A0A087YKX3_POEFO Loading...

Metabotropic glutamate receptor 3

G-protein coupled receptor for glutamate. Ligand binding causes a conformation change that triggers signaling via guanine nucleotide-binding proteins (G proteins) and modulates the activity of down-stream effectors. Signaling inhibits adenylate cyclase activity.

AlphaFold DB , UniProt , Accession A0A087YKX3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 883 aa.

						>A0A087YKX3_POEFO|A0A087YKX3
MVSHLPSLVFVMMCQGALLAEPPLSRREIRIEGDLVLGGLFPVHEKGAGMEECGRVNEDRGIQRLEAMLFAIDRINMDSTVLPGVSLGVHILDTCSRDTYALEQALEFVRASLTKVDDTEFICPDGSYALQDENPLAIAGVIGGSYSSVSIQVANLLRLFQIPQISYASTSAKLSDKTRYDYFARTVPPDFYQAKAMAEILRFFNWTYVSTVASEGDYGETGIEAFEQEARMRNICIATSEKVGRSNAKKSYEAVIRQLFQKPNAHVAVLFLRSDDARELIAAAARLNTSFIWVASDGWGAQESIVKGNEITAEGAITLELAANPIPDFNRYFLSLDPVKNHRNPWFRDFWEQRFQCSLGAGGLGLGGTPLPPCDKNLSVDQRYFEPESKIMFVVNAVYAMAHALHNMQRSLCLNTTKLCDSMKALDGRRLYRDYILNVSFTAPFSPPGSETVVKFDSQGDGMGRYNIFSYQRSGERYGYVPVGEWAESLSLNNDLIRWPKEVLPTSQCSDPCERNEMKKMQAGEYCCWICTACEPHEYLADEFTCSPCAPGQWPTDDLTSCYDLPEDYIMWEDAWAIGPITIACVGFVCTGLVVWVFVRHNNTPLVKASGRELCYILLSGVFMCYAMTFLFLAKPSPAICALRRLGLGTSFAVCYAALLTKTNRIARIFNGVKDGAGTVRPRFISPSSQVFICLSMISVQLVMVSVWLLLEVPGTRRFTLPERRQTVILKCNVRDSSMLLSLGYDVLLVILCTVYAFKTRKCPENFNEAKFIGFTMYTTCIIWLAFLPIFYVTSSDYRVQTTTMCISVSLSGFVVLGCMFAPKVNIIMFQPQKNVTSHHLNLNRFSVSGAATTYASHASVSAHFVPTVCNGREIVDSTTSSL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.7	Very low	47.5	Very low	243 Å²	243	130.9 Å²	130.9	100%	1.197	72%	0.721	S	S	*	*				0	129.7	0	-135.6	170.7	156.5	0	0	106.2
2	V	46.2	Very low	47.3	Very low	145 Å²	145	132 Å²	132	88%	0.879	72%	0.72	S	S	*	*			trans	83.2	97.1	-161.1	-167.8	0	0	0	0	113.4
3	S	44.7	Very low	46.9	Very low	97 Å²	97	133.1 Å²	133.1	68%	0.678	72%	0.72	S	S	*	*			trans	170.9	26.2	151.7	44.6	0	0	0	0	116
4	H	44.4	Very low	46.4	Very low	166 Å²	166	128.1 Å²	128.1	77%	0.769	70%	0.7	S	S	*	*			trans	-146.5	58.9	172	-73.8	-60.4	0	0	0	113.5
5	L	48.4	Very low	45.6	Very low	149 Å²	149	128.3 Å²	128.3	78%	0.78	69%	0.694	S	S	*	*	S	Bend	trans	-110.1	-18	171.3	-139.7	75	0	0	0	116.4
6	P	47.4	Very low	44.9	Very low	103 Å²	103	123.9 Å²	123.9	67%	0.669	69%	0.688	S	S	*	*	H	α-helix	trans	-87.6	-17.5	-175.8	32.8	-31.5	0	0	0	114.3
7	S	47.2	Very low	44.1	Very low	79 Å²	79	121.1 Å²	121.1	55%	0.552	69%	0.685	S	S	*	*	H	α-helix	trans	-82.6	-25.9	-176.6	-45.2	0	0	0	0	113.6	V11	S7-V11 WeakPolarHBondContact O-CG2 3.38Å
8	L	47.5	Very low	43.5	Very low	130 Å²	130	122.9 Å²	122.9	68%	0.681	69%	0.691	S	S	*	*	H	α-helix	trans	-79.3	-30.7	-178.1	-134.5	88	0	0	0	112.4	M12	L8-M12 PolarHBondContact O-N 3.35Å
9	V	52.5	Low	42.9	Very low	87 Å²	87	124.4 Å²	124.4	53%	0.527	70%	0.697	S	S	.	*	H	α-helix	trans	-75.4	-34.4	-179	-179.6	0	0	0	0	111.4	M13	V9-M13 PolarHBondContact O-N 3.43Å
10	F	47.4	Very low	42.1	Very low	153 Å²	153	122.2 Å²	122.2	67%	0.671	70%	0.695	S	S	*	*	H	α-helix	trans	-73.9	-32.5	179.5	-153.8	-96.5	0	0	0	112.9	C14	F10-C14 PolarHBondContact O-N 2.96Å; F10-C14 VanDerWaalsContact O-N 3.12Å; F10-C14 PolarHBondContact O-SG 3.18Å
11	V	50.3	Low	41.4	Very low	88 Å²	88	124 Å²	124	53%	0.533	70%	0.697	S	S	.	*	H	α-helix	trans	-73.1	-37.5	174.3	176.7	0	0	0	0	111.2	S7 C14 Q15	S7-V11 WeakPolarHBondContact O-CG2 3.38Å; V11-C14 PolarHBondContact O-N 2.97Å; V11-Q15 PolarHBondContact O-N 3.07Å
12	M	45.3	Very low	40.4	Very low	144 Å²	144	117.6 Å²	117.6	71%	0.709	67%	0.674	S	S	*	*	H	α-helix	trans	-67.5	-33.8	173.5	-87.6	-170.6	161.5	0	0	113.3	L8 G16	L8-M12 PolarHBondContact O-N 3.35Å; M12-G16 PolarHBondContact O-N 3.24Å
13	M	42.1	Very low	39.7	Very low	146 Å²	146	116.6 Å²	116.6	72%	0.719	67%	0.671	S	S	*	*	H	α-helix	trans	-75.1	-32	175.2	-78.4	-161.5	168.5	0	0	113.5	V9	V9-M13 PolarHBondContact O-N 3.43Å
14	C	39.1	Very low	39.4	Very low	64 Å²	64	119.1 Å²	119.1	43%	0.432	68%	0.676	S	S	.	*	H	α-helix	trans	-78	-29.5	176.4	-70.9	0	0	0	0	113.4	F10 V11	F10-C14 PolarHBondContact O-N 2.96Å; F10-C14 VanDerWaalsContact O-N 3.12Å; F10-C14 PolarHBondContact O-SG 3.18Å; V11-C14 PolarHBondContact O-N 2.97Å
15	Q	35	Very low	39.6	Very low	130 Å²	130	116 Å²	116	61%	0.607	67%	0.673	S	S	*	*	H	α-helix	trans	-75.1	-25.6	171.5	-91.4	174.3	-34.3	0	0	113.1	V11 A17	V11-Q15 PolarHBondContact O-N 3.07Å; Q15-A17 VanDerWaalsContact C-N 3.29Å; Q15-A17 PolarHBondContact O-N 3.3Å
16	G	33.6	Very low	40.3	Very low	59 Å²	59	114.3 Å²	114.3	61%	0.608	66%	0.656	S	S	*	*	H	α-helix	trans	-71.4	-19	172.7	0	0	0	0	0	114.6	M12	M12-G16 PolarHBondContact O-N 3.24Å
17	A	32.6	Very low	42	Very low	76 Å²	76	115 Å²	115	63%	0.628	65%	0.645	S	S	*	*	H	α-helix	trans	-96.2	-12.9	-179.4	0	0	0	0	0	114.2	Q15	Q15-A17 VanDerWaalsContact C-N 3.29Å; Q15-A17 PolarHBondContact O-N 3.3Å
18	L	32.6	Very low	44	Very low	153 Å²	153	113.4 Å²	113.4	80%	0.801	63%	0.629	S	S	*	*	S	Bend	trans	-106.4	2.6	-179	-77.9	164.1	0	0	0	114.1
19	L	32.2	Very low	46.1	Very low	152 Å²	152	107.4 Å²	107.4	80%	0.796	60%	0.597	S	S	*	*			trans	-122	31.3	171.3	-72.6	172.9	0	0	0	111.8	E21	L19-E21 VanDerWaalsContact C-N 3.32Å; L19-E21 PolarHBondContact O-N 2.67Å
20	A	26.6	Very low	48	Very low	80 Å²	80	108.4 Å²	108.4	66%	0.661	59%	0.592	S	S	*	*			trans	-79.5	92.9	154	0	0	0	0	0	106.3
21	E	26.6	Very low	50.1	Low	160 Å²	160	103.6 Å²	103.6	75%	0.748	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-48.8	136.3	153.8	-75.5	-176.3	158.5	0	0	107	L19	L19-E21 VanDerWaalsContact C-N 3.32Å; L19-E21 PolarHBondContact O-N 2.67Å
22	P	26.7	Very low	52	Low	109 Å²	109	107.4 Å²	107.4	71%	0.708	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-52.3	140.4	171.3	24.9	-31.8	0	0	0	107.1	L24	P22-L24 PolarHBondContact O-N 3.26Å
23	P	30.6	Very low	54	Low	124 Å²	124	101.7 Å²	101.7	81%	0.805	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-49.8	122	175.9	21.6	-31.5	0	0	0	107	S25	P23-S25 PolarHBondContact O-N 3.32Å
24	L	38.8	Very low	56.2	Low	149 Å²	149	99.1 Å²	99.1	78%	0.78	55%	0.552	S	S	*	*			trans	-45	111.7	180	-128.4	114.3	0	0	0	106.7	P22 R26	P22-L24 PolarHBondContact O-N 3.26Å; L24-R26 PolarHBondContact O-N 3.03Å
25	S	48.1	Very low	58.7	Low	101 Å²	101	96.6 Å²	96.6	71%	0.706	53%	0.534	S	S	*	.			trans	-53.2	114.9	-177.2	55.6	0	0	0	0	107.5	P23 R27	P23-S25 PolarHBondContact O-N 3.32Å; S25-R27 PolarHBondContact O-N 3.06Å; S25-R27 VanDerWaalsContact O-N 3.12Å
26	R	63.8	Low	61.4	Low	113 Å²	113	90.6 Å²	90.6	43%	0.426	51%	0.506	S	S	.	.			trans	-52.2	121.8	178.8	-179.9	-177.1	-96.7	-172.4	-13	107.5	L24 E28 Q104 E107	L24-R26 PolarHBondContact O-N 3.03Å; R26-E28 PolarHBondContact O-N 2.83Å; R26-Q104 VanDerWaalsContact CZ-OE1 3.22Å; R26-E107 IonicContact NH1-OE2 3.51Å
27	R	82.9	Confident	64.4	Low	117 Å²	117	87.8 Å²	87.8	44%	0.442	48%	0.477	S	S	.	.			trans	-76.5	120.7	-178.8	-67	-173.7	-176.3	-176.2	4.6	108.9	S25 W346 D349	S25-R27 PolarHBondContact O-N 3.06Å; S25-R27 VanDerWaalsContact O-N 3.12Å; R27-W346 HydrophobicContact CB-CZ2 4Å; R27-W346 WeakPolarHBondContact O-CZ2 3.43Å; R27-D349 IonicContact CZ-OD2 3.78Å; R27-D349 IonicContact NH1-OD1 3.89Å; R27-D349 IonicContact NH1-OD2 2.61Å; R27-D349 PolarHBondContact NH1-OD2 3.35Å
28	E	89.5	Confident	67.4	Low	47 Å²	47	84.2 Å²	84.2	22%	0.22	45%	0.447	C	S	.	.			trans	-146.7	160.3	179.8	62.1	-177.4	-170.7	0	0	109.8	R26 R30 H90 L92	R26-E28 PolarHBondContact O-N 2.83Å; E28-R30 HydrophobicContact CG-CG 4.29Å; E28-R30 WeakPolarHBondContact OE1-CD 3.34Å; E28-R30 IonicContact OE1-CZ 3.06Å; E28-R30 IonicContact OE1-NE 3.54Å; E28-R30 PolarHBondContact OE1-NE 3.3Å; E28-R30 IonicContact OE1-NH1 3.85Å; E28-R30 PolarHBondContact OE1-NH1 2.85Å; E28-H90 IonicContact OE2-CD2 2.69Å; E28-H90 IonicContact OE2-CE1 3.13Å; E28-H90 IonicContact OE2-NE2 2.78Å; E28-H90 PolarHBondContact OE2-NE2 3.17Å; E28-L92 HydrophobicContact CB-CD2 3.67Å
29	I	91.9	Very high	70.5	Confident	3 Å²	3	76.9 Å²	76.9	2%	0.015	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	123.7	168.8	-59.2	174.1	0	0	0	107.6	I31 L65 L69 V89 H90 I91 R343 N344 P345 W346	I29-I31 HydrophobicContact CG2-CD1 4.37Å; I29-I31 HydrophobicContact CG2-CG1 4.15Å; I29-L65 HydrophobicContact CD1-CD1 3.96Å; I29-L65 HydrophobicContact CD1-CD2 3.71Å; I29-L65 HydrophobicContact CD1-CG 4.23Å; I29-L69 HydrophobicContact CD1-CD1 4.41Å; I29-V89 HydrophobicContact CG2-CG2 4.35Å; I29-H90 CarbonylContact O-C 3.59Å; I29-H90 VanDerWaalsContact O-CA 3.26Å; I29-H90 WeakPolarHBondContact O-CA 3.32Å; I29-I91 HydrophobicContact CB-CB 4.07Å; I29-I91 HydrophobicContact CD1-CB 4.48Å; I29-I91 HydrophobicContact CD1-CD1 4.44Å; I29-I91 PolarHBondContact N-O 3.08Å; I29-I91 VanDerWaalsContact N-O 3.07Å; I29-I91 PolarHBondContact O-N 3.2Å; I29-R343 WeakPolarHBondContact CG1-O 3.18Å; I29-R343 WeakPolarHBondContact CG2-O 3.44Å; I29-N344 HydrophobicContact CD1-CB 4.2Å; I29-P345 VanDerWaalsContact CG1-CD 3.42Å; I29-P345 HydrophobicContact CG1-CG 4.22Å; I29-W346 HydrophobicContact CD1-CE3 4.17Å; I29-W346 HydrophobicContact CD1-CZ3 3.8Å; I29-W346 HydrophobicContact CG1-CE3 4.36Å; I29-W346 HydrophobicContact CG1-CZ3 3.74Å
30	R	91.2	Very high	73.5	Confident	108 Å²	108	69.7 Å²	69.7	41%	0.408	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	120.2	173.3	-75.9	-179.4	141.5	167.3	-24.7	109.5	E28 V89	E28-R30 HydrophobicContact CG-CG 4.29Å; E28-R30 WeakPolarHBondContact OE1-CD 3.34Å; E28-R30 IonicContact OE1-CZ 3.06Å; E28-R30 IonicContact OE1-NE 3.54Å; E28-R30 PolarHBondContact OE1-NE 3.3Å; E28-R30 IonicContact OE1-NH1 3.85Å; E28-R30 PolarHBondContact OE1-NH1 2.85Å; R30-V89 WeakPolarHBondContact CA-O 3.42Å
31	I	91.9	Very high	76.9	Confident	53 Å²	53	65.9 Å²	65.9	27%	0.272	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	121.7	171.7	-54	178	0	0	0	106.5	I29 L69 G88 V89	I29-I31 HydrophobicContact CG2-CD1 4.37Å; I29-I31 HydrophobicContact CG2-CG1 4.15Å; I31-L69 HydrophobicContact CD1-CD2 3.87Å; I31-G88 CarbonylContact O-C 3.51Å; I31-G88 WeakPolarHBondContact O-CA 3.32Å; I31-V89 HydrophobicContact CB-CG2 4Å; I31-V89 HydrophobicContact CD1-CG2 3.82Å; I31-V89 HydrophobicContact CG1-CG2 3.9Å; I31-V89 PolarHBondContact N-O 3.41Å; I31-V89 PolarHBondContact O-N 3.3Å
32	E	89.9	Confident	80.1	Confident	167 Å²	167	58.2 Å²	58.2	78%	0.78	30%	0.304	S	S	*	.			trans	-69.7	149.7	178.6	-63.9	-175.7	174.9	0	0	111.4
33	G	88.2	Confident	83.3	Confident	24 Å²	24	53 Å²	53	25%	0.247	27%	0.271	C	S	.	.			trans	-168.4	168.9	174.6	0	0	0	0	0	110	L35	G33-L35 PolarHBondContact O-N 3.05Å
34	D	88.4	Confident	86.1	Confident	92 Å²	92	48.4 Å²	48.4	49%	0.492	24%	0.238	S	C	.	.	S	Bend	trans	-62.7	-32.9	178.5	-64.3	-63.2	0	0	0	112	V85 S86 L419	D34-V85 HydrophobicContact CB-CG1 3.78Å; D34-S86 PolarHBondContact N-O 3.26Å; D34-S86 PolarHBondContact N-OG 2.71Å; D34-S86 VanDerWaalsContact N-OG 3.14Å; D34-S86 PolarHBondContact OD2-N 3.4Å; D34-S86 PolarHBondContact OD2-OG 3.46Å; D34-L419 HydrophobicContact CB-CD1 3.65Å; D34-L419 HydrophobicContact CB-CG 4.49Å; D34-L419 WeakPolarHBondContact O-CD1 3.25Å
35	L	91	Very high	88.3	Confident	12 Å²	12	43.8 Å²	43.8	6%	0.063	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	138.6	168.5	-62.4	176.2	0	0	0	109.4	G33 V85 S86 L87 G88 L405 L419 L426	G33-L35 PolarHBondContact O-N 3.05Å; L35-V85 HydrophobicContact CD1-CG1 4.29Å; L35-V85 HydrophobicContact CG-CG1 4.29Å; L35-S86 PolarHBondContact N-O 3.15Å; L35-L87 HydrophobicContact CB-CD2 3.9Å; L35-L87 HydrophobicContact CD1-CD2 4.42Å; L35-L87 CarbonylContact O-C 3.58Å; L35-L87 WeakPolarHBondContact O-CA 3.35Å; L35-G88 PolarHBondContact O-N 2.96Å; L35-L405 HydrophobicContact CD1-CD1 3.99Å; L35-L405 HydrophobicContact CD1-CD2 4.09Å; L35-L405 HydrophobicContact CD1-CG 4.43Å; L35-L419 HydrophobicContact CD1-CD2 4.1Å; L35-L419 HydrophobicContact CD2-CD1 3.84Å; L35-L419 HydrophobicContact CD2-CD2 4.14Å; L35-L419 HydrophobicContact CG-CD1 3.95Å; L35-L419 HydrophobicContact CG-CD2 4.14Å; L35-L426 HydrophobicContact CD2-CD1 4.1Å
36	V	92.8	Very high	89.8	Confident	4 Å²	4	42 Å²	42	2%	0.024	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	130.8	-178.2	-177.1	0	0	0	0	111.2	H90 L136 I138 A139	V36-H90 HydrophobicContact CG1-CB 4.09Å; V36-L136 HydrophobicContact CG2-CB 4.48Å; V36-L136 HydrophobicContact CG2-CD2 4.13Å; V36-I138 HydrophobicContact CB-CD1 4.28Å; V36-I138 HydrophobicContact CG1-CD1 3.71Å; V36-A139 PolarHBondContact O-N 2.97Å
37	L	96.1	Very high	90.4	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	130.7	172.1	-58.3	-171.2	0	0	0	111.2	M68 I72 G88 V89 H90 A139 M401 L405	L37-M68 HydrophobicContact CB-CE 3.96Å; L37-I72 HydrophobicContact CD1-CD1 4.08Å; L37-G88 PolarHBondContact N-O 3.47Å; L37-V89 CarbonylContact O-C 3.53Å; L37-V89 VanDerWaalsContact O-CA 3.26Å; L37-V89 WeakPolarHBondContact O-CA 3.31Å; L37-H90 PolarHBondContact O-N 3.35Å; L37-A139 HydrophobicContact CD2-CB 4.12Å; L37-M401 HydrophobicContact CD1-CB 4.33Å; L37-M401 HydrophobicContact CD1-CG 3.98Å; L37-M401 HydrophobicContact CD2-CG 3.69Å; L37-L405 HydrophobicContact CD2-CD1 4.23Å
38	G	95.9	Very high	89.7	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	144.2	170.7	0	0	0	0	0	110.8	H90 G140 V141 I142	G38-H90 CarbonylContact C-O 3.59Å; G38-H90 WeakPolarHBondContact CA-O 3.32Å; G38-G140 PolarHBondContact N-O 3.01Å; G38-V141 CarbonylContact O-C 3.58Å; G38-V141 WeakPolarHBondContact O-CA 3.39Å; G38-I142 PolarHBondContact O-N 3.37Å
39	G	96.7	Very high	88.6	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	131.6	176.5	0	0	0	0	0	111.8	H90 I91 L92 I142	G39-H90 PolarHBondContact N-O 3.06Å; G39-I91 WeakPolarHBondContact O-CA 3.34Å; G39-L92 PolarHBondContact O-N 3.12Å; G39-I142 WeakPolarHBondContact CA-O 3.5Å
