-L771 HydrophobicContact CE1-CD2 4.25Å; F767-L771 VanDerWaalsContact O-CB 3.24Å; F767-L771 WeakPolarHBondContact O-CB 3.17Å; F767-L771 PolarHBondContact O-N 2.98Å; F768-L771 PolarHBondContact O-N 3.39Å; L771-L774 PolarHBondContact O-N 2.78Å; L771-R775 HydrophobicContact CD1-CG 4.42Å; L771-R775 WeakPolarHBondContact O-CB 3.46Å; L771-R775 VanDerWaalsContact O-CG 3.22Å; L771-R775 WeakPolarHBondContact O-CG 3.36Å; L771-R775 PolarHBondContact O-N 2.88Å
772	L	93.5	Very high	92.8	Very high	45 Å²	45	63.4 Å²	63.4	24%	0.236	32%	0.318	C	S	.	.	H	α-helix	trans	-62.9	-44.2	175.4	-177.5	63.8	0	0	0	111.4	F714 F768 W769 R770 R775 L776	F714-L772 HydrophobicContact CE1-CD1 4.1Å; F768-L772 WeakPolarHBondContact O-CB 3.3Å; F768-L772 PolarHBondContact O-N 3.28Å; W769-L772 HydrophobicContact CE3-CD2 4.04Å; W769-L772 HydrophobicContact CZ3-CD2 4Å; W769-L772 PolarHBondContact O-N 2.95Å; R770-L772 VanDerWaalsContact C-N 3.33Å; R770-L772 PolarHBondContact O-N 3.41Å; L772-R775 WeakPolarHBondContact O-CB 3.35Å; L772-R775 PolarHBondContact O-N 2.98Å; L772-L776 HydrophobicContact CG-CD1 4.43Å; L772-L776 WeakPolarHBondContact O-CG 3.43Å; L772-L776 PolarHBondContact O-N 3.5Å
773	A	95.6	Very high	93.3	Very high	61 Å²	61	65.6 Å²	65.6	50%	0.504	33%	0.326	S	S	.	.	H	α-helix	trans	-60.8	-44.6	174.9	0	0	0	0	0	111.7	W769 R770 R775 L776 A777	W769-A773 PolarHBondContact O-N 3.38Å; R770-A773 PolarHBondContact O-N 3.26Å; A773-R775 PolarHBondContact O-N 2.92Å; A773-L776 PolarHBondContact O-N 3.07Å; A773-A777 WeakPolarHBondContact O-CB 3.4Å; A773-A777 PolarHBondContact O-N 3.42Å
774	L	95.2	Very high	93.4	Very high	63 Å²	63	64.1 Å²	64.1	33%	0.33	32%	0.319	S	S	.	.	H	α-helix	trans	-61.7	-41.5	176.1	-178.4	65	0	0	0	112.1	M723 R770 L771 A777 F778	M723-L774 HydrophobicContact CB-CD2 4.04Å; M723-L774 HydrophobicContact CG-CD2 4.48Å; M723-L774 HydrophobicContact SD-CD2 4.15Å; R770-L774 PolarHBondContact O-N 2.77Å; L771-L774 PolarHBondContact O-N 2.78Å; L774-A777 PolarHBondContact O-N 3.46Å; L774-F778 WeakPolarHBondContact O-CB 3.03Å; L774-F778 PolarHBondContact O-N 3.12Å
775	R	95	Very high	93.5	Very high	30 Å²	30	63.1 Å²	63.1	11%	0.113	32%	0.323	C	S	.	.	H	α-helix	trans	-60.2	-48.8	176.1	-78.3	171.7	164	165.3	-2.4	112.2	A713 F714 L719 L771 L772 A773 F778 V779	A713-R775 HydrophobicContact CB-CB 4.25Å; A713-R775 HydrophobicContact CB-CG 4.39Å; A713-R775 WeakPolarHBondContact O-CD 3.37Å; A713-R775 VanDerWaalsContact O-CG 3.32Å; A713-R775 WeakPolarHBondContact O-CG 3.42Å; A713-R775 PolarHBondContact O-NE 3.35Å; F714-R775 HydrophobicContact CZ-CB 4.39Å; L719-R775 HydrophobicContact CD1-CB 4.33Å; L719-R775 HydrophobicContact CD1-CG 3.76Å; L771-R775 HydrophobicContact CD1-CG 4.42Å; L771-R775 WeakPolarHBondContact O-CB 3.46Å; L771-R775 VanDerWaalsContact O-CG 3.22Å; L771-R775 WeakPolarHBondContact O-CG 3.36Å; L771-R775 PolarHBondContact O-N 2.88Å; L772-R775 WeakPolarHBondContact O-CB 3.35Å; L772-R775 PolarHBondContact O-N 2.98Å; A773-R775 PolarHBondContact O-N 2.92Å; R775-F778 PolarHBondContact O-N 2.93Å; R775-V779 WeakPolarHBondContact O-CG2 3.37Å; R775-V779 PolarHBondContact O-N 3.39Å
776	L	95.2	Very high	93.4	Very high	87 Å²	87	61.8 Å²	61.8	46%	0.455	32%	0.315	S	S	.	.	H	α-helix	trans	-65.2	-41.9	178.5	-66.8	173.6	0	0	0	111.4	F714 L772 A773 F778 V779 I780	F714-L776 HydrophobicContact CZ-CD2 4.17Å; L772-L776 HydrophobicContact CG-CD1 4.43Å; L772-L776 WeakPolarHBondContact O-CG 3.43Å; L772-L776 PolarHBondContact O-N 3.5Å; A773-L776 PolarHBondContact O-N 3.07Å; L776-F778 PolarHBondContact O-N 3.18Å; L776-V779 PolarHBondContact O-N 3.36Å; L776-I780 WeakPolarHBondContact O-CG1 3.39Å; L776-I780 PolarHBondContact O-N 3.27Å; L776-I780 VanDerWaalsContact O-N 3.11Å
777	A	95.8	Very high	93.2	Very high	48 Å²	48	57.7 Å²	57.7	40%	0.397	29%	0.293	S	S	.	.	H	α-helix	trans	-61.4	-43	175	0	0	0	0	0	111.9	A773 L774 V779 I780 V781	A773-A777 WeakPolarHBondContact O-CB 3.4Å; A773-A777 PolarHBondContact O-N 3.42Å; L774-A777 PolarHBondContact O-N 3.46Å; A777-V779 PolarHBondContact O-N 2.98Å; A777-I780 PolarHBondContact O-N 3.44Å; A777-V781 WeakPolarHBondContact O-CB 2.93Å; A777-V781 VanDerWaalsContact O-CG2 3.3Å; A777-V781 WeakPolarHBondContact O-CG2 3.35Å; A777-V781 PolarHBondContact O-N 3.18Å