40	L	96.9	Very high	87	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	107.1	176.4	-70.9	174.4	0	0	0	110.7	L92 T94 F108 V141 I142 V153 Y167	L40-L92 HydrophobicContact CD2-CB 4.1Å; L40-T94 HydrophobicContact CB-CG2 3.75Å; L40-T94 HydrophobicContact CD2-CG2 4.04Å; L40-T94 HydrophobicContact CG-CG2 4.39Å; L40-F108 HydrophobicContact CD1-CE2 4.02Å; L40-F108 HydrophobicContact CD2-CE2 3.74Å; L40-F108 HydrophobicContact CD2-CZ 3.97Å; L40-F108 HydrophobicContact CG-CE2 3.68Å; L40-F108 HydrophobicContact CG-CZ 4.1Å; L40-V141 HydrophobicContact CD1-CG1 4.05Å; L40-V141 HydrophobicContact CG-CG1 4.25Å; L40-I142 PolarHBondContact N-O 3.06Å; L40-V153 HydrophobicContact CD1-CB 4.33Å; L40-V153 HydrophobicContact CD1-CG1 3.71Å; L40-V153 HydrophobicContact CD1-CG2 3.84Å; L40-Y167 PolarHBondContact O-OH 3.14Å
41	F	96.1	Very high	85.8	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	147.7	-178.8	-62.6	-86.9	0	0	0	111.4	V43 R64 L65 M68 I91 L92 D93 T94 Y167 V394	F41-V43 HydrophobicContact CB-CG2 4.34Å; F41-V43 PolarHBondContact O-N 3.31Å; F41-R64 HydrophobicContact CD1-CB 3.71Å; F41-R64 HydrophobicContact CE1-CB 3.93Å; F41-R64 WeakPolarHBondContact CE1-O 3.46Å; F41-L65 HydrophobicContact CB-CB 4.27Å; F41-L65 HydrophobicContact CD1-CB 4.39Å; F41-L65 HydrophobicContact CD2-CB 4.16Å; F41-L65 HydrophobicContact CD2-CG 4.4Å; F41-L65 HydrophobicContact CG-CB 4Å; F41-M68 HydrophobicContact CE2-CB 4.15Å; F41-M68 HydrophobicContact CE2-CG 4.48Å; F41-M68 HydrophobicContact CE2-SD 3.52Å; F41-M68 VanDerWaalsContact CE2-SD 3.52Å; F41-M68 HydrophobicContact CZ-CB 3.67Å; F41-M68 HydrophobicContact CZ-CG 4.28Å; F41-M68 HydrophobicContact CZ-SD 3.65Å; F41-I91 HydrophobicContact CD2-CG2 3.56Å; F41-I91 HydrophobicContact CE2-CD1 4.36Å; F41-I91 HydrophobicContact CE2-CG2 4.05Å; F41-L92 PolarHBondContact N-O 3.29Å; F41-D93 WeakPolarHBondContact O-CA 3.34Å; F41-T94 PolarHBondContact O-N 2.99Å; F41-T94 PolarHBondContact O-OG1 2.99Å; F41-Y167 AromaticContact CD1-CE1 4Å; F41-Y167 HydrophobicContact CD1-CE1 4Å; F41-Y167 AromaticContact CD1-CZ 3.74Å; F41-Y167 WeakPolarHBondContact CD1-OH 3.41Å; F41-Y167 HydrophobicContact CE1-CD1 4.42Å; F41-Y167 AromaticContact CE1-CE1 3.55Å; F41-Y167 HydrophobicContact CE1-CE1 3.55Å; F41-Y167 AromaticContact CE1-CZ 3.7Å; F41-Y167 HydrophobicContact CZ-CE1 4.18Å; F41-V394 HydrophobicContact CE1-CG1 4.09Å; F41-V394 HydrophobicContact CZ-CG1 4.29Å
42	P	93.8	Very high	84.8	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.283	C	S	.	.			trans	-82.4	72.3	173.1	34.3	-33.4	0	0	0	109.4	H44 R60 G61 T94 S96 Y146	P42-H44 PolarHBondContact O-N 3.36Å; P42-R60 HydrophobicContact CG-CB 4.37Å; P42-R60 WeakPolarHBondContact CG-O 3.36Å; P42-G61 WeakPolarHBondContact O-CA 3.41Å; P42-T94 WeakPolarHBondContact CA-OG1 3.22Å; P42-S96 WeakPolarHBondContact CB-OG 3.41Å; P42-Y146 HydrophobicContact CB-CE2 4.09Å; P42-Y146 HydrophobicContact CG-CE2 4.49Å
43	V	93.7	Very high	84.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	26%	0.256	C	S	.	.			trans	-62.7	-38.8	-179	-177.1	0	0	0	0	109.9	F41 N57 I62 L65 D93 W346	F41-V43 HydrophobicContact CB-CG2 4.34Å; F41-V43 PolarHBondContact O-N 3.31Å; V43-N57 PolarHBondContact O-N 3.3Å; V43-I62 HydrophobicContact CG1-CD1 3.86Å; V43-L65 HydrophobicContact CG2-CD1 3.79Å; V43-D93 HydrophobicContact CB-CB 4.18Å; V43-D93 WeakPolarHBondContact CB-OD1 3.27Å; V43-D93 HydrophobicContact CG2-CB 4.15Å; V43-D93 PolarHBondContact N-OD1 2.91Å; V43-W346 HydrophobicContact CG1-CB 3.74Å; V43-W346 HydrophobicContact CG1-CD2 3.89Å; V43-W346 HydrophobicContact CG1-CE3 4.35Å; V43-W346 HydrophobicContact CG1-CG 3.62Å; V43-W346 HydrophobicContact CG2-CD2 4.36Å; V43-W346 HydrophobicContact CG2-CE3 4.18Å; V43-W346 HydrophobicContact CG2-CZ3 4.35Å
44	H	90.6	Very high	84.5	Confident	27 Å²	27	43.7 Å²	43.7	13%	0.125	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	148.9	171.6	-60.7	88.5	0	0	0	112.9	P42 C53 G54 R55 D93 C95 S96 W346	P42-H44 PolarHBondContact O-N 3.36Å; H44-C53 HydrophobicContact CB-CB 3.9Å; H44-G54 PolarHBondContact CD2-O 3.01Å; H44-R55 CarbonylContact C-O 3.55Å; H44-R55 VanDerWaalsContact CA-O 3.31Å; H44-R55 WeakPolarHBondContact CA-O 3.41Å; H44-D93 IonicContact CE1-OD2 3.97Å; H44-D93 IonicContact CG-OD2 2.66Å; H44-D93 PolarHBondContact N-OD1 3.5Å; H44-D93 PolarHBondContact N-OD2 3.16Å; H44-D93 IonicContact ND1-OD2 3.43Å; H44-D93 PolarHBondContact ND1-OD2 3.06Å; H44-C95 CarbonylContact O-C 3.51Å; H44-C95 WeakPolarHBondContact O-CA 3.47Å; H44-S96 PolarHBondContact O-N 3.5Å; H44-S96 PolarHBondContact O-OG 3.33Å; H44-W346 AromaticContact CE1-CD1 3.64Å; H44-W346 AromaticContact CE1-NE1 3.88Å
45	E	84.6	Confident	84.5	Confident	51 Å²	51	46.2 Å²	46.2	24%	0.238	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	166.9	161.8	-64.6	-175.2	169	0	0	110.3	G47 G54 R55 N57	E45-G47 PolarHBondContact O-N 3.03Å; E45-G54 WeakPolarHBondContact O-CA 3.32Å; E45-G54 PolarHBondContact O-N 3.39Å; E45-R55 PolarHBondContact N-O 3.15Å; E45-N57 HydrophobicContact CG-CB 4.3Å
46	K	79	Confident	84.4	Confident	64 Å²	64	46 Å²	46	28%	0.278	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	129	175.8	178.6	159	-175	-97.8	0	111	C95 R97	K46-C95 WeakPolarHBondContact CA-O 3.47Å; K46-R97 HydrophobicContact CB-CG 4.38Å; K46-R97 HydrophobicContact CD-CG 3.68Å; K46-R97 HydrophobicContact CG-CG 3.76Å
47	G	76.8	Confident	84.2	Confident	7 Å²	7	46.5 Å²	46.5	7%	0.072	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-63.9	154.9	177.2	0	0	0	0	0	114.3	E45	E45-G47 PolarHBondContact O-N 3.03Å
48	A	67.8	Low	83.7	Confident	83 Å²	83	48 Å²	48	69%	0.686	27%	0.268	S	S	*	.	S	Bend	trans	-97.6	130.3	177.2	0	0	0	0	0	111.2	M50	A48-M50 PolarHBondContact O-N 2.95Å
49	G	66.4	Low	83.2	Confident	80 Å²	80	50.3 Å²	50.3	83%	0.825	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	-119	177.5	0	0	0	0	0	113.2
50	M	59.2	Low	82.7	Confident	199 Å²	199	51.1 Å²	51.1	98%	0.98	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-11.7	-178.1	-73	-175.5	173.6	0	0	114	A48	A48-M50 PolarHBondContact O-N 2.95Å
51	E	66.1	Low	82.4	Confident	128 Å²	128	51.1 Å²	51.1	60%	0.598	28%	0.283	S	S	*	.			trans	-72.7	132.6	176.6	-67.1	-178.9	166.6	0	0	110.9	R97	E51-R97 PolarHBondContact O-NH1 2.98Å
52	E	71.9	Confident	82.3	Confident	113 Å²	113	51.1 Å²	51.1	53%	0.528	28%	0.283	S	S	.	.	S	Bend	trans	-69.5	-45.8	-179.4	-68.8	-177	170.9	0	0	111.5	R97 Y100	E52-R97 WeakPolarHBondContact O-CD 3.47Å; E52-R97 PolarHBondContact O-NH1 2.83Å; E52-Y100 HydrophobicContact CB-CD2 4.37Å; E52-Y100 HydrophobicContact CB-CE2 4.44Å; E52-Y100 WeakPolarHBondContact OE2-CE2 3.35Å
53	C	85.9	Confident	82.3	Confident	32 Å²	32	51.1 Å²	51.1	22%	0.216	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	147	-175.4	-51.7	0	0	0	0	110.5	H44 C95	H44-C53 HydrophobicContact CB-CB 3.9Å; C53-C95 HydrophobicContact CB-CB 3.74Å; C53-C95 WeakPolarHBondContact CB-SG 3.42Å; C53-C95 WeakPolarHBondContact SG-CB 3.42Å; C53-C95 CovalentContact SG-SG 2.01Å; C53-C95 PolarHBondContact SG-SG 3.19Å
54	G	85.7	Confident	82.4	Confident	25 Å²	25	51.2 Å²	51.2	26%	0.258	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	-144	-178.9	0	0	0	0	0	112.8	H44 E45	H44-G54 PolarHBondContact CD2-O 3.01Å; E45-G54 WeakPolarHBondContact O-CA 3.32Å; E45-G54 PolarHBondContact O-N 3.39Å
55	R	86.7	Confident	82.6	Confident	145 Å²	145	50 Å²	50	55%	0.547	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	157.6	177.3	-68.4	-179	-179.6	178.9	-0.8	111.8	H44 E45 N57	H44-R55 CarbonylContact C-O 3.55Å; H44-R55 VanDerWaalsContact CA-O 3.31Å; H44-R55 WeakPolarHBondContact CA-O 3.41Å; E45-R55 PolarHBondContact N-O 3.15Å; R55-N57 PolarHBondContact O-N 3.21Å
56	V	89.3	Confident	83.2	Confident	9 Å²	9	47.5 Å²	47.5	6%	0.055	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	129.6	174.8	179.9	0	0	0	0	109.2	I62 D349 F350 Q353	V56-I62 HydrophobicContact CG1-CD1 4.03Å; V56-I62 HydrophobicContact CG1-CG1 3.65Å; V56-D349 HydrophobicContact CG2-CB 4.15Å; V56-F350 HydrophobicContact CG1-CB 4.1Å; V56-Q353 PolarHBondContact O-NE2 2.87Å
57	N	88.3	Confident	84	Confident	14 Å²	14	44.5 Å²	44.5	8%	0.075	25%	0.253	C	S	.	.			trans	-89.5	104.2	174.6	-167.6	-37.2	0	0	0	109.2	V43 E45 R55 D59 R60 G61 I62	V43-N57 PolarHBondContact O-N 3.3Å; E45-N57 HydrophobicContact CG-CB 4.3Å; R55-N57 PolarHBondContact O-N 3.21Å; N57-D59 PolarHBondContact OD1-N 3.36Å; N57-R60 PolarHBondContact OD1-N 3.1Å; N57-G61 WeakPolarHBondContact O-CA 3.24Å; N57-G61 PolarHBondContact O-N 3.47Å; N57-G61 VanDerWaalsContact O-N 3.16Å; N57-I62 PolarHBondContact O-N 2.89Å
58	E	87.4	Confident	85	Confident	31 Å²	31	44.1 Å²	44.1	15%	0.145	25%	0.25	C	C	.	.	I	π-helix	trans	-61.6	-56.9	-180	172.3	168.4	-168.7	0	0	111.8	I62 Q63 F350 R354	E58-I62 PolarHBondContact O-N 3.5Å; E58-Q63 PolarHBondContact O-N 2.84Å; E58-F350 HydrophobicContact CB-CD2 4.16Å; E58-F350 HydrophobicContact CB-CE2 3.76Å; E58-F350 HydrophobicContact CG-CD2 4.21Å; E58-F350 HydrophobicContact CG-CE2 3.38Å; E58-F350 HydrophobicContact CG-CZ 3.97Å; E58-F350 WeakPolarHBondContact OE1-CZ 3.49Å; E58-R354 WeakPolarHBondContact OE1-CD 3.47Å; E58-R354 IonicContact OE1-CZ 3.3Å; E58-R354 IonicContact OE1-NE 3.75Å; E58-R354 PolarHBondContact OE1-NE 2.78Å; E58-R354 IonicContact OE1-NH1 2.69Å; E58-R354 PolarHBondContact OE1-NH1 3.48Å; E58-R354 IonicContact OE1-NH2 2.89Å; E58-R354 IonicContact OE2-CZ 3.55Å; E58-R354 IonicContact OE2-NE 2.84Å; E58-R354 IonicContact OE2-NH1 2.7Å; E58-R354 PolarHBondContact OE2-NH1 2.82Å
59	D	84.3	Confident	86.4	Confident	49 Å²	49	40.3 Å²	40.3	26%	0.262	22%	0.218	S	C	.	.	I	π-helix	trans	-72.7	-52.5	-168.2	-52.9	-32.3	0	0	0	111.2	N57 Q63 E388	N57-D59 PolarHBondContact OD1-N 3.36Å; D59-Q63 WeakPolarHBondContact O-CB 3.46Å; D59-E388 HydrophobicContact CB-CB 4.45Å; D59-E388 HydrophobicContact CB-CG 4.22Å
60	R	86.5	Confident	87.8	Confident	16 Å²	16	36.6 Å²	36.6	6%	0.06	18%	0.179	C	C	.	.	I	π-helix	trans	-90.5	-20	-172	-60.5	-177.1	177.6	-167.8	-2.4	113.5	P42 N57 R64 S274 G298 Q302	P42-R60 HydrophobicContact CG-CB 4.37Å; P42-R60 WeakPolarHBondContact CG-O 3.36Å; N57-R60 PolarHBondContact OD1-N 3.1Å; R60-R64 VanDerWaalsContact O-CD 3.26Å; R60-R64 WeakPolarHBondContact O-CD 3.48Å; R60-R64 WeakPolarHBondContact O-CG 3.4Å; R60-R64 PolarHBondContact O-NH1 3.29Å; R60-S274 PolarHBondContact NH1-OG 3.44Å; R60-S274 VanDerWaalsContact NH2-CB 3.31Å; R60-G298 PolarHBondContact NH2-O 3.47Å; R60-Q302 VanDerWaalsContact NH2-CD 3.34Å
61	G	91.2	Very high	89.6	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.132	C	C	.	.	I	π-helix	trans	-95.2	-77.4	-179.8	0	0	0	0	0	110.9	P42 N57 R64 L65	P42-G61 WeakPolarHBondContact O-CA 3.41Å; N57-G61 WeakPolarHBondContact O-CA 3.24Å; N57-G61 PolarHBondContact O-N 3.47Å; N57-G61 VanDerWaalsContact O-N 3.16Å; G61-R64 PolarHBondContact O-N 2.95Å; G61-L65 VanDerWaalsContact O-CB 3.31Å; G61-L65 WeakPolarHBondContact O-CB 3.48Å; G61-L65 PolarHBondContact O-N 2.91Å
62	I	93.3	Very high	91.1	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.105	C	C	.	.	I	π-helix	trans	-65.7	-48.2	-170.1	-61.1	-68	0	0	0	112.1	V43 V56 N57 E58 R64 L65 E66 F333 W346 F347 F350	V43-I62 HydrophobicContact CG1-CD1 3.86Å; V56-I62 HydrophobicContact CG1-CD1 4.03Å; V56-I62 HydrophobicContact CG1-CG1 3.65Å; N57-I62 PolarHBondContact O-N 2.89Å; E58-I62 PolarHBondContact O-N 3.5Å; I62-R64 VanDerWaalsContact C-N 3.33Å; I62-R64 PolarHBondContact O-N 3.29Å; I62-L65 PolarHBondContact O-N 2.99Å; I62-E66 HydrophobicContact CG2-CG 4.32Å; I62-E66 WeakPolarHBondContact O-CB 3.43Å; I62-E66 WeakPolarHBondContact O-CG 3.29Å; I62-E66 PolarHBondContact O-N 3.11Å; I62-F333 HydrophobicContact CG2-CE2 4.04Å; I62-F333 HydrophobicContact CG2-CZ 4.21Å; I62-W346 HydrophobicContact CD1-CB 3.92Å; I62-F347 HydrophobicContact CG2-CD2 4.13Å; I62-F347 HydrophobicContact CG2-CE2 4.47Å; I62-F350 HydrophobicContact CD1-CB 4.28Å; I62-F350 HydrophobicContact CG1-CB 4.04Å; I62-F350 HydrophobicContact CG1-CD2 4.39Å; I62-F350 HydrophobicContact CG1-CG 4.17Å; I62-F350 HydrophobicContact CG2-CD1 4.18Å; I62-F350 HydrophobicContact CG2-CG 4.25Å
63	Q	94.1	Very high	92.3	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.005	9%	0.092	C	C	.	.	I	π-helix	trans	-61.7	-41.1	-179.9	-61.6	-173.6	26.3	0	0	111.9	E58 D59 E66 A67 F329 F333 E386 I391	E58-Q63 PolarHBondContact O-N 2.84Å; D59-Q63 WeakPolarHBondContact O-CB 3.46Å; Q63-E66 PolarHBondContact O-N 3.26Å; Q63-A67 WeakPolarHBondContact O-CB 3.31Å; Q63-A67 PolarHBondContact O-N 3.41Å; Q63-F329 HydrophobicContact CB-CE1 4.45Å; Q63-F329 HydrophobicContact CB-CZ 4.37Å; Q63-F329 VanDerWaalsContact O-CZ 3.26Å; Q63-F329 WeakPolarHBondContact O-CZ 3.38Å; Q63-F333 HydrophobicContact CB-CE2 4.48Å; Q63-F333 HydrophobicContact CG-CE1 4.31Å; Q63-F333 HydrophobicContact CG-CE2 4.04Å; Q63-F333 HydrophobicContact CG-CZ 3.88Å; Q63-E386 PolarHBondContact NE2-O 3.26Å; Q63-I391 HydrophobicContact CB-CD1 4.36Å