778	F	94.2	Very high	93.2	Very high	40 Å²	40	61.6 Å²	61.6	18%	0.175	32%	0.318	C	S	.	.	H	α-helix	trans	-59.9	-45.1	176	175.8	-91.7	0	0	0	111.8	I712 A713 L719 L774 R775 L776 I780 V781 F782	I712-F778 HydrophobicContact CB-CE1 3.93Å; I712-F778 HydrophobicContact CB-CZ 4.34Å; I712-F778 HydrophobicContact CG2-CE1 3.58Å; I712-F778 HydrophobicContact CG2-CZ 3.63Å; A713-F778 HydrophobicContact CB-CD1 4.14Å; L719-F778 HydrophobicContact CD1-CB 3.82Å; L719-F778 HydrophobicContact CD1-CD1 4.15Å; L719-F778 HydrophobicContact CD1-CG 3.93Å; L719-F778 HydrophobicContact CD2-CB 4.27Å; L719-F778 HydrophobicContact CD2-CD2 3.96Å; L719-F778 HydrophobicContact CD2-CG 4.1Å; L774-F778 WeakPolarHBondContact O-CB 3.03Å; L774-F778 PolarHBondContact O-N 3.12Å; R775-F778 PolarHBondContact O-N 2.93Å; L776-F778 PolarHBondContact O-N 3.18Å; F778-I780 PolarHBondContact O-N 2.89Å; F778-V781 PolarHBondContact O-N 3.37Å; F778-F782 HydrophobicContact CE1-CB 4.25Å; F778-F782 HydrophobicContact CE1-CD2 4.22Å; F778-F782 HydrophobicContact CE1-CG 4.43Å; F778-F782 HydrophobicContact CZ-CB 4.38Å; F778-F782 AromaticContact CZ-CD2 3.83Å; F778-F782 HydrophobicContact CZ-CD2 3.83Å; F778-F782 HydrophobicContact CZ-CG 4.43Å; F778-F782 WeakPolarHBondContact O-CB 3.49Å; F778-F782 PolarHBondContact O-N 3.4Å
779	V	94.3	Very high	92.9	Very high	8 Å²	8	63.1 Å²	63.1	5%	0.048	33%	0.328	C	S	.	.	H	α-helix	trans	-58.9	-49	177.9	172.9	0	0	0	0	110.7	A709 F710 A713 F714 R775 L776 A777 V781 F782 E783	A709-V779 HydrophobicContact CB-CB 4.48Å; A709-V779 HydrophobicContact CB-CG1 4.13Å; A709-V779 HydrophobicContact CB-CG2 4.36Å; F710-V779 HydrophobicContact CD2-CG1 4.21Å; F710-V779 HydrophobicContact CE2-CG1 3.85Å; F710-V779 HydrophobicContact CZ-CG1 4.08Å; A713-V779 HydrophobicContact CB-CG2 3.6Å; F714-V779 HydrophobicContact CE2-CG2 4.48Å; R775-V779 WeakPolarHBondContact O-CG2 3.37Å; R775-V779 PolarHBondContact O-N 3.39Å; L776-V779 PolarHBondContact O-N 3.36Å; A777-V779 PolarHBondContact O-N 2.98Å; V779-V781 PolarHBondContact O-N 3.32Å; V779-F782 PolarHBondContact O-N 3.21Å; V779-E783 WeakPolarHBondContact O-CB 3.3Å; V779-E783 PolarHBondContact O-N 3.26Å
780	I	95.1	Very high	92.5	Very high	94 Å²	94	56.6 Å²	56.6	48%	0.482	31%	0.306	S	S	.	.	H	α-helix	trans	-59.8	-48.4	179	-66.7	166.2	0	0	0	110.7	L776 A777 F778 H784	L776-I780 WeakPolarHBondContact O-CG1 3.39Å; L776-I780 PolarHBondContact O-N 3.27Å; L776-I780 VanDerWaalsContact O-N 3.11Å; A777-I780 PolarHBondContact O-N 3.44Å; F778-I780 PolarHBondContact O-N 2.89Å; I780-H784 PolarHBondContact O-N 3.43Å; I780-H784 PolarHBondContact O-ND1 3.46Å
781	V	93.7	Very high	92.1	Very high	90 Å²	90	55.1 Å²	55.1	55%	0.545	31%	0.307	S	S	.	.	H	α-helix	trans	-64.6	-47.2	-179	172.1	0	0	0	0	111.1	A777 F778 V779 E783 H784 V785	A777-V781 WeakPolarHBondContact O-CB 2.93Å; A777-V781 VanDerWaalsContact O-CG2 3.3Å; A777-V781 WeakPolarHBondContact O-CG2 3.35Å; A777-V781 PolarHBondContact O-N 3.18Å; F778-V781 PolarHBondContact O-N 3.37Å; V779-V781 PolarHBondContact O-N 3.32Å; V781-E783 VanDerWaalsContact C-N 3.34Å; V781-E783 PolarHBondContact O-N 3.01Å; V781-H784 PolarHBondContact O-N 2.92Å; V781-V785 HydrophobicContact CG1-CG2 4.22Å; V781-V785 WeakPolarHBondContact O-CB 3.37Å; V781-V785 WeakPolarHBondContact O-CG2 3.34Å; V781-V785 PolarHBondContact O-N 2.86Å
782	F	91.7	Very high	91.9	Very high	17 Å²	17	56.8 Å²	56.8	8%	0.075	32%	0.322	C	S	.	.	H	α-helix	trans	-59.2	-47	179.4	-175.3	-81.7	0	0	0	111.1	I357 V705 A709 I712 F778 V779 A786	I357-F782 HydrophobicContact CD1-CE2 4.24Å; I357-F782 HydrophobicContact CG1-CD2 4.46Å; I357-F782 HydrophobicContact CG1-CE2 3.56Å; I357-F782 HydrophobicContact CG1-CZ 4.09Å; V705-F782 HydrophobicContact CG1-CE1 4.48Å; A709-F782 HydrophobicContact CB-CB 4.26Å; A709-F782 HydrophobicContact CB-CD1 3.56Å; A709-F782 HydrophobicContact CB-CE1 4.18Å; A709-F782 HydrophobicContact CB-CG 4.1Å; I712-F782 HydrophobicContact CD1-CE2 4.28Å; F778-F782 HydrophobicContact CE1-CB 4.25Å; F778-F782 HydrophobicContact CE1-CD2 4.22Å; F778-F782 HydrophobicContact CE1-CG 4.43Å; F778-F782 HydrophobicContact CZ-CB 4.38Å; F778-F782 AromaticContact CZ-CD2 3.83Å; F778-F782 HydrophobicContact CZ-CD2 3.83Å; F778-F782 HydrophobicContact CZ-CG 4.43Å; F778-F782 WeakPolarHBondContact O-CB 3.49Å; F778-F782 PolarHBondContact O-N 3.4Å; V779-F782 PolarHBondContact O-N 3.21Å; F782-A786 WeakPolarHBondContact O-CB 3.25Å; F782-A786 PolarHBondContact O-N 3.08Å
783	E	92.6	Very high	91.6	Very high	53 Å²	53	56.7 Å²	56.7	25%	0.248	32%	0.321	C	S	.	.	H	α-helix	trans	-59.4	-52.1	178.5	-178.3	-173.9	161.9	0	0	111.8	V779 V781 V785 A786 F787	V779-E783 WeakPolarHBondContact O-CB 3.3Å; V779-E783 PolarHBondContact O-N 3.26Å; V781-E783 VanDerWaalsContact C-N 3.34Å; V781-E783 PolarHBondContact O-N 3.01Å; E783-V785 PolarHBondContact O-N 2.83Å; E783-A786 PolarHBondContact O-N 2.81Å; E783-F787 HydrophobicContact CG-CD2 3.57Å; E783-F787 HydrophobicContact CG-CE2 3.26Å; E783-F787 HydrophobicContact CG-CZ 4.27Å; E783-F787 VanDerWaalsContact O-CD2 3.28Å; E783-F787 WeakPolarHBondContact O-CD2 3.22Å; E783-F787 PolarHBondContact O-N 2.81Å; E783-F787 WeakPolarHBondContact OE1-CE2 3.39Å
784	H	92.5	Very high	91	Very high	110 Å²	110	57 Å²	57	51%	0.509	31%	0.314	S	S	.	.	H	α-helix	trans	-65.8	-40.4	-178	-73.5	74.3	0	0	0	111.9	I780 V781 F787 V788	I780-H784 PolarHBondContact O-N 3.43Å; I780-H784 PolarHBondContact O-ND1 3.46Å; V781-H784 PolarHBondContact O-N 2.92Å; H784-F787 PolarHBondContact O-N 2.94Å; H784-V788 WeakPolarHBondContact O-CB 3.42Å; H784-V788 WeakPolarHBondContact O-CG2 3.44Å; H784-V788 PolarHBondContact O-N 3.11Å
785	V	90.4	Very high	90.6	Very high	79 Å²	79	61.9 Å²	61.9	48%	0.479	33%	0.333	S	S	.	.	H	α-helix	trans	-63.5	-46.1	176.4	170.8	0	0	0	0	110.4	V781 E783 V788 L789	V781-V785 HydrophobicContact CG1-CG2 4.22Å; V781-V785 WeakPolarHBondContact O-CB 3.37Å; V781-V785 WeakPolarHBondContact O-CG2 3.34Å; V781-V785 PolarHBondContact O-N 2.86Å; E783-V785 PolarHBondContact O-N 2.83Å; V785-V788 PolarHBondContact O-N 3.35Å; V785-L789 HydrophobicContact CG1-CD1 3.9Å; V785-L789 WeakPolarHBondContact O-CB 3.47Å; V785-L789 VanDerWaalsContact O-CG 3.28Å; V785-L789 WeakPolarHBondContact O-CG 3.48Å; V785-L789 PolarHBondContact O-N 3.25Å
786	A	88	Confident	90.4	Very high	7 Å²	7	67.9 Å²	67.9	6%	0.058	36%	0.36	C	S	.	.	H	α-helix	trans	-61.3	-45	177.7	0	0	0	0	0	112.4	V360 V705 F782 E783 L789 A790	V360-A786 HydrophobicContact CG1-CB 4.04Å; V705-A786 HydrophobicContact CB-CB 4.44Å; V705-A786 HydrophobicContact CG1-CB 3.46Å; V705-A786 VanDerWaalsContact CG1-CB 3.46Å; V705-A786 HydrophobicContact CG2-CB 4.11Å; F782-A786 WeakPolarHBondContact O-CB 3.25Å; F782-A786 PolarHBondContact O-N 3.08Å; E783-A786 PolarHBondContact O-N 2.81Å; A786-L789 PolarHBondContact O-N 3.44Å; A786-A790 WeakPolarHBondContact O-CB 3.39Å; A786-A790 PolarHBondContact O-N 2.84Å
787	F	88.4	Confident	90	Very high	47 Å²	47	65.6 Å²	65.6	21%	0.206	35%	0.348	C	S	.	.	H	α-helix	trans	-68.6	-38	177.9	-73.4	-44.7	0	0	0	113.2	R702 V705 E783 H784 L789 A790 N791	R702-F787 HydrophobicContact CB-CE1 4.42Å; R702-F787 HydrophobicContact CG-CE1 4.44Å; V705-F787 HydrophobicContact CB-CE1 4.36Å; V705-F787 HydrophobicContact CB-CZ 4.43Å; V705-F787 HydrophobicContact CG1-CE1 4.43Å; V705-F787 HydrophobicContact CG1-CZ 4.33Å; V705-F787 HydrophobicContact CG2-CE1 4.39Å; E783-F787 HydrophobicContact CG-CD2 3.57Å; E783-F787 HydrophobicContact CG-CE2 3.26Å; E783-F787 HydrophobicContact CG-CZ 4.27Å; E783-F787 VanDerWaalsContact O-CD2 3.28Å; E783-F787 WeakPolarHBondContact O-CD2 3.22Å; E783-F787 PolarHBondContact O-N 2.81Å; E783-F787 WeakPolarHBondContact OE1-CE2 3.39Å; H784-F787 PolarHBondContact O-N 2.94Å; F787-L789 VanDerWaalsContact C-N 3.35Å; F787-A790 PolarHBondContact O-N 3.46Å; F787-N791 WeakPolarHBondContact O-CB 3.5Å; F787-N791 PolarHBondContact O-N 2.99Å; F787-N791 PolarHBondContact O-ND2 3.23Å
788	V	90.6	Very high	89.7	Confident	101 Å²	101	66.8 Å²	66.8	61%	0.612	35%	0.352	S	S	*	.	H	α-helix	trans	-62.1	-44.8	173.8	168.4	0	0	0	0	110.5	H784 V785 A792	H784-V788 WeakPolarHBondContact O-CB 3.42Å; H784-V788 WeakPolarHBondContact O-CG2 3.44Å; H784-V788 PolarHBondContact O-N 3.11Å; V785-V788 PolarHBondContact O-N 3.35Å; V788-A792 VanDerWaalsContact O-CB 3.26Å; V788-A792 WeakPolarHBondContact O-CB 3.31Å; V788-A792 PolarHBondContact O-N 3.01Å
789	L	87.6	Confident	89.5	Confident	72 Å²	72	68.7 Å²	68.7	38%	0.377	36%	0.364	S	S	.	.	H	α-helix	trans	-62.6	-43.9	175.7	-73.2	168.5	0	0	0	111.8	V785 A786 F787 A792 L793	V785-L789 HydrophobicContact CG1-CD1 3.9Å; V785-L789 WeakPolarHBondContact O-CB 3.47Å; V785-L789 VanDerWaalsContact O-CG 3.28Å; V785-L789 WeakPolarHBondContact O-CG 3.48Å; V785-L789 PolarHBondContact O-N 3.25Å; A786-L789 PolarHBondContact O-N 3.44Å; F787-L789 VanDerWaalsContact C-N 3.35Å; L789-A792 PolarHBondContact O-N 3.46Å; L789-L793 VanDerWaalsContact O-CG 3.28Å; L789-L793 WeakPolarHBondContact O-CG 3.38Å; L789-L793 PolarHBondContact O-N 3.39Å
790	A	84.3	Confident	89.2	Confident	15 Å²	15	71.2 Å²	71.2	12%	0.124	38%	0.379	C	S	.	.	H	α-helix	trans	-60.5	-50.3	178.2	0	0	0	0	0	112	V364 A786 F787 A792 L793 D794	V364-A790 HydrophobicContact CG1-CB 4.31Å; V364-A790 HydrophobicContact CG2-CB 3.61Å; A786-A790 WeakPolarHBondContact O-CB 3.39Å; A786-A790 PolarHBondContact O-N 2.84Å; F787-A790 PolarHBondContact O-N 3.46Å; A790-A792 VanDerWaalsContact C-N 3.31Å; A790-A792 PolarHBondContact O-N 3.19Å; A790-L793 PolarHBondContact O-N 2.03Å; A790-D794 PolarHBondContact O-N 3.2Å