64	R	94.9	Very high	92.7	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.008	10%	0.098	C	C	.	.	H	α-helix	trans	-69.8	-39.4	179.3	-63.4	-165.3	-170.3	148.5	-11.1	113	F41 R60 G61 I62 A67 M68 S145 E388 V394	F41-R64 HydrophobicContact CD1-CB 3.71Å; F41-R64 HydrophobicContact CE1-CB 3.93Å; F41-R64 WeakPolarHBondContact CE1-O 3.46Å; R60-R64 VanDerWaalsContact O-CD 3.26Å; R60-R64 WeakPolarHBondContact O-CD 3.48Å; R60-R64 WeakPolarHBondContact O-CG 3.4Å; R60-R64 PolarHBondContact O-NH1 3.29Å; G61-R64 PolarHBondContact O-N 2.95Å; I62-R64 VanDerWaalsContact C-N 3.33Å; I62-R64 PolarHBondContact O-N 3.29Å; R64-A67 WeakPolarHBondContact O-CB 3.44Å; R64-A67 PolarHBondContact O-N 3.2Å; R64-M68 PolarHBondContact O-N 3.33Å; R64-S145 PolarHBondContact NH1-OG 3.43Å; R64-E388 IonicContact CZ-OE1 3.35Å; R64-E388 IonicContact CZ-OE2 3.3Å; R64-E388 IonicContact NE-OE1 2.82Å; R64-E388 IonicContact NE-OE2 2.84Å; R64-E388 PolarHBondContact NE-OE2 3.15Å; R64-E388 VanDerWaalsContact NH2-CD 3.34Å; R64-E388 IonicContact NH2-OE1 3.31Å; R64-E388 PolarHBondContact NH2-OE1 2.86Å; R64-E388 IonicContact NH2-OE2 2.76Å; R64-V394 HydrophobicContact CB-CG2 4.09Å; R64-V394 HydrophobicContact CG-CG2 4.21Å
65	L	96.1	Very high	93.2	Very high	0 Å²	0	20 Å²	20	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-60.6	-49.3	173.5	177.3	160.6	0	0	0	110.3	I29 F41 V43 G61 I62 A67 M68 L69 I91 W346	I29-L65 HydrophobicContact CD1-CD1 3.96Å; I29-L65 HydrophobicContact CD1-CD2 3.71Å; I29-L65 HydrophobicContact CD1-CG 4.23Å; F41-L65 HydrophobicContact CB-CB 4.27Å; F41-L65 HydrophobicContact CD1-CB 4.39Å; F41-L65 HydrophobicContact CD2-CB 4.16Å; F41-L65 HydrophobicContact CD2-CG 4.4Å; F41-L65 HydrophobicContact CG-CB 4Å; V43-L65 HydrophobicContact CG2-CD1 3.79Å; G61-L65 VanDerWaalsContact O-CB 3.31Å; G61-L65 WeakPolarHBondContact O-CB 3.48Å; G61-L65 PolarHBondContact O-N 2.91Å; I62-L65 PolarHBondContact O-N 2.99Å; L65-A67 PolarHBondContact O-N 3.1Å; L65-M68 PolarHBondContact O-N 2.98Å; L65-M68 VanDerWaalsContact O-N 3.15Å; L65-L69 HydrophobicContact CD2-CD1 3.8Å; L65-L69 HydrophobicContact CD2-CG 4.34Å; L65-L69 PolarHBondContact O-N 3.03Å; L65-I91 HydrophobicContact CD1-CG2 3.88Å; L65-I91 HydrophobicContact CG-CD1 4.19Å; L65-I91 HydrophobicContact CG-CG2 4.13Å; L65-W346 HydrophobicContact CD1-CE3 3.81Å; L65-W346 HydrophobicContact CD1-CZ3 3.76Å
66	E	96	Very high	93.7	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-64.5	-28.7	177.5	-73.4	-65.7	167.2	0	0	112.1	I62 Q63 L69 F70 F329 Y332 F333 L336 N341 N344	I62-E66 HydrophobicContact CG2-CG 4.32Å; I62-E66 WeakPolarHBondContact O-CB 3.43Å; I62-E66 WeakPolarHBondContact O-CG 3.29Å; I62-E66 PolarHBondContact O-N 3.11Å; Q63-E66 PolarHBondContact O-N 3.26Å; E66-L69 PolarHBondContact O-N 3.45Å; E66-F70 VanDerWaalsContact O-CB 3.28Å; E66-F70 WeakPolarHBondContact O-CB 3.44Å; E66-F70 PolarHBondContact O-N 3.02Å; E66-F329 HydrophobicContact CB-CE2 4.3Å; E66-F329 HydrophobicContact CB-CZ 4.4Å; E66-Y332 HydrophobicContact CB-CE1 4.21Å; E66-Y332 PolarHBondContact OE2-OH 2.89Å; E66-F333 HydrophobicContact CB-CD2 4.05Å; E66-F333 HydrophobicContact CB-CE2 4.2Å; E66-F333 HydrophobicContact CG-CD2 4.29Å; E66-F333 HydrophobicContact CG-CE2 4.09Å; E66-L336 HydrophobicContact CG-CD1 4.07Å; E66-N341 PolarHBondContact OE1-ND2 3.31Å; E66-N341 VanDerWaalsContact OE1-ND2 3.12Å; E66-N344 WeakPolarHBondContact OE1-CB 3.48Å; E66-N344 PolarHBondContact OE1-ND2 3.39Å
67	A	96.7	Very high	93.9	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-66.8	-36.2	173.8	0	0	0	0	0	112.7	Q63 R64 L65 A71 F329 I391 V394 V395	Q63-A67 WeakPolarHBondContact O-CB 3.31Å; Q63-A67 PolarHBondContact O-N 3.41Å; R64-A67 WeakPolarHBondContact O-CB 3.44Å; R64-A67 PolarHBondContact O-N 3.2Å; L65-A67 PolarHBondContact O-N 3.1Å; A67-A71 WeakPolarHBondContact O-CB 3.22Å; A67-A71 PolarHBondContact O-N 2.71Å; A67-F329 VanDerWaalsContact CA-CE2 3.43Å; A67-F329 HydrophobicContact CB-CD2 4.14Å; A67-F329 HydrophobicContact CB-CE2 3.74Å; A67-F329 HydrophobicContact CB-CZ 4.16Å; A67-I391 HydrophobicContact CB-CG2 3.95Å; A67-V394 HydrophobicContact CB-CB 4.39Å; A67-V394 HydrophobicContact CB-CG1 4.19Å; A67-V395 HydrophobicContact CB-CG2 4.46Å
68	M	97.3	Very high	94.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-65.8	-45.8	172	176.1	171.1	178	0	0	111.1	L37 F41 R64 L65 F70 A71 I72 V89 I91 I142 V394 V398	L37-M68 HydrophobicContact CB-CE 3.96Å; F41-M68 HydrophobicContact CE2-CB 4.15Å; F41-M68 HydrophobicContact CE2-CG 4.48Å; F41-M68 HydrophobicContact CE2-SD 3.52Å; F41-M68 VanDerWaalsContact CE2-SD 3.52Å; F41-M68 HydrophobicContact CZ-CB 3.67Å; F41-M68 HydrophobicContact CZ-CG 4.28Å; F41-M68 HydrophobicContact CZ-SD 3.65Å; R64-M68 PolarHBondContact O-N 3.33Å; L65-M68 PolarHBondContact O-N 2.98Å; L65-M68 VanDerWaalsContact O-N 3.15Å; M68-F70 VanDerWaalsContact C-N 3.34Å; M68-F70 PolarHBondContact O-N 2.99Å; M68-A71 PolarHBondContact O-N 3.27Å; M68-I72 HydrophobicContact CG-CG1 4.5Å; M68-I72 VanDerWaalsContact O-CG1 3.27Å; M68-I72 WeakPolarHBondContact O-CG1 3.22Å; M68-I72 PolarHBondContact O-N 3.01Å; M68-V89 HydrophobicContact CE-CB 4.18Å; M68-V89 HydrophobicContact CE-CG1 3.77Å; M68-I91 HydrophobicContact CG-CD1 4.5Å; M68-I91 HydrophobicContact SD-CD1 4.16Å; M68-I91 HydrophobicContact SD-CG1 4.29Å; M68-I142 HydrophobicContact CE-CB 4.4Å; M68-I142 HydrophobicContact CE-CG1 4.3Å; M68-I142 HydrophobicContact SD-CB 4.23Å; M68-V394 HydrophobicContact CB-CG1 4.2Å; M68-V398 HydrophobicContact CB-CG2 4.33Å; M68-V398 HydrophobicContact CG-CG2 3.92Å
69	L	97.1	Very high	94.2	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-60.4	-45	176.8	-63.8	179.3	0	0	0	111.6	I29 I31 L65 E66 A71 I72 D73 V89 I91 R343	I29-L69 HydrophobicContact CD1-CD1 4.41Å; I31-L69 HydrophobicContact CD1-CD2 3.87Å; L65-L69 HydrophobicContact CD2-CD1 3.8Å; L65-L69 HydrophobicContact CD2-CG 4.34Å; L65-L69 PolarHBondContact O-N 3.03Å; E66-L69 PolarHBondContact O-N 3.45Å; L69-A71 PolarHBondContact O-N 3.44Å; L69-I72 PolarHBondContact O-N 3.17Å; L69-D73 PolarHBondContact O-N 3.25Å; L69-V89 HydrophobicContact CD2-CG2 3.79Å; L69-I91 HydrophobicContact CD2-CD1 3.83Å; L69-I91 HydrophobicContact CG-CD1 4.19Å; L69-R343 HydrophobicContact CD1-CG 4.46Å
70	F	96.6	Very high	94.5	Very high	3 Å²	3	30.5 Å²	30.5	1%	0.013	16%	0.163	C	C	.	.	H	α-helix	trans	-56.6	-47	173.7	169.6	-98	0	0	0	112.3	E66 M68 I72 D73 R74 D328 F329 Y332 F445	E66-F70 VanDerWaalsContact O-CB 3.28Å; E66-F70 WeakPolarHBondContact O-CB 3.44Å; E66-F70 PolarHBondContact O-N 3.02Å; M68-F70 VanDerWaalsContact C-N 3.34Å; M68-F70 PolarHBondContact O-N 2.99Å; F70-I72 PolarHBondContact O-N 3.07Å; F70-D73 PolarHBondContact O-N 3.44Å; F70-R74 HydrophobicContact CD2-CG 4.41Å; F70-R74 HydrophobicContact CE1-CG 4.19Å; F70-R74 HydrophobicContact CE2-CG 4.06Å; F70-R74 HydrophobicContact CZ-CG 3.93Å; F70-R74 VanDerWaalsContact O-CG 3.25Å; F70-R74 WeakPolarHBondContact O-CG 3.41Å; F70-R74 PolarHBondContact O-N 3.4Å; F70-D328 HydrophobicContact CZ-CB 3.91Å; F70-F329 HydrophobicContact CB-CD2 4.08Å; F70-F329 HydrophobicContact CB-CE2 4.43Å; F70-F329 HydrophobicContact CD1-CD2 4.17Å; F70-F329 HydrophobicContact CE1-CB 4.42Å; F70-F329 HydrophobicContact CG-CD2 4.05Å; F70-Y332 HydrophobicContact CB-CD1 3.87Å; F70-Y332 HydrophobicContact CB-CE1 3.89Å; F70-Y332 HydrophobicContact CB-CG 4.42Å; F70-Y332 AromaticContact CD2-CD1 3.82Å; F70-Y332 HydrophobicContact CD2-CD1 3.82Å; F70-Y332 HydrophobicContact CD2-CD2 4.1Å; F70-Y332 AromaticContact CD2-CG 3.59Å; F70-Y332 HydrophobicContact CD2-CG 3.59Å; F70-Y332 HydrophobicContact CE2-CG 4.32Å; F70-Y332 HydrophobicContact CG-CD1 4.16Å; F70-Y332 HydrophobicContact CG-CG 4.38Å; F70-F445 HydrophobicContact CE1-CE2 4Å; F70-F445 HydrophobicContact CE1-CZ 4.16Å; F70-F445 HydrophobicContact CZ-CE1 4.48Å; F70-F445 HydrophobicContact CZ-CE2 4.45Å; F70-F445 HydrophobicContact CZ-CZ 4.19Å
71	A	97.1	Very high	94.8	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.1	-42.6	-180	0	0	0	0	0	111.8	A67 M68 L69 R74 I75 V395 V398 Y399	A67-A71 WeakPolarHBondContact O-CB 3.22Å; A67-A71 PolarHBondContact O-N 2.71Å; M68-A71 PolarHBondContact O-N 3.27Å; L69-A71 PolarHBondContact O-N 3.44Å; A71-R74 PolarHBondContact O-N 3.08Å; A71-I75 WeakPolarHBondContact O-CD1 3.34Å; A71-I75 VanDerWaalsContact O-CG1 3.28Å; A71-I75 WeakPolarHBondContact O-CG1 3.39Å; A71-I75 PolarHBondContact O-N 3.39Å; A71-V395 HydrophobicContact CB-CG1 4.24Å; A71-V395 HydrophobicContact CB-CG2 4.43Å; A71-V398 HydrophobicContact CB-CB 3.94Å; A71-V398 HydrophobicContact CB-CG1 3.88Å; A71-V398 HydrophobicContact CB-CG2 4.26Å; A71-Y399 HydrophobicContact CB-CD2 4.4Å; A71-Y399 HydrophobicContact CB-CE2 4.15Å
72	I	97.1	Very high	94.8	Very high	4 Å²	4	30.3 Å²	30.3	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-63.4	-46.1	177.5	-67.2	-73.2	0	0	0	111.3	L37 M68 L69 F70 R74 I75 N76 L87 V89 V398	L37-I72 HydrophobicContact CD1-CD1 4.08Å; M68-I72 HydrophobicContact CG-CG1 4.5Å; M68-I72 VanDerWaalsContact O-CG1 3.27Å; M68-I72 WeakPolarHBondContact O-CG1 3.22Å; M68-I72 PolarHBondContact O-N 3.01Å; L69-I72 PolarHBondContact O-N 3.17Å; F70-I72 PolarHBondContact O-N 3.07Å; I72-R74 VanDerWaalsContact C-N 3.26Å; I72-R74 PolarHBondContact O-N 3.11Å; I72-I75 PolarHBondContact O-N 3.2Å; I72-N76 WeakPolarHBondContact O-CB 3.33Å; I72-N76 PolarHBondContact O-N 3.13Å; I72-N76 PolarHBondContact O-ND2 2.98Å; I72-L87 HydrophobicContact CD1-CB 3.95Å; I72-L87 HydrophobicContact CD1-CD1 4.07Å; I72-L87 HydrophobicContact CG2-CB 4.37Å; I72-L87 WeakPolarHBondContact CG2-O 3.4Å; I72-V89 HydrophobicContact CB-CG1 4.4Å; I72-V89 HydrophobicContact CD1-CG1 4Å; I72-V89 HydrophobicContact CG1-CG1 3.65Å; I72-V89 HydrophobicContact CG2-CG1 4.28Å; I72-V398 HydrophobicContact CD1-CG1 3.7Å; I72-V398 HydrophobicContact CG1-CG1 4.06Å
73	D	96	Very high	94.6	Very high	47 Å²	47	31.4 Å²	31.4	25%	0.251	17%	0.17	S	C	.	.	H	α-helix	trans	-58	-41.7	176.6	-67.5	-27	0	0	0	110.9	L69 F70 M77 R343	L69-D73 PolarHBondContact O-N 3.25Å; F70-D73 PolarHBondContact O-N 3.44Å; D73-M77 VanDerWaalsContact O-CG 3.24Å; D73-M77 WeakPolarHBondContact O-CG 3.33Å; D73-M77 PolarHBondContact O-N 2.86Å; D73-R343 IonicContact OD1-NH1 2.67Å; D73-R343 PolarHBondContact OD1-NH1 3.41Å; D73-R343 IonicContact OD2-CZ 2.7Å; D73-R343 VanDerWaalsContact OD2-CZ 3.3Å; D73-R343 IonicContact OD2-NH1 2.87Å; D73-R343 PolarHBondContact OD2-NH1 3.1Å; D73-R343 IonicContact OD2-NH2 3.63Å; D73-R343 PolarHBondContact OD2-NH2 3.47Å
74	R	95.9	Very high	94.3	Very high	95 Å²	95	34 Å²	34	36%	0.358	20%	0.198	S	C	.	.	H	α-helix	trans	-67.5	-41.6	178	-68.6	-64.6	-171.7	154.5	7.3	112.9	F70 A71 I72 M77 D78 D328 F445	F70-R74 HydrophobicContact CD2-CG 4.41Å; F70-R74 HydrophobicContact CE1-CG 4.19Å; F70-R74 HydrophobicContact CE2-CG 4.06Å; F70-R74 HydrophobicContact CZ-CG 3.93Å; F70-R74 VanDerWaalsContact O-CG 3.25Å; F70-R74 WeakPolarHBondContact O-CG 3.41Å; F70-R74 PolarHBondContact O-N 3.4Å; A71-R74 PolarHBondContact O-N 3.08Å; I72-R74 VanDerWaalsContact C-N 3.26Å; I72-R74 PolarHBondContact O-N 3.11Å; R74-M77 PolarHBondContact O-N 3.14Å; R74-D78 PolarHBondContact O-N 2.96Å; R74-D78 VanDerWaalsContact O-N 3.11Å; R74-D328 IonicContact NH2-OD1 3.3Å; R74-F445 HydrophobicContact CB-CZ 4.41Å; R74-F445 HydrophobicContact CG-CZ 4.08Å
75	I	96.3	Very high	94	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-65.9	-43.9	177.8	-69.4	159	0	0	0	110.5	A71 I72 M77 D78 V81 L87 V398 Y399 A402	A71-I75 WeakPolarHBondContact O-CD1 3.34Å; A71-I75 VanDerWaalsContact O-CG1 3.28Å; A71-I75 WeakPolarHBondContact O-CG1 3.39Å; A71-I75 PolarHBondContact O-N 3.39Å; I72-I75 PolarHBondContact O-N 3.2Å; I75-M77 PolarHBondContact O-N 2.66Å; I75-D78 WeakPolarHBondContact O-CB 3.43Å; I75-D78 PolarHBondContact O-N 3.35Å; I75-V81 HydrophobicContact CG2-CG1 4.36Å; I75-L87 HydrophobicContact CG2-CD1 3.89Å; I75-V398 HydrophobicContact CD1-CG1 3.73Å; I75-Y399 HydrophobicContact CD1-CD1 4.43Å; I75-Y399 HydrophobicContact CD1-CD2 3.95Å; I75-Y399 HydrophobicContact CD1-CE1 4.46Å; I75-Y399 HydrophobicContact CD1-CE2 3.98Å; I75-Y399 HydrophobicContact CD1-CG 4.2Å; I75-Y399 HydrophobicContact CG1-CD1 4.28Å; I75-Y399 HydrophobicContact CG1-CD2 4.32Å; I75-Y399 HydrophobicContact CG1-CE1 3.89Å; I75-Y399 HydrophobicContact CG1-CE2 3.93Å; I75-Y399 HydrophobicContact CG1-CG 4.5Å; I75-A402 HydrophobicContact CD1-CB 3.79Å; I75-A402 HydrophobicContact CG1-CB 4.48Å; I75-A402 HydrophobicContact CG2-CB 4.21Å
76	N	95.9	Very high	93.9	Very high	68 Å²	68	36.5 Å²	36.5	36%	0.364	22%	0.215	S	C	.	.	H	α-helix	trans	-65.7	-21.7	178.3	-73.3	-22.2	0	0	0	113.2	I72 L87	I72-N76 WeakPolarHBondContact O-CB 3.33Å; I72-N76 PolarHBondContact O-N 3.13Å; I72-N76 PolarHBondContact O-ND2 2.98Å; N76-L87 PolarHBondContact ND2-O 3.32Å; N76-L87 PolarHBondContact OD1-N 2.78Å
77	M	94.4	Very high	93.8	Very high	156 Å²	156	36.6 Å²	36.6	77%	0.768	22%	0.215	S	C	*	.	H	α-helix	trans	-88.7	-14.7	172.4	-68.3	176.3	-165.4	0	0	113.3	D73 R74 I75	D73-M77 VanDerWaalsContact O-CG 3.24Å; D73-M77 WeakPolarHBondContact O-CG 3.33Å; D73-M77 PolarHBondContact O-N 2.86Å; R74-M77 PolarHBondContact O-N 3.14Å; I75-M77 PolarHBondContact O-N 2.66Å
78	D	92.5	Very high	93.8	Very high	54 Å²	54	36.6 Å²	36.6	29%	0.289	22%	0.215	S	C	.	.			trans	-80.4	135.4	-179.3	-164.5	-18.9	0	0	0	110.4	R74 I75 T80	R74-D78 PolarHBondContact O-N 2.96Å; R74-D78 VanDerWaalsContact O-N 3.11Å; I75-D78 WeakPolarHBondContact O-CB 3.43Å; I75-D78 PolarHBondContact O-N 3.35Å; D78-T80 WeakPolarHBondContact OD1-CB 3.3Å; D78-T80 PolarHBondContact OD1-N 2.85Å; D78-T80 PolarHBondContact OD1-OG1 3.3Å; D78-T80 PolarHBondContact OD2-OG1 3.31Å; D78-T80 VanDerWaalsContact OD2-OG1 3.09Å
79	S	89.7	Confident	93.7	Very high	100 Å²	100	36.6 Å²	36.6	70%	0.699	22%	0.215	S	C	*	.	S	Bend	trans	-92.3	-7.5	177.2	60.3	0	0	0	0	113.1
80	T	90.8	Very high	93.6	Very high	91 Å²	91	36.7 Å²	36.7	56%	0.558	22%	0.216	S	C	*	.	S	Bend	trans	-92.2	-40.7	-176.8	67.3	0	0	0	0	112.3	D78 H406	D78-T80 WeakPolarHBondContact OD1-CB 3.3Å; D78-T80 PolarHBondContact OD1-N 2.85Å; D78-T80 PolarHBondContact OD1-OG1 3.3Å; D78-T80 PolarHBondContact OD2-OG1 3.31Å; D78-T80 VanDerWaalsContact OD2-OG1 3.09Å; T80-H406 PolarHBondContact O-CE1 3.46Å