791	N	86.3	Confident	88.9	Confident	90 Å²	90	67.5 Å²	67.5	48%	0.481	36%	0.361	S	S	.	.	H	α-helix	trans	-66.1	-34.3	179.3	-67.5	-20.9	0	0	0	111.9	F787 F795	F787-N791 WeakPolarHBondContact O-CB 3.5Å; F787-N791 PolarHBondContact O-N 2.99Å; F787-N791 PolarHBondContact O-ND2 3.23Å; N791-F795 WeakPolarHBondContact O-CB 3.18Å; N791-F795 PolarHBondContact O-N 3.22Å
792	A	89.3	Confident	88.7	Confident	36 Å²	36	67.2 Å²	67.2	30%	0.298	36%	0.363	S	S	.	.	H	α-helix	trans	-63.8	-42.8	173.5	0	0	0	0	0	111.2	V788 L789 A790 F795 F796	V788-A792 VanDerWaalsContact O-CB 3.26Å; V788-A792 WeakPolarHBondContact O-CB 3.31Å; V788-A792 PolarHBondContact O-N 3.01Å; L789-A792 PolarHBondContact O-N 3.46Å; A790-A792 VanDerWaalsContact C-N 3.31Å; A790-A792 PolarHBondContact O-N 3.19Å; A792-F795 PolarHBondContact O-N 3.15Å; A792-F796 HydrophobicContact CB-CD2 4.45Å; A792-F796 HydrophobicContact CB-CE2 4.31Å; A792-F796 WeakPolarHBondContact O-CD2 3.26Å; A792-F796 PolarHBondContact O-N 2.68Å
793	L	87.7	Confident	88.5	Confident	42 Å²	42	70.3 Å²	70.3	22%	0.22	39%	0.387	C	S	.	.	H	α-helix	trans	-64.4	-42.8	177.6	-71.3	165.3	0	0	0	112.3	I361 V364 T365 L789 A790 F795 F796 I797	I361-L793 HydrophobicContact CG2-CD1 4.09Å; V364-L793 HydrophobicContact CB-CD1 4.49Å; V364-L793 HydrophobicContact CG1-CB 4.09Å; V364-L793 HydrophobicContact CG1-CD1 4.34Å; T365-L793 HydrophobicContact CG2-CD1 3.95Å; T365-L793 HydrophobicContact CG2-CD2 4.15Å; L789-L793 VanDerWaalsContact O-CG 3.28Å; L789-L793 WeakPolarHBondContact O-CG 3.38Å; L789-L793 PolarHBondContact O-N 3.39Å; A790-L793 PolarHBondContact O-N 2.03Å; L793-F795 VanDerWaalsContact C-N 3.31Å; L793-F795 PolarHBondContact O-N 3.11Å; L793-F796 PolarHBondContact O-N 3.02Å; L793-I797 HydrophobicContact CD2-CD1 4.49Å; L793-I797 WeakPolarHBondContact O-CB 3.47Å; L793-I797 WeakPolarHBondContact O-CG1 3.36Å; L793-I797 PolarHBondContact O-N 3.42Å
794	D	83.3	Confident	88.3	Confident	67 Å²	67	68.4 Å²	68.4	36%	0.358	38%	0.378	S	S	.	.	H	α-helix	trans	-59.5	-42	173.7	-171.3	20.9	0	0	0	111	K371 A790	K371-D794 IonicContact NZ-OD1 3.9Å; K371-D794 PolarHBondContact NZ-OD1 2.96Å; A790-D794 PolarHBondContact O-N 3.2Å
795	F	87.2	Confident	88.2	Confident	167 Å²	167	69 Å²	69	73%	0.732	38%	0.38	S	S	*	.	H	α-helix	trans	-65.7	-40.9	175.9	-178.5	-98.8	0	0	0	113.5	N791 A792 L793	N791-F795 WeakPolarHBondContact O-CB 3.18Å; N791-F795 PolarHBondContact O-N 3.22Å; A792-F795 PolarHBondContact O-N 3.15Å; L793-F795 VanDerWaalsContact C-N 3.31Å; L793-F795 PolarHBondContact O-N 3.11Å
796	F	89.4	Confident	88.2	Confident	155 Å²	155	71.3 Å²	71.3	68%	0.68	39%	0.385	S	S	*	.	H	α-helix	trans	-79.5	-25.8	-177.4	-73.4	-58.6	0	0	0	113.9	A792 L793 P798	A792-F796 HydrophobicContact CB-CD2 4.45Å; A792-F796 HydrophobicContact CB-CE2 4.31Å; A792-F796 WeakPolarHBondContact O-CD2 3.26Å; A792-F796 PolarHBondContact O-N 2.68Å; L793-F796 PolarHBondContact O-N 3.02Å; F796-P798 WeakPolarHBondContact O-CD 3.28Å
797	I	88.6	Confident	88.2	Confident	40 Å²	40	73.8 Å²	73.8	21%	0.205	39%	0.393	C	S	.	.	S	Bend	trans	-106.2	99	-176.5	-58	172.6	0	0	0	108.4	E368 L793 D799	E368-I797 HydrophobicContact CB-CB 4.35Å; E368-I797 HydrophobicContact CB-CG2 3.98Å; L793-I797 HydrophobicContact CD2-CD1 4.49Å; L793-I797 WeakPolarHBondContact O-CB 3.47Å; L793-I797 WeakPolarHBondContact O-CG1 3.36Å; L793-I797 PolarHBondContact O-N 3.42Å; I797-D799 PolarHBondContact O-N 2.86Å
798	P	88.7	Confident	88.1	Confident	73 Å²	73	72.7 Å²	72.7	47%	0.474	39%	0.389	S	S	.	.			trans	-66.8	135.9	-178.6	27	-34.7	0	0	0	111.8	R372 F796 V800	R372-P798 VanDerWaalsContact CD-O 3.29Å; R372-P798 WeakPolarHBondContact CD-O 3.46Å; R372-P798 WeakPolarHBondContact CG-O 3.31Å; F796-P798 WeakPolarHBondContact O-CD 3.28Å; P798-V800 PolarHBondContact O-N 2.91Å; P798-V800 VanDerWaalsContact O-N 3.14Å
799	D	89.1	Confident	88.1	Confident	79 Å²	79	73.3 Å²	73.3	42%	0.422	39%	0.385	S	S	.	.	S	Bend	trans	-49.7	-39.3	178	-69.6	-22.5	0	0	0	113.4	K371 R372 I797	K371-D799 HydrophobicContact CD-CB 4.4Å; K371-D799 WeakPolarHBondContact CD-OD1 3.16Å; K371-D799 WeakPolarHBondContact CE-OD1 3.34Å; K371-D799 IonicContact NZ-OD1 2.79Å; K371-D799 PolarHBondContact NZ-OD1 2.97Å; R372-D799 VanDerWaalsContact CA-O 3.24Å; R372-D799 WeakPolarHBondContact CA-O 3.27Å; R372-D799 VanDerWaalsContact CG-O 3.26Å; R372-D799 WeakPolarHBondContact CG-O 3.49Å; R372-D799 PolarHBondContact N-O 3.15Å; I797-D799 PolarHBondContact O-N 2.86Å
800	V	88.8	Confident	88.1	Confident	61 Å²	61	78.5 Å²	78.5	37%	0.37	40%	0.399	S	S	.	.	S	Bend	trans	-112.1	122.8	179.6	-177.5	0	0	0	0	109.2	A375 P798 S802 L804 K805	A375-V800 HydrophobicContact CB-CG2 4.26Å; P798-V800 PolarHBondContact O-N 2.91Å; P798-V800 VanDerWaalsContact O-N 3.14Å; V800-S802 PolarHBondContact O-N 3.39Å; V800-L804 HydrophobicContact CG1-CB 4.29Å; V800-L804 HydrophobicContact CG1-CD2 4.11Å; V800-L804 HydrophobicContact CG1-CG 4.31Å; V800-K805 HydrophobicContact CG1-CB 4.38Å