81	V	91.6	Very high	93.5	Very high	7 Å²	7	36.6 Å²	36.6	4%	0.042	22%	0.215	C	C	.	.	S	Bend	trans	-100.7	125.9	179.9	-175.9	0	0	0	0	109.5	I75 A402 H406	I75-V81 HydrophobicContact CG2-CG1 4.36Å; V81-A402 HydrophobicContact CG1-CB 4.05Å; V81-H406 HydrophobicContact CG1-CB 4.41Å
82	L	90.9	Very high	93.4	Very high	5 Å²	5	36.6 Å²	36.6	3%	0.026	22%	0.215	C	C	.	.	S	Bend	trans	48.8	50.9	-178.5	-67.2	169.3	0	0	0	114.9	G84 V85 L87 A402 L405 H406	L82-G84 PolarHBondContact O-N 3.07Å; L82-G84 VanDerWaalsContact O-N 3.16Å; L82-V85 HydrophobicContact CB-CB 4.43Å; L82-V85 PolarHBondContact O-N 3.44Å; L82-V85 VanDerWaalsContact O-N 3.17Å; L82-L87 HydrophobicContact CD1-CD1 3.82Å; L82-L87 HydrophobicContact CD1-CD2 3.8Å; L82-L87 HydrophobicContact CD1-CG 3.87Å; L82-A402 HydrophobicContact CD1-CB 4.23Å; L82-L405 HydrophobicContact CD1-CB 4.33Å; L82-L405 HydrophobicContact CD2-CB 4.2Å; L82-H406 HydrophobicContact CD2-CB 4.09Å; L82-H406 HydrophobicContact CG-CB 4.14Å; L82-H406 PolarHBondContact N-ND1 2.85Å
83	P	89.9	Confident	93.3	Very high	22 Å²	22	36.7 Å²	36.7	14%	0.143	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	124.4	-178.4	25.7	-33	0	0	0	110.6	T417	P83-T417 HydrophobicContact CG-CG2 4.44Å; P83-T417 CarbonylContact O-C 3.6Å; P83-T417 VanDerWaalsContact O-CB 3.27Å; P83-T417 WeakPolarHBondContact O-CB 3.33Å
84	G	86.6	Confident	93.1	Very high	57 Å²	57	34.5 Å²	34.5	59%	0.588	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.5	9.8	177.3	0	0	0	0	0	115.5	L82 T417	L82-G84 PolarHBondContact O-N 3.07Å; L82-G84 VanDerWaalsContact O-N 3.16Å; G84-T417 CarbonylContact C-O 3.58Å
85	V	90.5	Very high	92.8	Very high	9 Å²	9	30 Å²	30	6%	0.055	19%	0.187	C	C	.	.			trans	-125.9	127.4	171.3	179.9	0	0	0	0	108.4	D34 L35 L82 T417 L419	D34-V85 HydrophobicContact CB-CG1 3.78Å; L35-V85 HydrophobicContact CD1-CG1 4.29Å; L35-V85 HydrophobicContact CG-CG1 4.29Å; L82-V85 HydrophobicContact CB-CB 4.43Å; L82-V85 PolarHBondContact O-N 3.44Å; L82-V85 VanDerWaalsContact O-N 3.17Å; V85-T417 WeakPolarHBondContact CG2-O 3.03Å; V85-L419 HydrophobicContact CG1-CD1 4.23Å; V85-L419 HydrophobicContact CG1-CD2 4.15Å; V85-L419 HydrophobicContact CG1-CG 3.96Å; V85-L419 HydrophobicContact CG2-CD2 4.28Å; V85-L419 HydrophobicContact CG2-CG 3.99Å
86	S	93.1	Very high	92.4	Very high	45 Å²	45	30.2 Å²	30.2	32%	0.315	19%	0.189	S	C	.	.			trans	-92.7	134.6	177.4	57.6	0	0	0	0	111.7	D34 L35	D34-S86 PolarHBondContact N-O 3.26Å; D34-S86 PolarHBondContact N-OG 2.71Å; D34-S86 VanDerWaalsContact N-OG 3.14Å; D34-S86 PolarHBondContact OD2-N 3.4Å; D34-S86 PolarHBondContact OD2-OG 3.46Å; L35-S86 PolarHBondContact N-O 3.15Å
87	L	94.8	Very high	91.9	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	123.5	171.1	-65.8	-176.5	0	0	0	110.6	L35 I72 I75 N76 L82 A402 L405	L35-L87 HydrophobicContact CB-CD2 3.9Å; L35-L87 HydrophobicContact CD1-CD2 4.42Å; L35-L87 CarbonylContact O-C 3.58Å; L35-L87 WeakPolarHBondContact O-CA 3.35Å; I72-L87 HydrophobicContact CD1-CB 3.95Å; I72-L87 HydrophobicContact CD1-CD1 4.07Å; I72-L87 HydrophobicContact CG2-CB 4.37Å; I72-L87 WeakPolarHBondContact CG2-O 3.4Å; I75-L87 HydrophobicContact CG2-CD1 3.89Å; N76-L87 PolarHBondContact ND2-O 3.32Å; N76-L87 PolarHBondContact OD1-N 2.78Å; L82-L87 HydrophobicContact CD1-CD1 3.82Å; L82-L87 HydrophobicContact CD1-CD2 3.8Å; L82-L87 HydrophobicContact CD1-CG 3.87Å; L87-A402 HydrophobicContact CD1-CB 4.05Å; L87-L405 HydrophobicContact CD2-CD1 4.23Å
88	G	95.1	Very high	91.6	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	174.5	168.4	0	0	0	0	0	112	I31 L35 L37	I31-G88 CarbonylContact O-C 3.51Å; I31-G88 WeakPolarHBondContact O-CA 3.32Å; L35-G88 PolarHBondContact O-N 2.96Å; L37-G88 PolarHBondContact N-O 3.47Å
89	V	95.3	Very high	91.4	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.006	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	149.5	178.7	-56.1	0	0	0	0	112.9	I29 R30 I31 L37 M68 L69 I72 I91	I29-V89 HydrophobicContact CG2-CG2 4.35Å; R30-V89 WeakPolarHBondContact CA-O 3.42Å; I31-V89 HydrophobicContact CB-CG2 4Å; I31-V89 HydrophobicContact CD1-CG2 3.82Å; I31-V89 HydrophobicContact CG1-CG2 3.9Å; I31-V89 PolarHBondContact N-O 3.41Å; I31-V89 PolarHBondContact O-N 3.3Å; L37-V89 CarbonylContact O-C 3.53Å; L37-V89 VanDerWaalsContact O-CA 3.26Å; L37-V89 WeakPolarHBondContact O-CA 3.31Å; M68-V89 HydrophobicContact CE-CB 4.18Å; M68-V89 HydrophobicContact CE-CG1 3.77Å; L69-V89 HydrophobicContact CD2-CG2 3.79Å; I72-V89 HydrophobicContact CB-CG1 4.4Å; I72-V89 HydrophobicContact CD1-CG1 4Å; I72-V89 HydrophobicContact CG1-CG1 3.65Å; I72-V89 HydrophobicContact CG2-CG1 4.28Å; V89-I91 HydrophobicContact CB-CG1 4.28Å; V89-I91 HydrophobicContact CG2-CD1 4.18Å; V89-I91 HydrophobicContact CG2-CG1 4.18Å
90	H	94.7	Very high	91.4	Very high	4 Å²	4	22.2 Å²	22.2	2%	0.019	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	102.9	167.4	-169.7	177.7	0	0	0	109.1	E28 I29 V36 L37 G38 G39 F108 I138	E28-H90 IonicContact OE2-CD2 2.69Å; E28-H90 IonicContact OE2-CE1 3.13Å; E28-H90 IonicContact OE2-NE2 2.78Å; E28-H90 PolarHBondContact OE2-NE2 3.17Å; I29-H90 CarbonylContact O-C 3.59Å; I29-H90 VanDerWaalsContact O-CA 3.26Å; I29-H90 WeakPolarHBondContact O-CA 3.32Å; V36-H90 HydrophobicContact CG1-CB 4.09Å; L37-H90 PolarHBondContact O-N 3.35Å; G38-H90 CarbonylContact C-O 3.59Å; G38-H90 WeakPolarHBondContact CA-O 3.32Å; G39-H90 PolarHBondContact N-O 3.06Å; H90-F108 HydrophobicContact CB-CE1 4.28Å; H90-F108 WeakPolarHBondContact O-CE1 3.48Å; H90-I138 HydrophobicContact CB-CD1 3.93Å
91	I	95.7	Very high	91.5	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	131	-174.7	-55.1	175.5	0	0	0	110.8	I29 G39 F41 L65 M68 L69 V89	I29-I91 HydrophobicContact CB-CB 4.07Å; I29-I91 HydrophobicContact CD1-CB 4.48Å; I29-I91 HydrophobicContact CD1-CD1 4.44Å; I29-I91 PolarHBondContact N-O 3.08Å; I29-I91 VanDerWaalsContact N-O 3.07Å; I29-I91 PolarHBondContact O-N 3.2Å; G39-I91 WeakPolarHBondContact O-CA 3.34Å; F41-I91 HydrophobicContact CD2-CG2 3.56Å; F41-I91 HydrophobicContact CE2-CD1 4.36Å; F41-I91 HydrophobicContact CE2-CG2 4.05Å; L65-I91 HydrophobicContact CD1-CG2 3.88Å; L65-I91 HydrophobicContact CG-CD1 4.19Å; L65-I91 HydrophobicContact CG-CG2 4.13Å; M68-I91 HydrophobicContact CG-CD1 4.5Å; M68-I91 HydrophobicContact SD-CD1 4.16Å; M68-I91 HydrophobicContact SD-CG1 4.29Å; L69-I91 HydrophobicContact CD2-CD1 3.83Å; L69-I91 HydrophobicContact CG-CD1 4.19Å; V89-I91 HydrophobicContact CB-CG1 4.28Å; V89-I91 HydrophobicContact CG2-CD1 4.18Å; V89-I91 HydrophobicContact CG2-CG1 4.18Å
92	L	94.6	Very high	91.4	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	149.3	179.6	-60.3	171.3	0	0	0	110.8	E28 G39 L40 F41 Q104 E107 F108	E28-L92 HydrophobicContact CB-CD2 3.67Å; G39-L92 PolarHBondContact O-N 3.12Å; L40-L92 HydrophobicContact CD2-CB 4.1Å; F41-L92 PolarHBondContact N-O 3.29Å; L92-Q104 HydrophobicContact CB-CB 4.09Å; L92-Q104 HydrophobicContact CD1-CB 4.01Å; L92-Q104 WeakPolarHBondContact CD1-O 3.12Å; L92-E107 HydrophobicContact CD1-CB 3.99Å; L92-F108 HydrophobicContact CB-CZ 4.5Å; L92-F108 HydrophobicContact CD1-CD1 4.17Å; L92-F108 HydrophobicContact CD1-CE1 3.61Å; L92-F108 HydrophobicContact CD1-CE2 4.44Å; L92-F108 HydrophobicContact CD1-CZ 3.77Å; L92-F108 HydrophobicContact CG-CE1 4.1Å; L92-F108 HydrophobicContact CG-CZ 4.19Å
93	D	94.5	Very high	91.4	Very high	7 Å²	7	24.4 Å²	24.4	4%	0.037	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	143.9	175.2	-170.5	7.8	0	0	0	111.2	F41 V43 H44 C95 Y100 Q104 W346	F41-D93 WeakPolarHBondContact O-CA 3.34Å; V43-D93 HydrophobicContact CB-CB 4.18Å; V43-D93 WeakPolarHBondContact CB-OD1 3.27Å; V43-D93 HydrophobicContact CG2-CB 4.15Å; V43-D93 PolarHBondContact N-OD1 2.91Å; H44-D93 IonicContact CE1-OD2 3.97Å; H44-D93 IonicContact CG-OD2 2.66Å; H44-D93 PolarHBondContact N-OD1 3.5Å; H44-D93 PolarHBondContact N-OD2 3.16Å; H44-D93 IonicContact ND1-OD2 3.43Å; H44-D93 PolarHBondContact ND1-OD2 3.06Å; D93-C95 VanDerWaalsContact CG-SG 3.59Å; D93-C95 PolarHBondContact OD1-N 2.98Å; D93-C95 PolarHBondContact OD2-SG 2.97Å; D93-Y100 WeakPolarHBondContact O-CE1 3.38Å; D93-Q104 VanDerWaalsContact O-CG 3.29Å; D93-Q104 WeakPolarHBondContact O-CG 3.4Å; D93-W346 HydrophobicContact CB-CZ2 4.14Å
94	T	93.1	Very high	91.4	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.006	14%	0.137	C	C	.	.			trans	-101.4	-13.9	174.7	58.7	0	0	0	0	112.8	L40 F41 P42 S96 R97 A101 V149	L40-T94 HydrophobicContact CB-CG2 3.75Å; L40-T94 HydrophobicContact CD2-CG2 4.04Å; L40-T94 HydrophobicContact CG-CG2 4.39Å; F41-T94 PolarHBondContact O-N 2.99Å; F41-T94 PolarHBondContact O-OG1 2.99Å; P42-T94 WeakPolarHBondContact CA-OG1 3.22Å; T94-S96 PolarHBondContact O-N 2.89Å; T94-R97 PolarHBondContact O-N 3.42Å; T94-A101 HydrophobicContact CG2-CB 3.85Å; T94-V149 HydrophobicContact CG2-CG1 4.14Å
95	C	89.9	Confident	91.6	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.4	26.8	-173.8	-62	0	0	0	0	114	H44 K46 C53 D93 R97 Y100	H44-C95 CarbonylContact O-C 3.51Å; H44-C95 WeakPolarHBondContact O-CA 3.47Å; K46-C95 WeakPolarHBondContact CA-O 3.47Å; C53-C95 HydrophobicContact CB-CB 3.74Å; C53-C95 WeakPolarHBondContact CB-SG 3.42Å; C53-C95 WeakPolarHBondContact SG-CB 3.42Å; C53-C95 CovalentContact SG-SG 2.01Å; C53-C95 PolarHBondContact SG-SG 3.19Å; D93-C95 VanDerWaalsContact CG-SG 3.59Å; D93-C95 PolarHBondContact OD1-N 2.98Å; D93-C95 PolarHBondContact OD2-SG 2.97Å; C95-R97 WeakPolarHBondContact O-CG 3.1Å; C95-R97 PolarHBondContact O-N 3.3Å; C95-Y100 HydrophobicContact CB-CD1 3.87Å; C95-Y100 HydrophobicContact CB-CE1 4.13Å; C95-Y100 HydrophobicContact CB-CG 4.34Å; C95-Y100 WeakPolarHBondContact SG-CE1 3.45Å
96	S	86.8	Confident	91.6	Very high	7 Å²	7	24.7 Å²	24.7	5%	0.049	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	27.6	-175.4	-51.5	0	0	0	0	113.6	P42 H44 T94 Y146	P42-S96 WeakPolarHBondContact CB-OG 3.41Å; H44-S96 PolarHBondContact O-N 3.5Å; H44-S96 PolarHBondContact O-OG 3.33Å; T94-S96 PolarHBondContact O-N 2.89Å; S96-Y146 WeakPolarHBondContact OG-CE2 3.25Å
97	R	86.1	Confident	91.4	Very high	54 Å²	54	23.8 Å²	23.8	20%	0.204	12%	0.119	C	C	.	.			trans	-127.7	129.7	-177.1	-73.3	176.3	78.3	153.3	-2.6	110.8	K46 E51 E52 T94 C95 A101	K46-R97 HydrophobicContact CB-CG 4.38Å; K46-R97 HydrophobicContact CD-CG 3.68Å; K46-R97 HydrophobicContact CG-CG 3.76Å; E51-R97 PolarHBondContact O-NH1 2.98Å; E52-R97 WeakPolarHBondContact O-CD 3.47Å; E52-R97 PolarHBondContact O-NH1 2.83Å; T94-R97 PolarHBondContact O-N 3.42Å; C95-R97 WeakPolarHBondContact O-CG 3.1Å; C95-R97 PolarHBondContact O-N 3.3Å; R97-A101 WeakPolarHBondContact O-CB 3.26Å; R97-A101 PolarHBondContact O-N 3.49Å
98	D	87.4	Confident	91.1	Very high	41 Å²	41	23.8 Å²	23.8	22%	0.219	12%	0.119	C	C	.	.	H	α-helix	trans	-62.7	-46.6	179.1	49.9	-16.1	0	0	0	113.3	L102 V149 Q152	D98-L102 WeakPolarHBondContact O-CB 3.3Å; D98-L102 PolarHBondContact O-N 3.18Å; D98-L102 VanDerWaalsContact O-N 3.1Å; D98-V149 HydrophobicContact CB-CG2 4.48Å; D98-Q152 HydrophobicContact CB-CG 4.02Å
99	T	88.3	Confident	90.7	Very high	77 Å²	77	23.8 Å²	23.8	47%	0.472	12%	0.119	S	C	.	.	H	α-helix	trans	-66.1	-44.9	178.8	60.3	0	0	0	0	112.5	L102 E103	T99-L102 WeakPolarHBondContact O-CB 3.46Å; T99-L102 PolarHBondContact O-N 3.12Å; T99-E103 PolarHBondContact O-N 3.46Å
100	Y	89.8	Confident	90.1	Very high	37 Å²	37	30.2 Å²	30.2	15%	0.145	14%	0.143	C	C	.	.	H	α-helix	trans	-64.9	-44.8	179.3	-176.5	-91.8	0	0	0	111.4	E52 D93 C95 L102 E103 Q104	E52-Y100 HydrophobicContact CB-CD2 4.37Å; E52-Y100 HydrophobicContact CB-CE2 4.44Å; E52-Y100 WeakPolarHBondContact OE2-CE2 3.35Å; D93-Y100 WeakPolarHBondContact O-CE1 3.38Å; C95-Y100 HydrophobicContact CB-CD1 3.87Å; C95-Y100 HydrophobicContact CB-CE1 4.13Å; C95-Y100 HydrophobicContact CB-CG 4.34Å; C95-Y100 WeakPolarHBondContact SG-CE1 3.45Å; Y100-L102 VanDerWaalsContact C-N 3.28Å; Y100-L102 PolarHBondContact O-N 2.97Å; Y100-E103 WeakPolarHBondContact O-CB 3.48Å; Y100-E103 PolarHBondContact O-N 3.38Å; Y100-E103 VanDerWaalsContact O-N 3.15Å; Y100-Q104 HydrophobicContact CD1-CG 3.96Å; Y100-Q104 HydrophobicContact CE1-CG 3.62Å; Y100-Q104 WeakPolarHBondContact O-CG 3.27Å; Y100-Q104 PolarHBondContact O-N 3.45Å
101	A	92	Very high	88.7	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.1	-35.5	177.3	0	0	0	0	0	112.8	T94 R97 Q104 A105 V149 V153	T94-A101 HydrophobicContact CG2-CB 3.85Å; R97-A101 WeakPolarHBondContact O-CB 3.26Å; R97-A101 PolarHBondContact O-N 3.49Å; A101-Q104 PolarHBondContact O-N 2.85Å; A101-A105 WeakPolarHBondContact O-CB 3.5Å; A101-A105 PolarHBondContact O-N 3.45Å; A101-V149 HydrophobicContact CB-CB 4.44Å; A101-V149 HydrophobicContact CB-CG1 3.44Å; A101-V149 VanDerWaalsContact CB-CG1 3.44Å; A101-V149 HydrophobicContact CB-CG2 4.3Å; A101-V153 HydrophobicContact CB-CG2 4.47Å
102	L	91.3	Very high	87.4	Confident	56 Å²	56	33.3 Å²	33.3	29%	0.293	17%	0.166	S	C	.	.	H	α-helix	trans	-63.3	-43	174.1	-178.9	63.2	0	0	0	111.4	D98 T99 Y100 Q104 A105 L106 Q152 L156	D98-L102 WeakPolarHBondContact O-CB 3.3Å; D98-L102 PolarHBondContact O-N 3.18Å; D98-L102 VanDerWaalsContact O-N 3.1Å; T99-L102 WeakPolarHBondContact O-CB 3.46Å; T99-L102 PolarHBondContact O-N 3.12Å; Y100-L102 VanDerWaalsContact C-N 3.28Å; Y100-L102 PolarHBondContact O-N 2.97Å; L102-Q104 VanDerWaalsContact C-N 3.32Å; L102-Q104 PolarHBondContact O-N 2.87Å; L102-A105 PolarHBondContact O-N 3.02Å; L102-L106 PolarHBondContact O-N 3.45Å; L102-Q152 HydrophobicContact CB-CB 4.47Å; L102-L156 HydrophobicContact CD1-CB 3.88Å; L102-L156 HydrophobicContact CD1-CD2 4.03Å