801	P	89.6	Confident	88	Confident	17 Å²	17	79.9 Å²	79.9	11%	0.11	40%	0.404	C	S	.	.			trans	-55.2	136.8	174.9	-23	31.9	0	0	0	112	R372 S803 L804 K805	R372-P801 HydrophobicContact CB-CG 4.11Å; R372-P801 HydrophobicContact CG-CG 4.41Å; P801-S803 VanDerWaalsContact C-N 3.28Å; P801-S803 PolarHBondContact O-N 3.47Å; P801-L804 HydrophobicContact CB-CB 4.26Å; P801-L804 WeakPolarHBondContact O-CA 3.37Å; P801-L804 WeakPolarHBondContact O-CB 3.06Å; P801-L804 PolarHBondContact O-N 3.29Å; P801-K805 PolarHBondContact O-N 3.35Å
802	S	88.8	Confident	88	Confident	83 Å²	83	82.5 Å²	82.5	58%	0.58	41%	0.406	S	S	*	.	H	α-helix	trans	-53.6	-44.2	179.3	50.2	0	0	0	0	112.7	V800 L804 K805 E806	V800-S802 PolarHBondContact O-N 3.39Å; S802-L804 PolarHBondContact O-N 3.45Å; S802-K805 WeakPolarHBondContact O-CB 3.21Å; S802-K805 PolarHBondContact O-N 3.45Å; S802-K805 VanDerWaalsContact O-N 3.11Å; S802-E806 WeakPolarHBondContact O-CG 3.16Å; S802-E806 PolarHBondContact O-N 3.07Å
803	S	87.9	Confident	88	Confident	83 Å²	83	87.1 Å²	87.1	58%	0.58	42%	0.42	S	S	*	.	H	α-helix	trans	-57.9	-33.9	176.5	64.2	0	0	0	0	113.3	P801 R807	P801-S803 VanDerWaalsContact C-N 3.28Å; P801-S803 PolarHBondContact O-N 3.47Å; S803-R807 WeakPolarHBondContact O-CB 3.01Å; S803-R807 PolarHBondContact O-N 3.3Å
804	L	88	Confident	87.8	Confident	12 Å²	12	89.2 Å²	89.2	6%	0.063	43%	0.431	C	S	.	.	H	α-helix	trans	-77	-40.9	177.6	-178.3	61.5	0	0	0	110.9	A375 K376 H379 V800 P801 S802 E806 R807 I808	A375-L804 HydrophobicContact CB-CD2 4.13Å; K376-L804 HydrophobicContact CB-CD2 4.24Å; H379-L804 HydrophobicContact CB-CD1 3.85Å; H379-L804 HydrophobicContact CB-CD2 4.41Å; H379-L804 WeakPolarHBondContact ND1-CD1 3.22Å; V800-L804 HydrophobicContact CG1-CB 4.29Å; V800-L804 HydrophobicContact CG1-CD2 4.11Å; V800-L804 HydrophobicContact CG1-CG 4.31Å; P801-L804 HydrophobicContact CB-CB 4.26Å; P801-L804 WeakPolarHBondContact O-CA 3.37Å; P801-L804 WeakPolarHBondContact O-CB 3.06Å; P801-L804 PolarHBondContact O-N 3.29Å; S802-L804 PolarHBondContact O-N 3.45Å; L804-E806 PolarHBondContact O-N 3.33Å; L804-R807 WeakPolarHBondContact O-CB 3.15Å; L804-R807 PolarHBondContact O-N 3.09Å; L804-I808 HydrophobicContact CD1-CD1 4.27Å; L804-I808 HydrophobicContact CD1-CG1 4.38Å; L804-I808 HydrophobicContact CG-CD1 3.96Å; L804-I808 HydrophobicContact CG-CG1 4.49Å; L804-I808 WeakPolarHBondContact O-CG1 3.49Å; L804-I808 PolarHBondContact O-N 3.32Å
805	K	90.9	Very high	87.6	Confident	124 Å²	124	88.6 Å²	88.6	54%	0.539	44%	0.436	S	S	.	.	H	α-helix	trans	-59.9	-46.4	175.8	-172.8	178.3	-179.5	178.7	0	111.5	V800 P801 S802 R807 I808 Q809	V800-K805 HydrophobicContact CG1-CB 4.38Å; P801-K805 PolarHBondContact O-N 3.35Å; S802-K805 WeakPolarHBondContact O-CB 3.21Å; S802-K805 PolarHBondContact O-N 3.45Å; S802-K805 VanDerWaalsContact O-N 3.11Å; K805-R807 VanDerWaalsContact C-N 3.31Å; K805-R807 PolarHBondContact O-N 2.89Å; K805-I808 PolarHBondContact O-N 3.26Å; K805-Q809 WeakPolarHBondContact O-CB 2.95Å; K805-Q809 VanDerWaalsContact O-CG 3.28Å; K805-Q809 WeakPolarHBondContact O-CG 3.31Å; K805-Q809 PolarHBondContact O-N 2.91Å
806	E	90.2	Very high	87.5	Confident	127 Å²	127	87.7 Å²	87.7	59%	0.593	43%	0.431	S	S	*	.	H	α-helix	trans	-59.8	-42.6	174.9	-72.8	171	-167.7	0	0	111.5	S802 L804 Q809 R810	S802-E806 WeakPolarHBondContact O-CG 3.16Å; S802-E806 PolarHBondContact O-N 3.07Å; L804-E806 PolarHBondContact O-N 3.33Å; E806-Q809 PolarHBondContact O-N 3.14Å; E806-R810 WeakPolarHBondContact O-CB 3.23Å; E806-R810 PolarHBondContact O-N 2.87Å
807	R	86.6	Confident	87.3	Confident	59 Å²	59	84.5 Å²	84.5	22%	0.223	42%	0.418	C	S	.	.	H	α-helix	trans	-62.6	-49.5	177.5	-176.7	-178.2	-177	146.4	21.5	112.7	Q122 Y155 S803 L804 K805 Q809 R810 E811	Q122-R807 VanDerWaalsContact NE2-CZ 3.33Å; Q122-R807 VanDerWaalsContact NE2-NH1 3.15Å; Y155-R807 PolarHBondContact OH-NH2 2.89Å; S803-R807 WeakPolarHBondContact O-CB 3.01Å; S803-R807 PolarHBondContact O-N 3.3Å; L804-R807 WeakPolarHBondContact O-CB 3.15Å; L804-R807 PolarHBondContact O-N 3.09Å; K805-R807 VanDerWaalsContact C-N 3.31Å; K805-R807 PolarHBondContact O-N 2.89Å; R807-Q809 VanDerWaalsContact C-N 3.28Å; R807-Q809 PolarHBondContact O-N 3.14Å; R807-R810 WeakPolarHBondContact O-CB 3.34Å; R807-R810 PolarHBondContact O-N 3.03Å; R807-R810 VanDerWaalsContact O-N 3.16Å; R807-E811 WeakPolarHBondContact CG-OE1 3.48Å; R807-E811 IonicContact CZ-OE1 2.68Å; R807-E811 IonicContact NE-OE1 2.75Å; R807-E811 PolarHBondContact NE-OE1 2.94Å; R807-E811 IonicContact NH2-OE1 2.64Å; R807-E811 WeakPolarHBondContact O-CG 3.23Å; R807-E811 PolarHBondContact O-N 3.2Å
808	I	87.3	Confident	86.7	Confident	24 Å²	24	85 Å²	85	12%	0.123	43%	0.428	C	S	.	.	H	α-helix	trans	-59.7	-42.4	177.1	-68.7	166.1	0	0	0	110.2	H379 L384 L804 K805 E811 R812	H379-I808 VanDerWaalsContact CD2-CG1 3.47Å; H379-I808 WeakPolarHBondContact CD2-CG1 3.47Å; L384-I808 HydrophobicContact CD2-CD1 3.96Å; L804-I808 HydrophobicContact CD1-CD1 4.27Å; L804-I808 HydrophobicContact CD1-CG1 4.38Å; L804-I808 HydrophobicContact CG-CD1 3.96Å; L804-I808 HydrophobicContact CG-CG1 4.49Å; L804-I808 WeakPolarHBondContact O-CG1 3.49Å; L804-I808 PolarHBondContact O-N 3.32Å; K805-I808 PolarHBondContact O-N 3.26Å; I808-E811 PolarHBondContact O-N 3.16Å; I808-R812 HydrophobicContact CG2-CG 4.49Å; I808-R812 WeakPolarHBondContact O-CB 3.34Å; I808-R812 WeakPolarHBondContact O-CG 3.16Å; I808-R812 PolarHBondContact O-N 3.4Å
809	Q	90.4	Very high	86.2	Confident	113 Å²	113	86.7 Å²	86.7	53%	0.528	43%	0.433	S	S	.	.	H	α-helix	trans	-62.9	-42.1	176.5	-75.2	179.1	-6.8	0	0	111.9	K805 E806 R807 R812 F813	K805-Q809 WeakPolarHBondContact O-CB 2.95Å; K805-Q809 VanDerWaalsContact O-CG 3.28Å; K805-Q809 WeakPolarHBondContact O-CG 3.31Å; K805-Q809 PolarHBondContact O-N 2.91Å; E806-Q809 PolarHBondContact O-N 3.14Å; R807-Q809 VanDerWaalsContact C-N 3.28Å; R807-Q809 PolarHBondContact O-N 3.14Å; Q809-R812 PolarHBondContact O-N 3.44Å; Q809-F813 WeakPolarHBondContact O-CB 3.37Å; Q809-F813 PolarHBondContact O-N 3.03Å
810	R	88.1	Confident	86.1	Confident	181 Å²	181	87.9 Å²	87.9	68%	0.683	44%	0.439	S	S	*	.	H	α-helix	trans	-62.8	-46.4	175.9	-176.5	177.5	178.8	176.1	-0.4	111.9	E806 R807 F813 L814	E806-R810 WeakPolarHBondContact O-CB 3.23Å; E806-R810 PolarHBondContact O-N 2.87Å; R807-R810 WeakPolarHBondContact O-CB 3.34Å; R807-R810 PolarHBondContact O-N 3.03Å; R807-R810 VanDerWaalsContact O-N 3.16Å; R810-F813 WeakPolarHBondContact O-CB 3.5Å; R810-F813 PolarHBondContact O-N 3.25Å; R810-L814 HydrophobicContact CG-CD1 4.2Å; R810-L814 WeakPolarHBondContact O-CG 3.43Å; R810-L814 PolarHBondContact O-N 2.73Å
811	E	82.2	Confident	85.9	Confident	45 Å²	45	88.5 Å²	88.5	21%	0.21	44%	0.44	C	S	.	.	H	α-helix	trans	-62.2	-44.1	177.4	-73.2	167.2	-166.1	0	0	111.5	Y155 H379 R807 I808 F813 L814 A815	Y155-E811 HydrophobicContact CD1-CG 4.35Å; Y155-E811 HydrophobicContact CE1-CG 3.85Å; Y155-E811 WeakPolarHBondContact CE1-OE1 3.49Å; H379-E811 IonicContact CD2-OE2 3.33Å; H379-E811 IonicContact CE1-OE1 3.83Å; H379-E811 PolarHBondContact CE1-OE1 3.01Å; H379-E811 IonicContact CE1-OE2 3.96Å; H379-E811 PolarHBondContact CE1-OE2 3.04Å; H379-E811 IonicContact NE2-OE1 3.97Å; H379-E811 IonicContact NE2-OE2 3.63Å; H379-E811 PolarHBondContact NE2-OE2 3.3Å; R807-E811 WeakPolarHBondContact CG-OE1 3.48Å; R807-E811 IonicContact CZ-OE1 2.68Å; R807-E811 IonicContact NE-OE1 2.75Å; R807-E811 PolarHBondContact NE-OE1 2.94Å; R807-E811 IonicContact NH2-OE1 2.64Å; R807-E811 WeakPolarHBondContact O-CG 3.23Å; R807-E811 PolarHBondContact O-N 3.2Å; I808-E811 PolarHBondContact O-N 3.16Å; E811-F813 VanDerWaalsContact C-N 3.31Å; E811-F813 PolarHBondContact O-N 3.15Å; E811-L814 PolarHBondContact O-N 2.83Å; E811-A815 WeakPolarHBondContact O-CB 3.45Å; E811-A815 PolarHBondContact O-N 2.95Å
812	R	85.4	Confident	85.3	Confident	144 Å²	144	91.1 Å²	91.1	54%	0.543	45%	0.452	S	S	.	.	H	α-helix	trans	-62	-37.8	174	-74.1	177.2	177.6	177.6	-0.5	112.3	I808 Q809 K816	I808-R812 HydrophobicContact CG2-CG 4.49Å; I808-R812 WeakPolarHBondContact O-CB 3.34Å; I808-R812 WeakPolarHBondContact O-CG 3.16Å; I808-R812 PolarHBondContact O-N 3.4Å; Q809-R812 PolarHBondContact O-N 3.44Å; R812-K816 WeakPolarHBondContact O-CB 3.29Å; R812-K816 VanDerWaalsContact O-CG 3.32Å; R812-K816 WeakPolarHBondContact O-CG 3.34Å; R812-K816 PolarHBondContact O-N 3.44Å; R812-K816 VanDerWaalsContact O-N 3.07Å
813	F	88.9	Confident	84.9	Confident	133 Å²	133	89.2 Å²	89.2	58%	0.583	44%	0.439	S	S	*	.	H	α-helix	trans	-64.9	-48.9	175.5	177.1	-93.9	0	0	0	111.3	Q809 R810 E811 A815 K816 Q817	Q809-F813 WeakPolarHBondContact O-CB 3.37Å; Q809-F813 PolarHBondContact O-N 3.03Å; R810-F813 WeakPolarHBondContact O-CB 3.5Å; R810-F813 PolarHBondContact O-N 3.25Å; E811-F813 VanDerWaalsContact C-N 3.31Å; E811-F813 PolarHBondContact O-N 3.15Å; F813-A815 PolarHBondContact O-N 3Å; F813-K816 PolarHBondContact O-N 2.01Å; F813-Q817 PolarHBondContact O-N 2.96Å