103	E	89.9	Confident	86.2	Confident	94 Å²	94	38.4 Å²	38.4	44%	0.439	19%	0.193	S	C	.	.	H	α-helix	trans	-63.2	-37.2	175.5	-69.1	170.9	-167.4	0	0	112.5	T99 Y100 L106	T99-E103 PolarHBondContact O-N 3.46Å; Y100-E103 WeakPolarHBondContact O-CB 3.48Å; Y100-E103 PolarHBondContact O-N 3.38Å; Y100-E103 VanDerWaalsContact O-N 3.15Å; E103-L106 WeakPolarHBondContact O-CB 3.48Å
104	Q	89.8	Confident	84.8	Confident	6 Å²	6	40.6 Å²	40.6	3%	0.028	21%	0.207	C	C	.	.	H	α-helix	trans	-69.4	-40.9	173.8	-61.3	-44.6	-55.7	0	0	111.7	R26 L92 D93 Y100 A101 L102 L106 E107	R26-Q104 VanDerWaalsContact CZ-OE1 3.22Å; L92-Q104 HydrophobicContact CB-CB 4.09Å; L92-Q104 HydrophobicContact CD1-CB 4.01Å; L92-Q104 WeakPolarHBondContact CD1-O 3.12Å; D93-Q104 VanDerWaalsContact O-CG 3.29Å; D93-Q104 WeakPolarHBondContact O-CG 3.4Å; Y100-Q104 HydrophobicContact CD1-CG 3.96Å; Y100-Q104 HydrophobicContact CE1-CG 3.62Å; Y100-Q104 WeakPolarHBondContact O-CG 3.27Å; Y100-Q104 PolarHBondContact O-N 3.45Å; A101-Q104 PolarHBondContact O-N 2.85Å; L102-Q104 VanDerWaalsContact C-N 3.32Å; L102-Q104 PolarHBondContact O-N 2.87Å; Q104-L106 PolarHBondContact O-N 3.23Å; Q104-L106 VanDerWaalsContact O-N 3.13Å; Q104-E107 VanDerWaalsContact O-CB 3.29Å; Q104-E107 WeakPolarHBondContact O-CB 3.34Å; Q104-E107 PolarHBondContact O-N 3.21Å
105	A	91.7	Very high	83	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.1	-19.9	179.5	0	0	0	0	0	113.6	A101 L102 E107 F108 V153 L156	A101-A105 WeakPolarHBondContact O-CB 3.5Å; A101-A105 PolarHBondContact O-N 3.45Å; L102-A105 PolarHBondContact O-N 3.02Å; A105-E107 PolarHBondContact O-N 3.36Å; A105-F108 HydrophobicContact CB-CD2 4.4Å; A105-F108 PolarHBondContact O-N 3.04Å; A105-V153 HydrophobicContact CB-CG1 4.09Å; A105-V153 HydrophobicContact CB-CG2 4.08Å; A105-L156 HydrophobicContact CB-CD2 3.89Å
106	L	90.3	Very high	81.1	Confident	88 Å²	88	52.3 Å²	52.3	46%	0.461	26%	0.264	S	S	.	.	H	α-helix	trans	-59.8	-26.9	170	-70.6	171.3	0	0	0	112.6	L102 E103 Q104 F108 V109 R110 L156	L102-L106 PolarHBondContact O-N 3.45Å; E103-L106 WeakPolarHBondContact O-CB 3.48Å; Q104-L106 PolarHBondContact O-N 3.23Å; Q104-L106 VanDerWaalsContact O-N 3.13Å; L106-F108 VanDerWaalsContact C-N 3.33Å; L106-F108 PolarHBondContact O-N 2.98Å; L106-V109 HydrophobicContact CD2-CG2 4.49Å; L106-V109 WeakPolarHBondContact O-CG2 3.31Å; L106-V109 PolarHBondContact O-N 3.07Å; L106-R110 PolarHBondContact O-N 2.64Å; L106-L156 HydrophobicContact CD2-CD1 4.01Å; L106-L156 HydrophobicContact CD2-CD2 3.88Å; L106-L156 HydrophobicContact CG-CD2 4.24Å
107	E	88.3	Confident	79.4	Confident	26 Å²	26	57.4 Å²	57.4	12%	0.121	29%	0.29	C	S	.	.	H	α-helix	trans	-68.9	-33.4	178.1	-162.5	64.1	-153.4	0	0	111.7	R26 L92 Q104 A105 V109 R110	R26-E107 IonicContact NH1-OE2 3.51Å; L92-E107 HydrophobicContact CD1-CB 3.99Å; Q104-E107 VanDerWaalsContact O-CB 3.29Å; Q104-E107 WeakPolarHBondContact O-CB 3.34Å; Q104-E107 PolarHBondContact O-N 3.21Å; A105-E107 PolarHBondContact O-N 3.36Å; E107-V109 PolarHBondContact O-N 3.25Å; E107-R110 VanDerWaalsContact O-CB 3.25Å; E107-R110 WeakPolarHBondContact O-CB 3.46Å; E107-R110 PolarHBondContact O-N 2.99Å; E107-R110 WeakPolarHBondContact OE1-CD 3.3Å; E107-R110 IonicContact OE1-CZ 2.95Å; E107-R110 IonicContact OE1-NE 3.54Å; E107-R110 IonicContact OE1-NH1 3.57Å; E107-R110 PolarHBondContact OE1-NH1 3.43Å; E107-R110 IonicContact OE2-NH1 3.65Å; E107-R110 PolarHBondContact OE2-NH1 3.23Å
108	F	89.3	Confident	77.7	Confident	1 Å²	1	61.2 Å²	61.2	0%	0.004	32%	0.315	C	S	.	.	H	α-helix	trans	-65.6	-27.5	177.5	-62.8	-33	0	0	0	113.3	L40 H90 L92 A105 L106 I138 V141	L40-F108 HydrophobicContact CD1-CE2 4.02Å; L40-F108 HydrophobicContact CD2-CE2 3.74Å; L40-F108 HydrophobicContact CD2-CZ 3.97Å; L40-F108 HydrophobicContact CG-CE2 3.68Å; L40-F108 HydrophobicContact CG-CZ 4.1Å; H90-F108 HydrophobicContact CB-CE1 4.28Å; H90-F108 WeakPolarHBondContact O-CE1 3.48Å; L92-F108 HydrophobicContact CB-CZ 4.5Å; L92-F108 HydrophobicContact CD1-CD1 4.17Å; L92-F108 HydrophobicContact CD1-CE1 3.61Å; L92-F108 HydrophobicContact CD1-CE2 4.44Å; L92-F108 HydrophobicContact CD1-CZ 3.77Å; L92-F108 HydrophobicContact CG-CE1 4.1Å; L92-F108 HydrophobicContact CG-CZ 4.19Å; A105-F108 HydrophobicContact CB-CD2 4.4Å; A105-F108 PolarHBondContact O-N 3.04Å; L106-F108 VanDerWaalsContact C-N 3.33Å; L106-F108 PolarHBondContact O-N 2.98Å; F108-I138 HydrophobicContact CB-CB 4.44Å; F108-I138 HydrophobicContact CB-CG1 3.91Å; F108-I138 HydrophobicContact CD1-CD1 4.16Å; F108-I138 HydrophobicContact CD1-CG1 3.92Å; F108-I138 HydrophobicContact CG-CG1 4.24Å; F108-V141 HydrophobicContact CD2-CG1 4.4Å; F108-V141 HydrophobicContact CD2-CG2 3.74Å; F108-V141 HydrophobicContact CE2-CG1 3.94Å; F108-V141 HydrophobicContact CE2-CG2 4.04Å; F108-V141 HydrophobicContact CG-CG2 4.34Å
109	V	86.7	Confident	76.2	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-96.5	-5.1	-179.8	-58.8	0	0	0	0	112.2	L106 E107 A111 S112 L113 L157 F160 I162	L106-V109 HydrophobicContact CD2-CG2 4.49Å; L106-V109 WeakPolarHBondContact O-CG2 3.31Å; L106-V109 PolarHBondContact O-N 3.07Å; E107-V109 PolarHBondContact O-N 3.25Å; V109-A111 VanDerWaalsContact C-N 3.27Å; V109-A111 PolarHBondContact O-N 3.23Å; V109-S112 WeakPolarHBondContact O-CA 3.26Å; V109-S112 WeakPolarHBondContact O-CB 3.49Å; V109-S112 PolarHBondContact O-N 3.45Å; V109-L113 HydrophobicContact CG2-CD1 4.07Å; V109-L113 PolarHBondContact O-N 3.3Å; V109-L157 HydrophobicContact CG1-CD2 4.28Å; V109-F160 HydrophobicContact CB-CD1 4.15Å; V109-F160 HydrophobicContact CB-CD2 3.76Å; V109-F160 HydrophobicContact CB-CE1 4.18Å; V109-F160 HydrophobicContact CB-CE2 3.79Å; V109-F160 HydrophobicContact CB-CG 3.94Å; V109-F160 HydrophobicContact CB-CZ 3.99Å; V109-F160 HydrophobicContact CG1-CB 4.06Å; V109-F160 HydrophobicContact CG1-CD1 4.36Å; V109-F160 HydrophobicContact CG1-CD2 3.33Å; V109-F160 HydrophobicContact CG1-CE2 3.79Å; V109-F160 HydrophobicContact CG1-CG 3.65Å; V109-F160 HydrophobicContact CG1-CZ 4.47Å; V109-F160 HydrophobicContact CG2-CD2 4.3Å; V109-F160 HydrophobicContact CG2-CE2 3.87Å; V109-F160 HydrophobicContact CG2-CZ 4.09Å; V109-I162 HydrophobicContact CG1-CD1 3.91Å
110	R	81.1	Confident	74.6	Confident	135 Å²	135	67.2 Å²	67.2	51%	0.509	34%	0.343	S	S	.	.	H	α-helix	trans	-54.3	-43.9	-179	-169.1	175.3	-173.8	161.3	0	111.6	L106 E107 S112 L113 T114	L106-R110 PolarHBondContact O-N 2.64Å; E107-R110 VanDerWaalsContact O-CB 3.25Å; E107-R110 WeakPolarHBondContact O-CB 3.46Å; E107-R110 PolarHBondContact O-N 2.99Å; E107-R110 WeakPolarHBondContact OE1-CD 3.3Å; E107-R110 IonicContact OE1-CZ 2.95Å; E107-R110 IonicContact OE1-NE 3.54Å; E107-R110 IonicContact OE1-NH1 3.57Å; E107-R110 PolarHBondContact OE1-NH1 3.43Å; E107-R110 IonicContact OE2-NH1 3.65Å; E107-R110 PolarHBondContact OE2-NH1 3.23Å; R110-S112 PolarHBondContact O-N 2.88Å; R110-L113 WeakPolarHBondContact O-CB 3.41Å; R110-L113 PolarHBondContact O-N 2.93Å; R110-T114 HydrophobicContact CG-CG2 4.1Å; R110-T114 WeakPolarHBondContact O-CG2 3.26Å; R110-T114 PolarHBondContact O-N 3.48Å; R110-T114 PolarHBondContact O-OG1 3.41Å
111	A	66.8	Low	73.2	Confident	8 Å²	8	71.5 Å²	71.5	7%	0.066	36%	0.363	C	S	.	.	H	α-helix	trans	-59.5	-31.9	175.6	0	0	0	0	0	114.6	V109 P135 L136	V109-A111 VanDerWaalsContact C-N 3.27Å; V109-A111 PolarHBondContact O-N 3.23Å; A111-P135 HydrophobicContact CB-CB 3.59Å; A111-P135 HydrophobicContact CB-CG 3.79Å; A111-P135 VanDerWaalsContact CB-O 3.31Å; A111-P135 WeakPolarHBondContact CB-O 3.45Å; A111-L136 WeakPolarHBondContact CB-O 3.38Å
112	S	68.3	Low	72.1	Confident	62 Å²	62	76.8 Å²	76.8	43%	0.434	39%	0.39	S	S	.	.	H	α-helix	trans	-79.7	-24.2	176.3	-60.9	0	0	0	0	112.3	V109 R110	V109-S112 WeakPolarHBondContact O-CA 3.26Å; V109-S112 WeakPolarHBondContact O-CB 3.49Å; V109-S112 PolarHBondContact O-N 3.45Å; R110-S112 PolarHBondContact O-N 2.88Å
113	L	70	Confident	71.2	Confident	107 Å²	107	76.3 Å²	76.3	56%	0.56	39%	0.391	S	S	*	.	H	α-helix	trans	-86.5	-31.9	178.3	-68.7	171.3	0	0	0	113	V109 R110 F160	V109-L113 HydrophobicContact CG2-CD1 4.07Å; V109-L113 PolarHBondContact O-N 3.3Å; R110-L113 WeakPolarHBondContact O-CB 3.41Å; R110-L113 PolarHBondContact O-N 2.93Å; L113-F160 HydrophobicContact CD1-CZ 4.46Å; L113-F160 HydrophobicContact CD2-CE1 3.79Å; L113-F160 HydrophobicContact CD2-CZ 3.8Å; L113-F160 HydrophobicContact CG-CE1 4.04Å; L113-F160 HydrophobicContact CG-CZ 4.11Å
114	T	63.1	Low	70.4	Confident	53 Å²	53	79 Å²	79	33%	0.325	42%	0.416	S	S	.	.			trans	-93.9	8.9	-177.1	56.8	0	0	0	0	113.6	R110 V116 P135	R110-T114 HydrophobicContact CG-CG2 4.1Å; R110-T114 WeakPolarHBondContact O-CG2 3.26Å; R110-T114 PolarHBondContact O-N 3.48Å; R110-T114 PolarHBondContact O-OG1 3.41Å; T114-V116 PolarHBondContact O-N 3.45Å; T114-P135 VanDerWaalsContact OG1-CG 3.31Å; T114-P135 WeakPolarHBondContact OG1-CG 3.48Å
115	K	57	Low	69.9	Low	170 Å²	170	84.6 Å²	84.6	74%	0.739	45%	0.446	S	S	*	.			trans	-67	73.1	160	-89	-174.2	174.7	180	0	108.8
116	V	49	Very low	69.1	Low	77 Å²	77	87.2 Å²	87.2	47%	0.467	47%	0.474	S	S	.	.			trans	-82.4	136.9	163.7	-174.8	0	0	0	0	105.8	T114 D118 F121	T114-V116 PolarHBondContact O-N 3.45Å; V116-D118 PolarHBondContact O-N 3.46Å; V116-F121 HydrophobicContact CG1-CE2 4.03Å
117	D	50.5	Low	68.4	Low	114 Å²	114	85.3 Å²	85.3	61%	0.61	47%	0.468	S	S	*	.			trans	-49.7	121.5	-177.1	-113.6	-27	0	0	0	110.9	T119 E120	D117-T119 PolarHBondContact O-N 3.32Å; D117-E120 PolarHBondContact O-N 3.04Å
118	D	52.3	Low	67.3	Low	133 Å²	133	92.4 Å²	92.4	71%	0.711	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-10.6	178.7	-71.1	-30.9	0	0	0	112.8	V116	V116-D118 PolarHBondContact O-N 3.46Å
119	T	55.1	Low	66.1	Low	103 Å²	103	94.9 Å²	94.9	63%	0.632	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-7	-171.3	55.4	0	0	0	0	115.5	D117	D117-T119 PolarHBondContact O-N 3.32Å
120	E	55.4	Low	64.7	Low	141 Å²	141	103.1 Å²	103.1	66%	0.659	56%	0.558	S	S	*	*	S	Bend	trans	-97.1	-13.8	-169.6	-73.5	-164.9	154.6	0	0	116.3	D117	D117-E120 PolarHBondContact O-N 3.04Å
121	F	59.9	Low	63.4	Low	128 Å²	128	101.9 Å²	101.9	56%	0.561	56%	0.559	S	S	*	*			trans	-113.8	98.7	-175.7	-59.6	-74.7	0	0	0	112.6	V116 A129	V116-F121 HydrophobicContact CG1-CE2 4.03Å; F121-A129 HydrophobicContact CB-CB 3.99Å; F121-A129 PolarHBondContact O-N 2.97Å
122	I	67.9	Low	62.5	Low	110 Å²	110	109.3 Å²	109.3	56%	0.564	60%	0.597	S	S	*	*	B	Isolated β-bridge	trans	-101.7	124.3	170.6	-60.9	172	0	0	0	107.9
123	C	72.5	Confident	61.8	Low	47 Å²	47	113.4 Å²	113.4	32%	0.318	61%	0.609	S	S	.	*			trans	-64.9	155.5	174	-70.4	0	0	0	0	110.3	D125 G126 S127	C123-D125 WeakPolarHBondContact CB-OD1 3.25Å; C123-D125 PolarHBondContact O-N 3.1Å; C123-G126 PolarHBondContact O-N 2.68Å; C123-S127 WeakPolarHBondContact CB-OG 3.23Å; C123-S127 PolarHBondContact N-O 3.29Å
124	P	73.9	Confident	61.1	Low	150 Å²	150	114.9 Å²	114.9	97%	0.974	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	-16.4	-177.4	-24.1	33.2	0	0	0	115.2
125	D	79.9	Confident	60.9	Low	123 Å²	123	114.4 Å²	114.4	66%	0.658	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	2.1	177	65.1	-11.2	0	0	0	113.8	C123 S127	C123-D125 WeakPolarHBondContact CB-OD1 3.25Å; C123-D125 PolarHBondContact O-N 3.1Å; D125-S127 VanDerWaalsContact C-N 3.3Å; D125-S127 VanDerWaalsContact CG-OG 3.26Å; D125-S127 WeakPolarHBondContact OD1-CB 2.99Å; D125-S127 PolarHBondContact OD1-N 3.25Å; D125-S127 VanDerWaalsContact OD1-N 3.07Å; D125-S127 PolarHBondContact OD1-OG 3.47Å; D125-S127 PolarHBondContact OD2-OG 2.67Å
126	G	73.5	Confident	61.3	Low	56 Å²	56	108.9 Å²	108.9	58%	0.577	59%	0.594	S	S	*	*	S	Bend	trans	80.8	6.1	-178.4	0	0	0	0	0	114.4	C123	C123-G126 PolarHBondContact O-N 2.68Å
127	S	75.5	Confident	62.7	Low	48 Å²	48	108.4 Å²	108.4	34%	0.336	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-82.3	152.9	172.8	69.3	0	0	0	0	111.5	C123 D125	C123-S127 WeakPolarHBondContact CB-OG 3.23Å; C123-S127 PolarHBondContact N-O 3.29Å; D125-S127 VanDerWaalsContact C-N 3.3Å; D125-S127 VanDerWaalsContact CG-OG 3.26Å; D125-S127 WeakPolarHBondContact OD1-CB 2.99Å; D125-S127 PolarHBondContact OD1-N 3.25Å; D125-S127 VanDerWaalsContact OD1-N 3.07Å; D125-S127 PolarHBondContact OD1-OG 3.47Å; D125-S127 PolarHBondContact OD2-OG 2.67Å
128	Y	66.6	Low	64.5	Low	174 Å²	174	103.8 Å²	103.8	68%	0.682	57%	0.573	S	S	*	*	B	Isolated β-bridge	trans	-76.1	140.4	171.7	-63.3	-81.6	0	0	0	109.4	L130	Y128-L130 PolarHBondContact O-N 3.29Å; Y128-L130 VanDerWaalsContact O-N 3.15Å
129	A	62.7	Low	66.4	Low	53 Å²	53	97.6 Å²	97.6	44%	0.438	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-57.9	120.1	172.6	0	0	0	0	0	110	F121 Q131	F121-A129 HydrophobicContact CB-CB 3.99Å; F121-A129 PolarHBondContact O-N 2.97Å; A129-Q131 PolarHBondContact O-N 3.41Å
130	L	57.1	Low	68.3	Low	173 Å²	173	92.7 Å²	92.7	91%	0.906	51%	0.511	S	S	*	.			trans	-75.3	104.9	169.6	-72.5	166.6	0	0	0	107.6	Y128 D132	Y128-L130 PolarHBondContact O-N 3.29Å; Y128-L130 VanDerWaalsContact O-N 3.15Å; L130-D132 PolarHBondContact O-N 3.44Å
131	Q	54.4	Low	70.3	Confident	110 Å²	110	86 Å²	86	51%	0.514	48%	0.479	S	S	.	.			trans	-78.8	101.6	171.9	-163.1	149.1	-0.2	0	0	108.3	A129 E133	A129-Q131 PolarHBondContact O-N 3.41Å; Q131-E133 PolarHBondContact O-N 3.15Å
132	D	48.4	Very low	72.1	Confident	164 Å²	164	79.9 Å²	79.9	88%	0.877	45%	0.453	S	S	*	.	S	Bend	trans	-72.3	-13.4	-173.1	-147.8	16.9	0	0	0	112.9	L130	L130-D132 PolarHBondContact O-N 3.44Å
133	E	52.4	Low	73.4	Confident	147 Å²	147	74.7 Å²	74.7	69%	0.687	43%	0.426	S	S	*	.			trans	-127	99.3	175	-65.8	-156.8	179.7	0	0	111	Q131 P135	Q131-E133 PolarHBondContact O-N 3.15Å; E133-P135 VanDerWaalsContact O-CD 3.25Å; E133-P135 WeakPolarHBondContact O-CD 3.34Å
134	N	55.8	Low	74.4	Confident	139 Å²	139	72.4 Å²	72.4	74%	0.743	41%	0.411	S	S	*	.			trans	-67.5	113.4	157.9	-85.4	-20.8	0	0	0	107.3	L136	N134-L136 PolarHBondContact O-N 3.24Å
135	P	58.7	Low	75.2	Confident	43 Å²	43	65.7 Å²	65.7	28%	0.279	37%	0.367	S	S	.	.			trans	-65.2	128.9	-177	31.8	-38.9	0	0	0	108.9	A111 T114 E133 A137	A111-P135 HydrophobicContact CB-CB 3.59Å; A111-P135 HydrophobicContact CB-CG 3.79Å; A111-P135 VanDerWaalsContact CB-O 3.31Å; A111-P135 WeakPolarHBondContact CB-O 3.45Å; T114-P135 VanDerWaalsContact OG1-CG 3.31Å; T114-P135 WeakPolarHBondContact OG1-CG 3.48Å; E133-P135 VanDerWaalsContact O-CD 3.25Å; E133-P135 WeakPolarHBondContact O-CD 3.34Å; P135-A137 PolarHBondContact O-N 3.32Å; P135-A137 VanDerWaalsContact O-N 3.12Å
136	L	65.9	Low	75.8	Confident	53 Å²	53	61 Å²	61	28%	0.277	34%	0.341	S	S	.	.			trans	-60	114.2	-174.6	-65.2	165.4	0	0	0	110.5	V36 A111 N134 I138	V36-L136 HydrophobicContact CG2-CB 4.48Å; V36-L136 HydrophobicContact CG2-CD2 4.13Å; A111-L136 WeakPolarHBondContact CB-O 3.38Å; N134-L136 PolarHBondContact O-N 3.24Å; L136-I138 PolarHBondContact O-N 2.85Å
137	A	77.5	Confident	76.7	Confident	68 Å²	68	58.6 Å²	58.6	56%	0.562	32%	0.315	S	S	*	.			trans	-74.8	119.5	176	0	0	0	0	0	110.3	P135 A139	P135-A137 PolarHBondContact O-N 3.32Å; P135-A137 VanDerWaalsContact O-N 3.12Å; A137-A139 PolarHBondContact O-N 3.32Å
138	I	89.9	Confident	77.4	Confident	16 Å²	16	57.8 Å²	57.8	8%	0.082	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	119.5	178.8	-59	-58.9	0	0	0	109.9	V36 H90 F108 L136 G140 V141 I162	V36-I138 HydrophobicContact CB-CD1 4.28Å; V36-I138 HydrophobicContact CG1-CD1 3.71Å; H90-I138 HydrophobicContact CB-CD1 3.93Å; F108-I138 HydrophobicContact CB-CB 4.44Å; F108-I138 HydrophobicContact CB-CG1 3.91Å; F108-I138 HydrophobicContact CD1-CD1 4.16Å; F108-I138 HydrophobicContact CD1-CG1 3.92Å; F108-I138 HydrophobicContact CG-CG1 4.24Å; L136-I138 PolarHBondContact O-N 2.85Å; I138-G140 WeakPolarHBondContact CG2-O 3.48Å; I138-V141 HydrophobicContact CG2-CG2 3.99Å; I138-I162 HydrophobicContact CG2-CG2 4.44Å
139	A	91	Very high	78.7	Confident	4 Å²	4	49.5 Å²	49.5	3%	0.033	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	-31.4	179.9	0	0	0	0	0	112.9	V36 L37 A137 L426	V36-A139 PolarHBondContact O-N 2.97Å; L37-A139 HydrophobicContact CD2-CB 4.12Å; A137-A139 PolarHBondContact O-N 3.32Å; A139-L426 HydrophobicContact CB-CD1 3.27Å
140	G	94.9	Very high	80.3	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.5	163.6	179	0	0	0	0	0	110.5	G38 I138 P163	G38-G140 PolarHBondContact N-O 3.01Å; I138-G140 WeakPolarHBondContact CG2-O 3.48Å; G140-P163 CarbonylContact C-O 3.56Å; G140-P163 VanDerWaalsContact CA-O 3.28Å; G140-P163 WeakPolarHBondContact CA-O 3.34Å
141	V	97.3	Very high	82.1	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	130.9	-176	178	0	0	0	0	110.6	G38 L40 F108 I138 L157 I162 P163 Q164 I165	G38-V141 CarbonylContact O-C 3.58Å; G38-V141 WeakPolarHBondContact O-CA 3.39Å; L40-V141 HydrophobicContact CD1-CG1 4.05Å; L40-V141 HydrophobicContact CG-CG1 4.25Å; F108-V141 HydrophobicContact CD2-CG1 4.4Å; F108-V141 HydrophobicContact CD2-CG2 3.74Å; F108-V141 HydrophobicContact CE2-CG1 3.94Å; F108-V141 HydrophobicContact CE2-CG2 4.04Å; F108-V141 HydrophobicContact CG-CG2 4.34Å; I138-V141 HydrophobicContact CG2-CG2 3.99Å; V141-L157 HydrophobicContact CB-CD1 3.85Å; V141-L157 HydrophobicContact CG1-CD1 4.3Å; V141-L157 HydrophobicContact CG2-CD1 3.71Å; V141-L157 HydrophobicContact CG2-CD2 4.19Å; V141-I162 HydrophobicContact CG2-CG2 4.05Å; V141-P163 PolarHBondContact N-O 3.49Å; V141-Q164 HydrophobicContact CB-CG 4.48Å; V141-Q164 CarbonylContact O-C 3.57Å; V141-Q164 VanDerWaalsContact O-CA 3.29Å; V141-Q164 WeakPolarHBondContact O-CA 3.45Å; V141-I165 PolarHBondContact O-N 2.97Å
142	I	98.3	Very high	83.9	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	124.1	171.5	-53.6	-58.2	0	0	0	108.9	G38 G39 L40 M68 I165 Y167 A397 V398 M401	G38-I142 PolarHBondContact O-N 3.37Å; G39-I142 WeakPolarHBondContact CA-O 3.5Å; L40-I142 PolarHBondContact N-O 3.06Å; M68-I142 HydrophobicContact CE-CB 4.4Å; M68-I142 HydrophobicContact CE-CG1 4.3Å; M68-I142 HydrophobicContact SD-CB 4.23Å; I142-I165 WeakPolarHBondContact CA-O 3.22Å; I142-I165 HydrophobicContact CD1-CB 4.12Å; I142-Y167 HydrophobicContact CG2-CD1 4.05Å; I142-A397 HydrophobicContact CD1-CB 4.36Å; I142-A397 HydrophobicContact CG2-CB 4.06Å; I142-V398 HydrophobicContact CG1-CG2 4.29Å; I142-V398 HydrophobicContact CG2-CG2 4.35Å; I142-M401 HydrophobicContact CD1-CB 4.17Å; I142-M401 HydrophobicContact CD1-CE 4.44Å
143	G	94.9	Very high	86.2	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.164	C	C	.	.			trans	112.4	-169.5	-172.4	0	0	0	0	0	112.4	Q164 I165	G143-Q164 WeakPolarHBondContact O-CG 3.43Å; G143-Q164 PolarHBondContact O-NE2 3.45Å; G143-I165 PolarHBondContact N-O 3.32Å
144	G	92.9	Very high	88.2	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.134	C	C	.	.			cis	-80	176.9	-6.2	0	0	0	0	0	113.2	S150 S166 S169	G144-S150 PolarHBondContact N-OG 3.43Å; G144-S150 VanDerWaalsContact N-OG 3.15Å; G144-S150 PolarHBondContact O-OG 3.37Å; G144-S166 PolarHBondContact O-OG 3.2Å; G144-S169 PolarHBondContact O-OG 3.4Å; G144-S169 VanDerWaalsContact O-OG 3.06Å
145	S	92.1	Very high	90.1	Very high	9 Å²	9	18.5 Å²	18.5	6%	0.063	11%	0.111	C	C	.	.	S	Bend	trans	-76.3	-52.2	179.9	-175.6	0	0	0	0	113	R64 A168 S169	R64-S145 PolarHBondContact NH1-OG 3.43Å; S145-A168 CarbonylContact O-C 3.57Å; S145-A168 VanDerWaalsContact O-C 3.26Å; S145-A168 WeakPolarHBondContact O-CB 3.34Å; S145-S169 PolarHBondContact O-N 3.18Å; S145-S169 PolarHBondContact O-OG 2.88Å
146	Y	91.2	Very high	91.8	Very high	25 Å²	25	17.4 Å²	17.4	10%	0.098	10%	0.103	C	C	.	.	S	Bend	trans	-84.9	139.1	-176.3	-67.7	-81.9	0	0	0	111.2	P42 S96 S148 V149 S150 S169	P42-Y146 HydrophobicContact CB-CE2 4.09Å; P42-Y146 HydrophobicContact CG-CE2 4.49Å; S96-Y146 WeakPolarHBondContact OG-CE2 3.25Å; Y146-S148 VanDerWaalsContact C-N 3.31Å; Y146-S148 PolarHBondContact O-N 2.79Å; Y146-V149 WeakPolarHBondContact O-CB 3.32Å; Y146-V149 PolarHBondContact O-N 3.21Å; Y146-S150 PolarHBondContact O-N 3.43Å; Y146-S169 PolarHBondContact O-OG 3.37Å
147	S	93.5	Very high	93.1	Very high	5 Å²	5	15 Å²	15	4%	0.035	9%	0.09	C	C	.	.	H	α-helix	trans	-56.4	-41.5	-179.4	-57.9	0	0	0	0	113.3	V149 S150 I151 T170 S171	S147-V149 VanDerWaalsContact C-N 3.31Å; S147-V149 PolarHBondContact O-N 2.87Å; S147-S150 PolarHBondContact O-N 3.43Å; S147-I151 VanDerWaalsContact O-CG1 3.28Å; S147-I151 WeakPolarHBondContact O-CG1 3.38Å; S147-I151 PolarHBondContact O-N 3.28Å; S147-T170 PolarHBondContact OG-N 2.98Å; S147-S171 PolarHBondContact OG-N 2.88Å
148	S	90.9	Very high	93.9	Very high	31 Å²	31	16 Å²	16	22%	0.217	8%	0.08	C	C	.	.	H	α-helix	trans	-63.4	-35.8	177.1	55.2	0	0	0	0	112.9	Y146 Q152	Y146-S148 VanDerWaalsContact C-N 3.31Å; Y146-S148 PolarHBondContact O-N 2.79Å; S148-Q152 PolarHBondContact O-N 2.97Å
149	V	92.4	Very high	94	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-67.1	-50.2	174.4	170	0	0	0	0	110.1	T94 D98 A101 Y146 S147 I151 Q152 V153	T94-V149 HydrophobicContact CG2-CG1 4.14Å; D98-V149 HydrophobicContact CB-CG2 4.48Å; A101-V149 HydrophobicContact CB-CB 4.44Å; A101-V149 HydrophobicContact CB-CG1 3.44Å; A101-V149 VanDerWaalsContact CB-CG1 3.44Å; A101-V149 HydrophobicContact CB-CG2 4.3Å; Y146-V149 WeakPolarHBondContact O-CB 3.32Å; Y146-V149 PolarHBondContact O-N 3.21Å; S147-V149 VanDerWaalsContact C-N 3.31Å; S147-V149 PolarHBondContact O-N 2.87Å; V149-I151 VanDerWaalsContact C-N 3.27Å; V149-I151 PolarHBondContact O-N 2.93Å; V149-Q152 PolarHBondContact O-N 3.18Å; V149-V153 HydrophobicContact CG1-CG2 4.18Å; V149-V153 WeakPolarHBondContact O-CG2 3.5Å; V149-V153 PolarHBondContact O-N 3.44Å
150	S	95.9	Very high	94	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61	-35.7	179.9	-69.7	0	0	0	0	112.6	G144 Y146 S147 A154 Q164 S169	G144-S150 PolarHBondContact N-OG 3.43Å; G144-S150 VanDerWaalsContact N-OG 3.15Å; G144-S150 PolarHBondContact O-OG 3.37Å; Y146-S150 PolarHBondContact O-N 3.43Å; S147-S150 PolarHBondContact O-N 3.43Å; S150-A154 WeakPolarHBondContact O-CB 3.39Å; S150-A154 PolarHBondContact O-N 3.44Å; S150-Q164 PolarHBondContact OG-NE2 3.42Å; S150-S169 VanDerWaalsContact CB-OG 3.32Å; S150-S169 WeakPolarHBondContact CB-OG 3.34Å; S150-S169 PolarHBondContact OG-OG 3.47Å
151	I	94.9	Very high	93.9	Very high	7 Å²	7	27.4 Å²	27.4	4%	0.036	13%	0.134	C	C	.	.	H	α-helix	trans	-61.1	-47.5	174.9	-74.7	167.1	0	0	0	111.3	S147 V149 N155 L174 Y180 D217	S147-I151 VanDerWaalsContact O-CG1 3.28Å; S147-I151 WeakPolarHBondContact O-CG1 3.38Å; S147-I151 PolarHBondContact O-N 3.28Å; V149-I151 VanDerWaalsContact C-N 3.27Å; V149-I151 PolarHBondContact O-N 2.93Å; I151-N155 PolarHBondContact O-N 3.43Å; I151-N155 PolarHBondContact O-ND2 3.22Å; I151-L174 HydrophobicContact CG1-CD1 4.37Å; I151-L174 HydrophobicContact CG1-CD2 3.66Å; I151-L174 HydrophobicContact CG1-CG 3.92Å; I151-Y180 HydrophobicContact CG2-CE1 4.31Å; I151-Y180 WeakPolarHBondContact CG2-OH 3.46Å; I151-D217 HydrophobicContact CD1-CB 3.58Å
152	Q	94.1	Very high	93.7	Very high	69 Å²	69	27.9 Å²	27.9	32%	0.322	14%	0.137	S	C	.	.	H	α-helix	trans	-66.3	-45.3	179.3	-66.2	-56.8	-32.7	0	0	111.8	D98 L102 S148 V149 N155 L156	D98-Q152 HydrophobicContact CB-CG 4.02Å; L102-Q152 HydrophobicContact CB-CB 4.47Å; S148-Q152 PolarHBondContact O-N 2.97Å; V149-Q152 PolarHBondContact O-N 3.18Å; Q152-N155 PolarHBondContact O-N 3Å; Q152-L156 PolarHBondContact O-N 3.1Å
153	V	95.3	Very high	93.6	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-64.9	-43.3	-179.9	173.5	0	0	0	0	111.2	L40 A101 A105 V149 N155 L156 L157	L40-V153 HydrophobicContact CD1-CB 4.33Å; L40-V153 HydrophobicContact CD1-CG1 3.71Å; L40-V153 HydrophobicContact CD1-CG2 3.84Å; A101-V153 HydrophobicContact CB-CG2 4.47Å; A105-V153 HydrophobicContact CB-CG1 4.09Å; A105-V153 HydrophobicContact CB-CG2 4.08Å; V149-V153 HydrophobicContact CG1-CG2 4.18Å; V149-V153 WeakPolarHBondContact O-CG2 3.5Å; V149-V153 PolarHBondContact O-N 3.44Å; V153-N155 VanDerWaalsContact C-N 3.28Å; V153-N155 PolarHBondContact O-N 3.13Å; V153-L156 WeakPolarHBondContact O-CB 3.13Å; V153-L156 PolarHBondContact O-N 2.81Å; V153-L157 HydrophobicContact CG1-CD1 3.59Å; V153-L157 HydrophobicContact CG1-CG 3.91Å; V153-L157 WeakPolarHBondContact O-CG 3.34Å; V153-L157 PolarHBondContact O-N 3.44Å
154	A	95.8	Very high	93.8	Very high	8 Å²	8	28 Å²	28	7%	0.066	14%	0.138	C	C	.	.	H	α-helix	trans	-61	-36.7	178.5	0	0	0	0	0	112.1	S150 L156 L157 R158 Y180 F183	S150-A154 WeakPolarHBondContact O-CB 3.39Å; S150-A154 PolarHBondContact O-N 3.44Å; A154-L156 VanDerWaalsContact C-N 3.27Å; A154-L156 PolarHBondContact O-N 3.28Å; A154-L157 PolarHBondContact O-N 3.06Å; A154-R158 WeakPolarHBondContact O-CB 3.38Å; A154-R158 WeakPolarHBondContact O-CG 3.44Å; A154-R158 PolarHBondContact O-N 3.16Å; A154-Y180 HydrophobicContact CB-CD1 3.9Å; A154-Y180 HydrophobicContact CB-CE1 4.48Å; A154-F183 HydrophobicContact CB-CD2 4.37Å
155	N	94.6	Very high	94	Very high	50 Å²	50	28.1 Å²	28.1	27%	0.267	14%	0.138	S	C	.	.	H	α-helix	trans	-64.2	-30.1	175.7	-73.6	-37.8	0	0	0	113	I151 Q152 V153 R158	I151-N155 PolarHBondContact O-N 3.43Å; I151-N155 PolarHBondContact O-ND2 3.22Å; Q152-N155 PolarHBondContact O-N 3Å; V153-N155 VanDerWaalsContact C-N 3.28Å; V153-N155 PolarHBondContact O-N 3.13Å; N155-R158 VanDerWaalsContact O-CG 3.22Å; N155-R158 WeakPolarHBondContact O-CG 3.45Å
156	L	94.3	Very high	94.3	Very high	20 Å²	20	27.7 Å²	27.7	11%	0.105	14%	0.135	C	C	.	.	H	α-helix	trans	-78	-53.1	172.9	175.8	64.6	0	0	0	111	L102 A105 L106 Q152 V153 A154 R158 L159 F160	L102-L156 HydrophobicContact CD1-CB 3.88Å; L102-L156 HydrophobicContact CD1-CD2 4.03Å; A105-L156 HydrophobicContact CB-CD2 3.89Å; L106-L156 HydrophobicContact CD2-CD1 4.01Å; L106-L156 HydrophobicContact CD2-CD2 3.88Å; L106-L156 HydrophobicContact CG-CD2 4.24Å; Q152-L156 PolarHBondContact O-N 3.1Å; V153-L156 WeakPolarHBondContact O-CB 3.13Å; V153-L156 PolarHBondContact O-N 2.81Å; A154-L156 VanDerWaalsContact C-N 3.27Å; A154-L156 PolarHBondContact O-N 3.28Å; L156-R158 PolarHBondContact O-N 3.16Å; L156-L159 WeakPolarHBondContact O-CB 3.33Å; L156-L159 PolarHBondContact O-N 3.3Å; L156-F160 HydrophobicContact CD1-CE2 3.98Å
157	L	93.9	Very high	94.5	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.01	13%	0.13	C	C	.	.	H	α-helix	trans	-61.9	-31.6	-173.3	-66.1	-178.7	0	0	0	112.8	V109 V141 V153 A154 L159 F160 Q161 I162 Q164	V109-L157 HydrophobicContact CG1-CD2 4.28Å; V141-L157 HydrophobicContact CB-CD1 3.85Å; V141-L157 HydrophobicContact CG1-CD1 4.3Å; V141-L157 HydrophobicContact CG2-CD1 3.71Å; V141-L157 HydrophobicContact CG2-CD2 4.19Å; V153-L157 HydrophobicContact CG1-CD1 3.59Å; V153-L157 HydrophobicContact CG1-CG 3.91Å; V153-L157 WeakPolarHBondContact O-CG 3.34Å; V153-L157 PolarHBondContact O-N 3.44Å; A154-L157 PolarHBondContact O-N 3.06Å; L157-L159 PolarHBondContact O-N 2.87Å; L157-F160 CarbonylContact O-C 3.56Å; L157-F160 PolarHBondContact O-N 3.1Å; L157-F160 VanDerWaalsContact O-N 3.11Å; L157-Q161 PolarHBondContact O-N 3.32Å; L157-I162 HydrophobicContact CB-CB 4.26Å; L157-I162 HydrophobicContact CD2-CB 4.13Å; L157-I162 HydrophobicContact CD2-CD1 4.23Å; L157-I162 HydrophobicContact CD2-CG2 4.25Å; L157-I162 PolarHBondContact O-N 2.96Å; L157-Q164 HydrophobicContact CD1-CB 4Å; L157-Q164 HydrophobicContact CD1-CG 4.31Å