814	L	84	Confident	84.8	Confident	87 Å²	87	89.7 Å²	89.7	46%	0.455	44%	0.435	S	S	.	.	H	α-helix	trans	-62.2	-41.4	177.5	-68.7	173.2	0	0	0	112.1	R810 E811 K816 Q817 A818	R810-L814 HydrophobicContact CG-CD1 4.2Å; R810-L814 WeakPolarHBondContact O-CG 3.43Å; R810-L814 PolarHBondContact O-N 2.73Å; E811-L814 PolarHBondContact O-N 2.83Å; L814-K816 PolarHBondContact O-N 3.17Å; L814-Q817 PolarHBondContact O-N 2.83Å; L814-A818 WeakPolarHBondContact O-CB 3.47Å; L814-A818 PolarHBondContact O-N 2.95Å
815	A	79	Confident	84.4	Confident	54 Å²	54	95.5 Å²	95.5	45%	0.446	46%	0.462	S	S	.	.	H	α-helix	trans	-63.3	-40.6	176	0	0	0	0	0	112.3	E811 F813 A818 L819	E811-A815 WeakPolarHBondContact O-CB 3.45Å; E811-A815 PolarHBondContact O-N 2.95Å; F813-A815 PolarHBondContact O-N 3Å; A815-A818 PolarHBondContact O-N 3.23Å; A815-L819 WeakPolarHBondContact O-CG 3.36Å; A815-L819 PolarHBondContact O-N 3.46Å
816	K	85.2	Confident	83.5	Confident	147 Å²	147	93.7 Å²	93.7	64%	0.639	46%	0.464	S	S	*	.	H	α-helix	trans	-63.8	-42.3	173.7	-77.4	178.1	177.9	-175.3	0	111.7	R812 F813 L814 L819 L820	R812-K816 WeakPolarHBondContact O-CB 3.29Å; R812-K816 VanDerWaalsContact O-CG 3.32Å; R812-K816 WeakPolarHBondContact O-CG 3.34Å; R812-K816 PolarHBondContact O-N 3.44Å; R812-K816 VanDerWaalsContact O-N 3.07Å; F813-K816 PolarHBondContact O-N 2.01Å; L814-K816 PolarHBondContact O-N 3.17Å; K816-L819 PolarHBondContact O-N 3.39Å; K816-L820 WeakPolarHBondContact O-CG 3.08Å; K816-L820 PolarHBondContact O-N 3.02Å
817	Q	86.5	Confident	82.7	Confident	88 Å²	88	96.9 Å²	96.9	41%	0.411	47%	0.471	S	S	.	.	H	α-helix	trans	-61.9	-47.1	176.4	-172.4	171.9	3.6	0	0	111.2	F813 L814 L819 L820 D821	F813-Q817 PolarHBondContact O-N 2.96Å; L814-Q817 PolarHBondContact O-N 2.83Å; Q817-L819 VanDerWaalsContact C-N 3.32Å; Q817-L819 PolarHBondContact O-N 3.41Å; Q817-L820 WeakPolarHBondContact O-CB 3.18Å; Q817-L820 PolarHBondContact O-N 3.29Å; Q817-D821 VanDerWaalsContact O-CG 3.31Å; Q817-D821 PolarHBondContact O-N 3.4Å
818	A	76	Confident	81.5	Confident	50 Å²	50	100.3 Å²	100.3	41%	0.413	49%	0.489	S	S	.	.	H	α-helix	trans	-60.7	-37.7	177.1	0	0	0	0	0	113	L814 A815 I822	L814-A818 WeakPolarHBondContact O-CB 3.47Å; L814-A818 PolarHBondContact O-N 2.95Å; A815-A818 PolarHBondContact O-N 3.23Å; A818-I822 WeakPolarHBondContact O-CD1 3.46Å; A818-I822 VanDerWaalsContact O-CG1 3.23Å; A818-I822 WeakPolarHBondContact O-CG1 3.46Å; A818-I822 PolarHBondContact O-N 2.98Å; A818-I822 VanDerWaalsContact O-N 3.09Å
819	L	77.8	Confident	79.9	Confident	109 Å²	109	103 Å²	103	57%	0.571	51%	0.509	S	S	*	.	H	α-helix	trans	-67	-37.6	174.2	-73.4	171.9	0	0	0	112.3	A815 K816 Q817 S823	A815-L819 WeakPolarHBondContact O-CG 3.36Å; A815-L819 PolarHBondContact O-N 3.46Å; K816-L819 PolarHBondContact O-N 3.39Å; Q817-L819 VanDerWaalsContact C-N 3.32Å; Q817-L819 PolarHBondContact O-N 3.41Å; L819-S823 WeakPolarHBondContact O-CB 3.07Å; L819-S823 PolarHBondContact O-N 3.35Å; L819-S823 VanDerWaalsContact O-N 3.09Å
820	L	86.2	Confident	78	Confident	105 Å²	105	105.5 Å²	105.5	55%	0.55	52%	0.52	S	S	.	.	H	α-helix	trans	-65.7	-45.3	175	-72.7	167	0	0	0	110.9	K816 Q817 I822 S823 L824	K816-L820 WeakPolarHBondContact O-CG 3.08Å; K816-L820 PolarHBondContact O-N 3.02Å; Q817-L820 WeakPolarHBondContact O-CB 3.18Å; Q817-L820 PolarHBondContact O-N 3.29Å; L820-I822 PolarHBondContact O-N 3.31Å; L820-S823 WeakPolarHBondContact CA-OG 2.99Å; L820-S823 CarbonylContact O-C 3.59Å; L820-S823 WeakPolarHBondContact O-CA 3.09Å; L820-S823 WeakPolarHBondContact O-CB 3.38Å; L820-S823 PolarHBondContact O-N 3.15Å; L820-S823 PolarHBondContact O-OG 2.04Å; L820-L824 WeakPolarHBondContact O-CG 3.08Å; L820-L824 PolarHBondContact O-N 3.38Å
821	D	84.3	Confident	76.1	Confident	74 Å²	74	101.8 Å²	101.8	40%	0.396	52%	0.518	S	S	.	.	H	α-helix	trans	-60.2	-44.6	178.7	-64.9	-22	0	0	0	111.3	Q817 S823 L824 E825	Q817-D821 VanDerWaalsContact O-CG 3.31Å; Q817-D821 PolarHBondContact O-N 3.4Å; D821-S823 VanDerWaalsContact C-N 3.27Å; D821-S823 PolarHBondContact O-N 3.16Å; D821-L824 PolarHBondContact O-N 3.2Å; D821-L824 VanDerWaalsContact O-N 3.1Å; D821-E825 WeakPolarHBondContact O-CG 3.44Å; D821-E825 PolarHBondContact O-N 2.8Å
822	I	77	Confident	74.6	Confident	71 Å²	71	108 Å²	108	36%	0.364	54%	0.544	S	S	.	.	H	α-helix	trans	-59.4	-38.1	173.1	-67.6	164.9	0	0	0	111.6	A818 L820 L824 S826	A818-I822 WeakPolarHBondContact O-CD1 3.46Å; A818-I822 VanDerWaalsContact O-CG1 3.23Å; A818-I822 WeakPolarHBondContact O-CG1 3.46Å; A818-I822 PolarHBondContact O-N 2.98Å; A818-I822 VanDerWaalsContact O-N 3.09Å; L820-I822 PolarHBondContact O-N 3.31Å; I822-L824 VanDerWaalsContact C-N 3.34Å; I822-S826 PolarHBondContact O-N 3.36Å; I822-S826 VanDerWaalsContact O-N 3.16Å; I822-S826 PolarHBondContact O-OG 2.65Å
823	S	81.3	Confident	72.8	Confident	44 Å²	44	108.7 Å²	108.7	31%	0.308	55%	0.551	S	S	.	*	H	α-helix	trans	-73.8	-24.2	178.5	79.3	0	0	0	0	113.6	L819 L820 D821 S826 R827	L819-S823 WeakPolarHBondContact O-CB 3.07Å; L819-S823 PolarHBondContact O-N 3.35Å; L819-S823 VanDerWaalsContact O-N 3.09Å; L820-S823 WeakPolarHBondContact CA-OG 2.99Å; L820-S823 CarbonylContact O-C 3.59Å; L820-S823 WeakPolarHBondContact O-CA 3.09Å; L820-S823 WeakPolarHBondContact O-CB 3.38Å; L820-S823 PolarHBondContact O-N 3.15Å; L820-S823 PolarHBondContact O-OG 2.04Å; D821-S823 VanDerWaalsContact C-N 3.27Å; D821-S823 PolarHBondContact O-N 3.16Å; S823-S826 PolarHBondContact O-OG 2.6Å; S823-S826 VanDerWaalsContact O-OG 3.05Å; S823-R827 WeakPolarHBondContact O-CG 3.44Å
824	L	85.4	Confident	71	Confident	93 Å²	93	108.7 Å²	108.7	49%	0.487	56%	0.557	S	S	.	*	H	α-helix	trans	-81.9	-43	175.2	-69.4	171.8	0	0	0	110.7	L820 D821 I822 S826 R827 Q828	L820-L824 WeakPolarHBondContact O-CG 3.08Å; L820-L824 PolarHBondContact O-N 3.38Å; D821-L824 PolarHBondContact O-N 3.2Å; D821-L824 VanDerWaalsContact O-N 3.1Å; I822-L824 VanDerWaalsContact C-N 3.34Å; L824-S826 VanDerWaalsContact C-N 3.26Å; L824-S826 PolarHBondContact O-N 3.26Å; L824-R827 PolarHBondContact O-N 3.34Å; L824-Q828 PolarHBondContact O-N 2.71Å; L824-Q828 VanDerWaalsContact O-N 3.13Å
825	E	79.9	Confident	69.6	Low	134 Å²	134	110.5 Å²	110.5	63%	0.626	57%	0.571	S	S	*	*	H	α-helix	trans	-59.4	-36.9	174.5	-75	178.3	176.1	0	0	112	D821 R827 Q828 P829	D821-E825 WeakPolarHBondContact O-CG 3.44Å; D821-E825 PolarHBondContact O-N 2.8Å; E825-R827 VanDerWaalsContact C-N 3.25Å; E825-R827 PolarHBondContact O-N 3.14Å; E825-Q828 PolarHBondContact O-N 2.99Å; E825-P829 WeakPolarHBondContact O-CD 3.49Å
826	S	73.1	Confident	68.3	Low	85 Å²	85	112.6 Å²	112.6	59%	0.594	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-16.8	175.9	68.2	0	0	0	0	114.1	I822 S823 L824 P829	I822-S826 PolarHBondContact O-N 3.36Å; I822-S826 VanDerWaalsContact O-N 3.16Å; I822-S826 PolarHBondContact O-OG 2.65Å; S823-S826 PolarHBondContact O-OG 2.6Å; S823-S826 VanDerWaalsContact O-OG 3.05Å; L824-S826 VanDerWaalsContact C-N 3.26Å; L824-S826 PolarHBondContact O-N 3.26Å; S826-P829 VanDerWaalsContact C-CD 3.45Å; S826-P829 WeakPolarHBondContact O-CD 3.39Å
827	R	71.4	Confident	66.4	Low	194 Å²	194	116.9 Å²	116.9	73%	0.732	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	-23.3	174.8	-70.7	-177.5	-169.1	-169.8	3.4	114	S823 L824 E825	S823-R827 WeakPolarHBondContact O-CG 3.44Å; L824-R827 PolarHBondContact O-N 3.34Å; E825-R827 VanDerWaalsContact C-N 3.25Å; E825-R827 PolarHBondContact O-N 3.14Å
828	Q	62.1	Low	65.3	Low	131 Å²	131	118.3 Å²	118.3	61%	0.612	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-77.3	-4.1	177.3	-70.1	-173.4	-3.4	0	0	118.1	L824 E825 E830	L824-Q828 PolarHBondContact O-N 2.71Å; L824-Q828 VanDerWaalsContact O-N 3.13Å; E825-Q828 PolarHBondContact O-N 2.99Å; Q828-E830 PolarHBondContact O-N 3.3Å
829	P	53.9	Low	64.8	Low	81 Å²	81	121.9 Å²	121.9	53%	0.526	63%	0.626	S	S	.	*	G	3₁₀ helix	trans	-67.1	-19.1	179.8	-18.7	31.8	0	0	0	114.8	E825 S826	E825-P829 WeakPolarHBondContact O-CD 3.49Å; S826-P829 VanDerWaalsContact C-CD 3.45Å; S826-P829 WeakPolarHBondContact O-CD 3.39Å
830	E	50.1	Low	64.1	Low	165 Å²	165	122.6 Å²	122.6	77%	0.771	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-84.4	-20.6	-174.4	-67.6	-167.9	162.1	0	0	114.2	Q828	Q828-E830 PolarHBondContact O-N 3.3Å
831	T	49.7	Very low	62.8	Low	104 Å²	104	123.6 Å²	123.6	64%	0.638	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-16.8	-175.8	19.9	0	0	0	0	114.4
832	K	49.4	Very low	61.4	Low	176 Å²	176	126.8 Å²	126.8	77%	0.765	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-13.6	177.7	-76.4	-172.1	178.7	178.7	0	114.8	S836	K832-S836 PolarHBondContact O-OG 3.46Å
833	K	48.5	Very low	60.4	Low	158 Å²	158	130.5 Å²	130.5	69%	0.687	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-78.6	-26	175.5	-91.3	-176.5	173	-177.8	0	113.9	V835	K833-V835 PolarHBondContact O-N 3.27Å
834	N	50	Low	58.9	Low	132 Å²	132	136.6 Å²	136.6	71%	0.706	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-90.1	7.8	-177.3	-68	-2.1	0	0	0	114.5
835	V	55	Low	56.8	Low	125 Å²	125	140 Å²	140	76%	0.758	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-115.6	2.1	177.6	-172.4	0	0	0	0	111.4	K833	K833-V835 PolarHBondContact O-N 3.27Å
836	S	50.8	Low	54.9	Low	99 Å²	99	140.5 Å²	140.5	69%	0.692	72%	0.715	S	S	*	*			trans	-124	9.4	-179.3	54.8	0	0	0	0	114.3	K832	K832-S836 PolarHBondContact O-OG 3.46Å
837	E	45.2	Very low	53.3	Low	236 Å²	236	145.5 Å²	145.5	100%	1.103	73%	0.726	S	S	*	*			trans	-107.1	0	157	-74.2	-176.9	173.1	0	0	108

Retrieved 837 of 837 residues in 1762.5 ms (Link to these results)

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