158	R	93.7	Very high	94.5	Very high	90 Å²	90	26.7 Å²	26.7	34%	0.34	13%	0.132	S	C	.	.	G	3₁₀ helix	trans	-60.2	-29.3	175.1	64.9	172.7	-81.5	172.9	-2.8	114.1	A154 N155 L156 F160 Q161 R179 D181 Y182	A154-R158 WeakPolarHBondContact O-CB 3.38Å; A154-R158 WeakPolarHBondContact O-CG 3.44Å; A154-R158 PolarHBondContact O-N 3.16Å; N155-R158 VanDerWaalsContact O-CG 3.22Å; N155-R158 WeakPolarHBondContact O-CG 3.45Å; L156-R158 PolarHBondContact O-N 3.16Å; R158-F160 PolarHBondContact O-N 3.45Å; R158-Q161 PolarHBondContact O-N 3.38Å; R158-R179 PolarHBondContact NH1-O 2.86Å; R158-D181 WeakPolarHBondContact CB-OD1 3.45Å; R158-Y182 HydrophobicContact CB-CD2 4.01Å; R158-Y182 HydrophobicContact CB-CE2 4.45Å
159	L	92.1	Very high	94.7	Very high	126 Å²	126	25.2 Å²	25.2	66%	0.66	12%	0.122	S	C	*	.	G	3₁₀ helix	trans	-68.6	-29.4	179.1	-59.8	177	0	0	0	111.5	L156 L157	L156-L159 WeakPolarHBondContact O-CB 3.33Å; L156-L159 PolarHBondContact O-N 3.3Å; L157-L159 PolarHBondContact O-N 2.87Å
160	F	90.9	Very high	94.8	Very high	62 Å²	62	25.3 Å²	25.3	27%	0.272	12%	0.123	S	C	.	.	G	3₁₀ helix	trans	-103.8	6.7	179.2	-60	-86.8	0	0	0	112.7	V109 L113 L156 L157 R158 I162	V109-F160 HydrophobicContact CB-CD1 4.15Å; V109-F160 HydrophobicContact CB-CD2 3.76Å; V109-F160 HydrophobicContact CB-CE1 4.18Å; V109-F160 HydrophobicContact CB-CE2 3.79Å; V109-F160 HydrophobicContact CB-CG 3.94Å; V109-F160 HydrophobicContact CB-CZ 3.99Å; V109-F160 HydrophobicContact CG1-CB 4.06Å; V109-F160 HydrophobicContact CG1-CD1 4.36Å; V109-F160 HydrophobicContact CG1-CD2 3.33Å; V109-F160 HydrophobicContact CG1-CE2 3.79Å; V109-F160 HydrophobicContact CG1-CG 3.65Å; V109-F160 HydrophobicContact CG1-CZ 4.47Å; V109-F160 HydrophobicContact CG2-CD2 4.3Å; V109-F160 HydrophobicContact CG2-CE2 3.87Å; V109-F160 HydrophobicContact CG2-CZ 4.09Å; L113-F160 HydrophobicContact CD1-CZ 4.46Å; L113-F160 HydrophobicContact CD2-CE1 3.79Å; L113-F160 HydrophobicContact CD2-CZ 3.8Å; L113-F160 HydrophobicContact CG-CE1 4.04Å; L113-F160 HydrophobicContact CG-CZ 4.11Å; L156-F160 HydrophobicContact CD1-CE2 3.98Å; L157-F160 CarbonylContact O-C 3.56Å; L157-F160 PolarHBondContact O-N 3.1Å; L157-F160 VanDerWaalsContact O-N 3.11Å; R158-F160 PolarHBondContact O-N 3.45Å; F160-I162 HydrophobicContact CB-CD1 4.07Å; F160-I162 HydrophobicContact CB-CG1 4.04Å; F160-I162 PolarHBondContact O-N 3.35Å
161	Q	92.3	Very high	94.7	Very high	71 Å²	71	25.3 Å²	25.3	33%	0.332	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	30.1	-179.3	-53.5	177.4	-7.7	0	0	113.5	L157 R158 P163 Y182 G428	L157-Q161 PolarHBondContact O-N 3.32Å; R158-Q161 PolarHBondContact O-N 3.38Å; Q161-P163 WeakPolarHBondContact O-CD 3.37Å; Q161-Y182 HydrophobicContact CB-CE2 4.26Å; Q161-Y182 HydrophobicContact CG-CE2 4.18Å; Q161-G428 CarbonylContact O-C 3.26Å; Q161-G428 WeakPolarHBondContact O-CA 3.07Å
162	I	94.3	Very high	94.6	Very high	11 Å²	11	26.8 Å²	26.8	6%	0.056	14%	0.136	C	C	.	.			trans	-87.9	119.9	179.8	-59.6	176.7	0	0	0	108.9	V109 I138 V141 L157 F160	V109-I162 HydrophobicContact CG1-CD1 3.91Å; I138-I162 HydrophobicContact CG2-CG2 4.44Å; V141-I162 HydrophobicContact CG2-CG2 4.05Å; L157-I162 HydrophobicContact CB-CB 4.26Å; L157-I162 HydrophobicContact CD2-CB 4.13Å; L157-I162 HydrophobicContact CD2-CD1 4.23Å; L157-I162 HydrophobicContact CD2-CG2 4.25Å; L157-I162 PolarHBondContact O-N 2.96Å; F160-I162 HydrophobicContact CB-CD1 4.07Å; F160-I162 HydrophobicContact CB-CG1 4.04Å; F160-I162 PolarHBondContact O-N 3.35Å
163	P	96.6	Very high	94.5	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.006	14%	0.138	C	C	.	.			trans	-71.2	143.9	178	27.4	-31.9	0	0	0	112.4	G140 V141 Q161 Y182 M401 L431 Y432 I436	G140-P163 CarbonylContact C-O 3.56Å; G140-P163 VanDerWaalsContact CA-O 3.28Å; G140-P163 WeakPolarHBondContact CA-O 3.34Å; V141-P163 PolarHBondContact N-O 3.49Å; Q161-P163 WeakPolarHBondContact O-CD 3.37Å; P163-Y182 WeakPolarHBondContact CA-O 3.11Å; P163-M401 HydrophobicContact CG-CE 4.44Å; P163-L431 HydrophobicContact CG-CD2 3.81Å; P163-L431 HydrophobicContact CG-CG 4.18Å; P163-Y432 HydrophobicContact CB-CD2 4.13Å; P163-I436 HydrophobicContact CB-CD1 3.54Å; P163-I436 HydrophobicContact CG-CD1 3.83Å
164	Q	97.5	Very high	94.4	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.009	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	129	179.5	-177.3	-174.2	-18.6	0	0	110	V141 G143 S150 L157 Y182 F183 A184	V141-Q164 HydrophobicContact CB-CG 4.48Å; V141-Q164 CarbonylContact O-C 3.57Å; V141-Q164 VanDerWaalsContact O-CA 3.29Å; V141-Q164 WeakPolarHBondContact O-CA 3.45Å; G143-Q164 WeakPolarHBondContact O-CG 3.43Å; G143-Q164 PolarHBondContact O-NE2 3.45Å; S150-Q164 PolarHBondContact OG-NE2 3.42Å; L157-Q164 HydrophobicContact CD1-CB 4Å; L157-Q164 HydrophobicContact CD1-CG 4.31Å; Q164-Y182 PolarHBondContact N-O 3.33Å; Q164-F183 HydrophobicContact CB-CD2 4.32Å; Q164-F183 HydrophobicContact CG-CD2 4.15Å; Q164-F183 HydrophobicContact CG-CE2 4.37Å; Q164-A184 PolarHBondContact O-N 3.37Å
165	I	98.3	Very high	94.4	Very high	1 Å²	1	28 Å²	28	1%	0.005	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	107.9	171	-52.5	-178.3	0	0	0	109.1	V141 I142 G143 A184 T186 A397 A400 M401 I436 F456	V141-I165 PolarHBondContact O-N 2.97Å; I142-I165 WeakPolarHBondContact CA-O 3.22Å; I142-I165 HydrophobicContact CD1-CB 4.12Å; G143-I165 PolarHBondContact N-O 3.32Å; I165-A184 CarbonylContact C-O 3.5Å; I165-A184 VanDerWaalsContact CA-O 3.26Å; I165-A184 WeakPolarHBondContact CA-O 3.49Å; I165-A184 HydrophobicContact CG1-CB 4.38Å; I165-T186 HydrophobicContact CG2-CG2 4.15Å; I165-A397 HydrophobicContact CB-CB 4.44Å; I165-A397 HydrophobicContact CG2-CB 3.75Å; I165-A400 HydrophobicContact CD1-CB 4.25Å; I165-M401 HydrophobicContact CD1-CB 4.25Å; I165-M401 HydrophobicContact CD1-CE 3.78Å; I165-M401 HydrophobicContact CG1-CE 3.9Å; I165-I436 HydrophobicContact CD1-CD1 4.37Å; I165-I436 HydrophobicContact CD1-CG2 3.97Å; I165-I436 HydrophobicContact CG1-CG2 4.4Å; I165-F456 HydrophobicContact CG2-CZ 4.3Å
166	S	97.8	Very high	94.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	142.8	174.9	-179	0	0	0	0	111.9	G144 A168 S169 A184 R185 T186	G144-S166 PolarHBondContact O-OG 3.2Å; S166-A168 PolarHBondContact OG-N 2.98Å; S166-S169 WeakPolarHBondContact OG-CB 3.46Å; S166-S169 PolarHBondContact OG-N 3.19Å; S166-S169 PolarHBondContact OG-OG 3.37Å; S166-S169 VanDerWaalsContact OG-OG 3.14Å; S166-A184 PolarHBondContact N-O 3.29Å; S166-R185 WeakPolarHBondContact O-CA 3.36Å; S166-R185 VanDerWaalsContact O-CB 3.24Å; S166-R185 WeakPolarHBondContact O-CB 3.37Å; S166-T186 PolarHBondContact O-N 3.12Å; S166-T186 VanDerWaalsContact O-N 3.08Å
167	Y	95.6	Very high	94.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.149	C	C	.	.	S	Bend	trans	-101.1	-4.3	177.3	58	-99.7	0	0	0	113.7	L40 F41 I142 V187 F393 V394	L40-Y167 PolarHBondContact O-OH 3.14Å; F41-Y167 AromaticContact CD1-CE1 4Å; F41-Y167 HydrophobicContact CD1-CE1 4Å; F41-Y167 AromaticContact CD1-CZ 3.74Å; F41-Y167 WeakPolarHBondContact CD1-OH 3.41Å; F41-Y167 HydrophobicContact CE1-CD1 4.42Å; F41-Y167 AromaticContact CE1-CE1 3.55Å; F41-Y167 HydrophobicContact CE1-CE1 3.55Å; F41-Y167 AromaticContact CE1-CZ 3.7Å; F41-Y167 HydrophobicContact CZ-CE1 4.18Å; I142-Y167 HydrophobicContact CG2-CD1 4.05Å; Y167-V187 WeakPolarHBondContact O-CG1 3.48Å; Y167-F393 WeakPolarHBondContact O-CB 3.42Å; Y167-V394 HydrophobicContact CD1-CG2 4.03Å; Y167-V394 HydrophobicContact CD2-CG2 3.53Å; Y167-V394 HydrophobicContact CE1-CG2 4.44Å; Y167-V394 HydrophobicContact CE2-CG2 4.01Å; Y167-V394 HydrophobicContact CG-CB 4.4Å; Y167-V394 HydrophobicContact CG-CG2 3.55Å
168	A	94.3	Very high	94.3	Very high	9 Å²	9	35.3 Å²	35.3	7%	0.074	18%	0.183	C	C	.	.	S	Bend	trans	-152.1	-3.4	-174.7	0	0	0	0	0	115.7	S145 S166 T170 K390	S145-A168 CarbonylContact O-C 3.57Å; S145-A168 VanDerWaalsContact O-C 3.26Å; S145-A168 WeakPolarHBondContact O-CB 3.34Å; S166-A168 PolarHBondContact OG-N 2.98Å; A168-T170 PolarHBondContact O-N 3.19Å; A168-K390 HydrophobicContact CB-CD 3.86Å
169	S	94.6	Very high	94.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.187	C	C	.	.			trans	-84.4	104.3	178.7	-64.2	0	0	0	0	111.7	G144 S145 Y146 S150 S166 R185	G144-S169 PolarHBondContact O-OG 3.4Å; G144-S169 VanDerWaalsContact O-OG 3.06Å; S145-S169 PolarHBondContact O-N 3.18Å; S145-S169 PolarHBondContact O-OG 2.88Å; Y146-S169 PolarHBondContact O-OG 3.37Å; S150-S169 VanDerWaalsContact CB-OG 3.32Å; S150-S169 WeakPolarHBondContact CB-OG 3.34Å; S150-S169 PolarHBondContact OG-OG 3.47Å; S166-S169 WeakPolarHBondContact OG-CB 3.46Å; S166-S169 PolarHBondContact OG-N 3.19Å; S166-S169 PolarHBondContact OG-OG 3.37Å; S166-S169 VanDerWaalsContact OG-OG 3.14Å; S169-R185 WeakPolarHBondContact O-CD 3.46Å; S169-R185 PolarHBondContact O-NH1 3.44Å
170	T	94.5	Very high	94.4	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.012	16%	0.156	C	C	.	.			trans	-102.4	-3	-169.8	56.4	0	0	0	0	114.5	S147 A168 A172 R185 V187 P189 D190 Y218	S147-T170 PolarHBondContact OG-N 2.98Å; A168-T170 PolarHBondContact O-N 3.19Å; T170-A172 PolarHBondContact O-N 3.47Å; T170-R185 VanDerWaalsContact CA-NH1 3.31Å; T170-R185 PolarHBondContact O-NH1 3.03Å; T170-R185 VanDerWaalsContact O-NH1 3.08Å; T170-V187 HydrophobicContact CG2-CB 4.19Å; T170-V187 HydrophobicContact CG2-CG2 3.69Å; T170-P189 CarbonylContact O-C 3.57Å; T170-P189 VanDerWaalsContact O-CA 3.29Å; T170-P189 WeakPolarHBondContact O-CA 3.36Å; T170-D190 WeakPolarHBondContact CB-OD1 3.47Å; T170-D190 PolarHBondContact O-N 3.26Å; T170-D190 VanDerWaalsContact OG1-CG 3.28Å; T170-D190 PolarHBondContact OG1-OD1 2.92Å; T170-D190 PolarHBondContact OG1-OD2 3.45Å; T170-Y218 WeakPolarHBondContact OG1-CE2 3.5Å
171	S	93.7	Very high	94.5	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.156	C	C	.	.			trans	-56.5	134.9	179.7	178	0	0	0	0	112.1	S147 K173 L174 R185 D190 D217 T221	S147-S171 PolarHBondContact OG-N 2.88Å; S171-K173 PolarHBondContact O-N 3.23Å; S171-K173 PolarHBondContact OG-N 3.15Å; S171-L174 PolarHBondContact O-N 3.06Å; S171-R185 PolarHBondContact O-NH1 3.33Å; S171-D190 VanDerWaalsContact CA-OD2 3.3Å; S171-D190 WeakPolarHBondContact CA-OD2 3.47Å; S171-D190 PolarHBondContact N-OD2 2.9Å; S171-D217 PolarHBondContact OG-O 3.41Å; S171-T221 PolarHBondContact OG-OG1 2.94Å; S171-T221 VanDerWaalsContact OG-OG1 3.09Å
172	A	91.8	Very high	94.7	Very high	39 Å²	39	27.6 Å²	27.6	32%	0.322	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-64.7	-21.8	179.5	0	0	0	0	0	113.2	T170 L174 S175	T170-A172 PolarHBondContact O-N 3.47Å; A172-L174 PolarHBondContact O-N 3.35Å; A172-S175 WeakPolarHBondContact O-CB 3.29Å; A172-S175 PolarHBondContact O-N 2.95Å; A172-S175 PolarHBondContact O-OG 3.49Å
173	K	91.8	Very high	94.8	Very high	83 Å²	83	27.1 Å²	27.1	36%	0.361	14%	0.141	S	C	.	.	G	3₁₀ helix	trans	-58.7	-32.7	177.3	-76.8	178.2	177.9	172.5	0	112.9	S171 S175 D176 Y180 D217 T221	S171-K173 PolarHBondContact O-N 3.23Å; S171-K173 PolarHBondContact OG-N 3.15Å; K173-S175 PolarHBondContact O-N 2.96Å; K173-D176 PolarHBondContact O-N 3.16Å; K173-Y180 VanDerWaalsContact O-CD2 3.28Å; K173-Y180 WeakPolarHBondContact O-CD2 3.17Å; K173-Y180 WeakPolarHBondContact O-CE2 3.45Å; K173-D217 HydrophobicContact CD-CB 4.49Å; K173-D217 WeakPolarHBondContact CD-OD1 3.47Å; K173-D217 IonicContact NZ-OD1 3.21Å; K173-D217 PolarHBondContact NZ-OD1 3.32Å; K173-T221 HydrophobicContact CD-CG2 3.84Å; K173-T221 HydrophobicContact CG-CG2 4.01Å
174	L	94.5	Very high	94.9	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-71.4	-12.3	-176.6	-73.1	162.7	0	0	0	113.7	I151 S171 A172 D176 Y180 F183	I151-L174 HydrophobicContact CG1-CD1 4.37Å; I151-L174 HydrophobicContact CG1-CD2 3.66Å; I151-L174 HydrophobicContact CG1-CG 3.92Å; S171-L174 PolarHBondContact O-N 3.06Å; A172-L174 PolarHBondContact O-N 3.35Å; L174-D176 VanDerWaalsContact C-N 3.31Å; L174-Y180 HydrophobicContact CD2-CD1 4.27Å; L174-Y180 HydrophobicContact CD2-CD2 4.4Å; L174-Y180 HydrophobicContact CD2-CE1 4.41Å; L174-Y180 HydrophobicContact CD2-CG 4.26Å; L174-F183 HydrophobicContact CB-CD1 3.85Å; L174-F183 HydrophobicContact CB-CE1 3.58Å; L174-F183 HydrophobicContact CB-CZ 4.17Å; L174-F183 HydrophobicContact CD1-CE1 4.01Å; L174-F183 HydrophobicContact CD1-CE2 4.32Å; L174-F183 HydrophobicContact CD1-CZ 3.72Å; L174-F183 HydrophobicContact CD2-CD1 4.21Å; L174-F183 HydrophobicContact CD2-CD2 4.18Å; L174-F183 HydrophobicContact CD2-CE1 4.17Å; L174-F183 HydrophobicContact CD2-CE2 4.12Å; L174-F183 HydrophobicContact CD2-CG 4.22Å; L174-F183 HydrophobicContact CD2-CZ 4.12Å; L174-F183 HydrophobicContact CG-CE1 4.12Å; L174-F183 HydrophobicContact CG-CZ 4.22Å
175	S	94.4	Very high	94.9	Very high	20 Å²	20	27 Å²	27	14%	0.14	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-76.5	-16.6	175	-54.5	0	0	0	0	112.8	A172 K173 K177 R185 Q459 D461	A172-S175 WeakPolarHBondContact O-CB 3.29Å; A172-S175 PolarHBondContact O-N 2.95Å; A172-S175 PolarHBondContact O-OG 3.49Å; K173-S175 PolarHBondContact O-N 2.96Å; S175-K177 PolarHBondContact O-N 3.05Å; S175-R185 PolarHBondContact OG-NH2 3.11Å; S175-Q459 PolarHBondContact O-OE1 2.81Å; S175-D461 WeakPolarHBondContact CB-OD2 3.29Å; S175-D461 PolarHBondContact OG-OD1 3.35Å; S175-D461 PolarHBondContact OG-OD2 3.48Å
176	D	94.8	Very high	94.8	Very high	63 Å²	63	27.5 Å²	27.5	34%	0.337	14%	0.144	S	C	.	.			trans	-72.2	98.1	179.3	179	7.4	0	0	0	112.3	K173 L174 T178 R179 Y180	K173-D176 PolarHBondContact O-N 3.16Å; L174-D176 VanDerWaalsContact C-N 3.31Å; D176-T178 VanDerWaalsContact CG-OG1 3.3Å; D176-T178 PolarHBondContact O-N 3.37Å; D176-T178 WeakPolarHBondContact OD1-CB 3.35Å; D176-T178 PolarHBondContact OD1-N 3.39Å; D176-T178 PolarHBondContact OD1-OG1 2.89Å; D176-T178 PolarHBondContact OD2-OG1 3.41Å; D176-R179 PolarHBondContact O-N 3.46Å; D176-R179 VanDerWaalsContact O-N 3.09Å; D176-R179 WeakPolarHBondContact OD2-CD 3.24Å; D176-R179 WeakPolarHBondContact OD2-CG 3.46Å; D176-Y180 PolarHBondContact O-N 2.94Å
177	K	93.1	Very high	94.6	Very high	45 Å²	45	27.5 Å²	27.5	20%	0.196	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-8.4	179.2	-59	-53.2	173.6	-154.7	0	115.2	S175 R179 Y180 F183 Y432 Q459	S175-K177 PolarHBondContact O-N 3.05Å; K177-R179 PolarHBondContact O-N 3.22Å; K177-Y180 VanDerWaalsContact CD-O 3.25Å; K177-Y180 WeakPolarHBondContact CD-O 3.44Å; K177-F183 PolarHBondContact NZ-O 2.91Å; K177-Y432 WeakPolarHBondContact CE-OH 3.28Å; K177-Y432 PolarHBondContact NZ-OH 3.28Å; K177-Q459 WeakPolarHBondContact CE-O 3.39Å; K177-Q459 PolarHBondContact NZ-O 3.48Å
178	T	93.1	Very high	94.6	Very high	116 Å²	116	27.6 Å²	27.6	71%	0.712	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-24.9	168.7	73.8	0	0	0	0	111.3	D176	D176-T178 VanDerWaalsContact CG-OG1 3.3Å; D176-T178 PolarHBondContact O-N 3.37Å; D176-T178 WeakPolarHBondContact OD1-CB 3.35Å; D176-T178 PolarHBondContact OD1-N 3.39Å; D176-T178 PolarHBondContact OD1-OG1 2.89Å; D176-T178 PolarHBondContact OD2-OG1 3.41Å
179	R	93.1	Very high	94.6	Very high	113 Å²	113	27.6 Å²	27.6	43%	0.426	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-38	-178.3	-66.3	-174.3	62.5	-165.4	-3.9	113.8	R158 D176 K177	R158-R179 PolarHBondContact NH1-O 2.86Å; D176-R179 PolarHBondContact O-N 3.46Å; D176-R179 VanDerWaalsContact O-N 3.09Å; D176-R179 WeakPolarHBondContact OD2-CD 3.24Å; D176-R179 WeakPolarHBondContact OD2-CG 3.46Å; K177-R179 PolarHBondContact O-N 3.22Å
180	Y	95.1	Very high	94.5	Very high	5 Å²	5	27.7 Å²	27.7	2%	0.02	14%	0.144	C	C	.	.			trans	-119.8	63.6	-175	-50.3	-70.2	0	0	0	110.3	I151 A154 K173 L174 D176 K177 Y182 F183	I151-Y180 HydrophobicContact CG2-CE1 4.31Å; I151-Y180 WeakPolarHBondContact CG2-OH 3.46Å; A154-Y180 HydrophobicContact CB-CD1 3.9Å; A154-Y180 HydrophobicContact CB-CE1 4.48Å; K173-Y180 VanDerWaalsContact O-CD2 3.28Å; K173-Y180 WeakPolarHBondContact O-CD2 3.17Å; K173-Y180 WeakPolarHBondContact O-CE2 3.45Å; L174-Y180 HydrophobicContact CD2-CD1 4.27Å; L174-Y180 HydrophobicContact CD2-CD2 4.4Å; L174-Y180 HydrophobicContact CD2-CE1 4.41Å; L174-Y180 HydrophobicContact CD2-CG 4.26Å; D176-Y180 PolarHBondContact O-N 2.94Å; K177-Y180 VanDerWaalsContact CD-O 3.25Å; K177-Y180 WeakPolarHBondContact CD-O 3.44Å; Y180-Y182 VanDerWaalsContact C-N 3.3Å; Y180-Y182 PolarHBondContact O-N 3.01Å; Y180-F183 PolarHBondContact O-N 2.65Å
181	D	93.4	Very high	94.4	Very high	50 Å²	50	31.4 Å²	31.4	27%	0.267	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-20.2	-172.1	55.1	-17.8	0	0	0	114.8	R158 Y432	R158-D181 WeakPolarHBondContact CB-OD1 3.45Å; D181-Y432 VanDerWaalsContact O-CD1 3.27Å; D181-Y432 WeakPolarHBondContact O-CD1 3.42Å; D181-Y432 WeakPolarHBondContact O-CE1 3.5Å
182	Y	96.1	Very high	94.4	Very high	19 Å²	19	35.3 Å²	35.3	8%	0.075	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.4	19.5	177.8	-52.8	-68.1	0	0	0	114.5	R158 Q161 P163 Q164 Y180 R429 Y432	R158-Y182 HydrophobicContact CB-CD2 4.01Å; R158-Y182 HydrophobicContact CB-CE2 4.45Å; Q161-Y182 HydrophobicContact CB-CE2 4.26Å; Q161-Y182 HydrophobicContact CG-CE2 4.18Å; P163-Y182 WeakPolarHBondContact CA-O 3.11Å; Q164-Y182 PolarHBondContact N-O 3.33Å; Y180-Y182 VanDerWaalsContact C-N 3.3Å; Y180-Y182 PolarHBondContact O-N 3.01Å; Y182-R429 HydrophobicContact CE1-CB 3.76Å; Y182-R429 HydrophobicContact CE1-CG 3.98Å; Y182-R429 PolarHBondContact OH-NE 2.89Å; Y182-Y432 HydrophobicContact CD1-CD1 4.24Å; Y182-Y432 HydrophobicContact CD1-CG 4.08Å
183	F	97.7	Very high	94.5	Very high	1 Å²	1	33.4 Å²	33.4	0%	0.004	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	127	-179.9	-179.5	-90.2	0	0	0	111.4	A154 Q164 L174 K177 Y180 R185 Y432	A154-F183 HydrophobicContact CB-CD2 4.37Å; Q164-F183 HydrophobicContact CB-CD2 4.32Å; Q164-F183 HydrophobicContact CG-CD2 4.15Å; Q164-F183 HydrophobicContact CG-CE2 4.37Å; L174-F183 HydrophobicContact CB-CD1 3.85Å; L174-F183 HydrophobicContact CB-CE1 3.58Å; L174-F183 HydrophobicContact CB-CZ 4.17Å; L174-F183 HydrophobicContact CD1-CE1 4.01Å; L174-F183 HydrophobicContact CD1-CE2 4.32Å; L174-F183 HydrophobicContact CD1-CZ 3.72Å; L174-F183 HydrophobicContact CD2-CD1 4.21Å; L174-F183 HydrophobicContact CD2-CD2 4.18Å; L174-F183 HydrophobicContact CD2-CE1 4.17Å; L174-F183 HydrophobicContact CD2-CE2 4.12Å; L174-F183 HydrophobicContact CD2-CG 4.22Å; L174-F183 HydrophobicContact CD2-CZ 4.12Å; L174-F183 HydrophobicContact CG-CE1 4.12Å; L174-F183 HydrophobicContact CG-CZ 4.22Å; K177-F183 PolarHBondContact NZ-O 2.91Å; Y180-F183 PolarHBondContact O-N 2.65Å; F183-R185 HydrophobicContact CE1-CB 4.05Å; F183-R185 HydrophobicContact CE1-CG 4.03Å; F183-R185 HydrophobicContact CZ-CB 4.2Å; F183-Y432 PolarHBondContact O-OH 3.26Å
184	A	97.7	Very high	94.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	168.2	167.7	0	0	0	0	0	110.2	Q164 I165 S166 Y432 I436 F456 G460	Q164-A184 PolarHBondContact O-N 3.37Å; I165-A184 CarbonylContact C-O 3.5Å; I165-A184 VanDerWaalsContact CA-O 3.26Å; I165-A184 WeakPolarHBondContact CA-O 3.49Å; I165-A184 HydrophobicContact CG1-CB 4.38Å; S166-A184 PolarHBondContact N-O 3.29Å; A184-Y432 HydrophobicContact CB-CE2 3.97Å; A184-I436 HydrophobicContact CB-CG2 4.18Å; A184-F456 HydrophobicContact CB-CE1 4.48Å; A184-G460 CarbonylContact C-O 3.59Å; A184-G460 VanDerWaalsContact CA-O 3.26Å; A184-G460 WeakPolarHBondContact CA-O 3.49Å; A184-G460 WeakPolarHBondContact CB-O 3.26Å
185	R	97.2	Very high	94.8	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	145.1	176.3	55.1	173.5	177	-155.7	-10.8	112.7	S166 S169 T170 S171 S175 F183 V187 F456 G460 D461 G462	S166-R185 WeakPolarHBondContact O-CA 3.36Å; S166-R185 VanDerWaalsContact O-CB 3.24Å; S166-R185 WeakPolarHBondContact O-CB 3.37Å; S169-R185 WeakPolarHBondContact O-CD 3.46Å; S169-R185 PolarHBondContact O-NH1 3.44Å; T170-R185 VanDerWaalsContact CA-NH1 3.31Å; T170-R185 PolarHBondContact O-NH1 3.03Å; T170-R185 VanDerWaalsContact O-NH1 3.08Å; S171-R185 PolarHBondContact O-NH1 3.33Å; S175-R185 PolarHBondContact OG-NH2 3.11Å; F183-R185 HydrophobicContact CE1-CB 4.05Å; F183-R185 HydrophobicContact CE1-CG 4.03Å; F183-R185 HydrophobicContact CZ-CB 4.2Å; R185-V187 HydrophobicContact CB-CG2 4.29Å; R185-V187 WeakPolarHBondContact CD-O 3.18Å; R185-V187 VanDerWaalsContact CG-O 3.27Å; R185-V187 WeakPolarHBondContact CG-O 3.27Å; R185-V187 PolarHBondContact NE-O 3.36Å; R185-V187 PolarHBondContact O-N 3.34Å; R185-F456 WeakPolarHBondContact O-CD1 3.34Å; R185-F456 WeakPolarHBondContact O-CE1 3.38Å; R185-G460 PolarHBondContact N-O 3.44Å; R185-D461 IonicContact CZ-OD1 3.75Å; R185-D461 IonicContact NE-OD1 3.81Å; R185-D461 PolarHBondContact NE-OD1 3.27Å; R185-D461 VanDerWaalsContact NH2-CG 3.3Å; R185-D461 IonicContact NH2-OD1 2.92Å; R185-D461 PolarHBondContact NH2-OD1 3.04Å; R185-D461 IonicContact NH2-OD2 3.59Å; R185-D461 PolarHBondContact NH2-OD2 3.38Å; R185-G462 PolarHBondContact O-N 2.92Å
186	T	95.9	Very high	94.8	Very high	12 Å²	12	31.3 Å²	31.3	7%	0.074	15%	0.148	C	C	.	.	S	Bend	trans	-82	-6.1	177.6	52.8	0	0	0	0	113.4	I165 S166 F393 N396 A397 F456	I165-T186 HydrophobicContact CG2-CG2 4.15Å; S166-T186 PolarHBondContact O-N 3.12Å; S166-T186 VanDerWaalsContact O-N 3.08Å; T186-F393 WeakPolarHBondContact O-CD1 3.49Å; T186-F393 PolarHBondContact OG1-O 3.02Å; T186-N396 HydrophobicContact CG2-CB 4.21Å; T186-A397 HydrophobicContact CG2-CB 3.85Å; T186-F456 HydrophobicContact CG2-CE1 4.12Å; T186-F456 HydrophobicContact CG2-CZ 4.26Å
187	V	95.1	Very high	94.9	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	13%	0.132	C	C	.	.	S	Bend	trans	-106.3	151.2	177.9	-60.9	0	0	0	0	110.5	Y167 T170 R185 L321 F393 G462	Y167-V187 WeakPolarHBondContact O-CG1 3.48Å; T170-V187 HydrophobicContact CG2-CB 4.19Å; T170-V187 HydrophobicContact CG2-CG2 3.69Å; R185-V187 HydrophobicContact CB-CG2 4.29Å; R185-V187 WeakPolarHBondContact CD-O 3.18Å; R185-V187 VanDerWaalsContact CG-O 3.27Å; R185-V187 WeakPolarHBondContact CG-O 3.27Å; R185-V187 PolarHBondContact NE-O 3.36Å; R185-V187 PolarHBondContact O-N 3.34Å; V187-L321 HydrophobicContact CB-CD1 3.94Å; V187-L321 HydrophobicContact CG1-CD1 3.54Å; V187-F393 HydrophobicContact CG1-CB 4.03Å; V187-F393 HydrophobicContact CG1-CD1 3.79Å; V187-F393 HydrophobicContact CG1-CD2 3.97Å; V187-F393 HydrophobicContact CG1-CE1 4.26Å; V187-F393 HydrophobicContact CG1-CE2 4.45Å; V187-F393 HydrophobicContact CG1-CG 3.65Å; V187-G462 PolarHBondContact O-N 3.32Å
188	P	94.9	Very high	95.1	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.013	12%	0.123	C	C	.	.			trans	-73.5	159.6	176.4	30.2	-37.4	0	0	0	113.8	Y192 L321 G462 Y466	P188-Y192 HydrophobicContact CB-CD2 4.06Å; P188-L321 HydrophobicContact CG-CD2 3.58Å; P188-G462 WeakPolarHBondContact CA-O 3.36Å; P188-Y466 HydrophobicContact CG-CE1 4.48Å; P188-Y466 HydrophobicContact CG-CE2 4.36Å; P188-Y466 WeakPolarHBondContact CG-OH 3.48Å
189	P	94.6	Very high	95.3	Very high	10 Å²	10	22.3 Å²	22.3	7%	0.065	10%	0.097	C	C	.	.			trans	-65.3	149.8	168.3	16.1	-23.9	0	0	0	113.8	T170 F191 Y192 Y466	T170-P189 CarbonylContact O-C 3.57Å; T170-P189 VanDerWaalsContact O-CA 3.29Å; T170-P189 WeakPolarHBondContact O-CA 3.36Å; P189-F191 PolarHBondContact O-N 2.93Å; P189-Y192 HydrophobicContact CG-CD2 3.71Å; P189-Y192 HydrophobicContact CG-CE2 3.69Å; P189-Y192 PolarHBondContact O-N 3.39Å; P189-Y192 VanDerWaalsContact O-N 3.14Å; P189-Y466 PolarHBondContact O-OH 3.09Å
190	D	92.6	Very high	95.4	Very high	1 Å²	1	17 Å²	17	1%	0.005	8%	0.077	C	C	.	.	H	α-helix	trans	-59.1	-18.4	176	-66.5	-32	0	0	0	113.7	T170 S171 Y192 Q193 A194 Y218	T170-D190 WeakPolarHBondContact CB-OD1 3.47Å; T170-D190 PolarHBondContact O-N 3.26Å; T170-D190 VanDerWaalsContact OG1-CG 3.28Å; T170-D190 PolarHBondContact OG1-OD1 2.92Å; T170-D190 PolarHBondContact OG1-OD2 3.45Å; S171-D190 VanDerWaalsContact CA-OD2 3.3Å; S171-D190 WeakPolarHBondContact CA-OD2 3.47Å; S171-D190 PolarHBondContact N-OD2 2.9Å; D190-Y192 VanDerWaalsContact C-N 3.25Å; D190-Y192 PolarHBondContact O-N 3.01Å; D190-Q193 WeakPolarHBondContact O-CB 3.45Å; D190-Q193 PolarHBondContact O-N 2.96Å; D190-Q193 VanDerWaalsContact O-N 3.08Å; D190-Q193 PolarHBondContact OD1-OE1 3.27Å; D190-A194 WeakPolarHBondContact O-CB 3.47Å; D190-A194 PolarHBondContact O-N 3.34Å; D190-Y218 VanDerWaalsContact OD2-CD2 3.28Å; D190-Y218 WeakPolarHBondContact OD2-CD2 3.33Å
191	F	91.8	Very high	95.5	Very high	80 Å²	80	16.7 Å²	16.7	35%	0.351	8%	0.076	S	C	.	.	H	α-helix	trans	-56.6	-40.1	173.8	176	-102.1	0	0	0	112	P189 Q193 A194 K195 A225 E229	P189-F191 PolarHBondContact O-N 2.93Å; F191-Q193 VanDerWaalsContact C-N 3.34Å; F191-A194 PolarHBondContact O-N 2.87Å; F191-K195 WeakPolarHBondContact O-CB 3.44Å; F191-K195 PolarHBondContact O-N 3.07Å; F191-A225 HydrophobicContact CD2-CB 4.47Å; F191-E229 HydrophobicContact CE2-CG 4.41Å; F191-E229 VanDerWaalsContact CE2-OE1 3.26Å; F191-E229 WeakPolarHBondContact CE2-OE1 3.44Å; F191-E229 VanDerWaalsContact CZ-OE1 3.27Å; F191-E229 WeakPolarHBondContact CZ-OE1 3.49Å
192	Y	93.6	Very high	95.6	Very high	82 Å²	82	20.6 Å²	20.6	32%	0.322	9%	0.087	S	C	.	.	H	α-helix	trans	-69.4	-34.8	176.7	-66.1	-60.7	0	0	0	112.1	P188 P189 D190 K195 A196 W486	P188-Y192 HydrophobicContact CB-CD2 4.06Å; P189-Y192 HydrophobicContact CG-CD2 3.71Å; P189-Y192 HydrophobicContact CG-CE2 3.69Å; P189-Y192 PolarHBondContact O-N 3.39Å; P189-Y192 VanDerWaalsContact O-N 3.14Å; D190-Y192 VanDerWaalsContact C-N 3.25Å; D190-Y192 PolarHBondContact O-N 3.01Å; Y192-K195 PolarHBondContact O-N 2.71Å; Y192-A196 WeakPolarHBondContact O-CB 3.34Å; Y192-A196 PolarHBondContact O-N 3.48Å; Y192-W486 AromaticContact CD1-CH2 3.77Å; Y192-W486 HydrophobicContact CD1-CH2 3.77Å; Y192-W486 HydrophobicContact CD1-CZ3 4.25Å; Y192-W486 HydrophobicContact CG-CH2 4.28Å; Y192-W486 HydrophobicContact CG-CZ3 4.37Å
193	Q	94.2	Very high	95.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-67	-45.7	175.2	-170.3	177.9	54	0	0	111.7	D190 F191 K195 A196 M197 F271 D297 L319 Y466	D190-Q193 WeakPolarHBondContact O-CB 3.45Å; D190-Q193 PolarHBondContact O-N 2.96Å; D190-Q193 VanDerWaalsContact O-N 3.08Å; D190-Q193 PolarHBondContact OD1-OE1 3.27Å; F191-Q193 VanDerWaalsContact C-N 3.34Å; Q193-K195 VanDerWaalsContact C-N 3.3Å; Q193-K195 PolarHBondContact O-N 3.45Å; Q193-A196 PolarHBondContact O-N 3.38Å; Q193-M197 HydrophobicContact CG-SD 4.12Å; Q193-M197 VanDerWaalsContact O-CG 3.26Å; Q193-M197 WeakPolarHBondContact O-CG 3.3Å; Q193-M197 PolarHBondContact O-N 3.08Å; Q193-F271 HydrophobicContact CG-CE1 4.46Å; Q193-F271 HydrophobicContact CG-CZ 4.37Å; Q193-F271 VanDerWaalsContact OE1-CE1 3.24Å; Q193-D297 PolarHBondContact NE2-OD1 2.97Å; Q193-L319 HydrophobicContact CG-CD2 4.06Å; Q193-Y466 HydrophobicContact CB-CE1 4.06Å; Q193-Y466 HydrophobicContact CB-CE2 4.42Å; Q193-Y466 HydrophobicContact CG-CE1 4.2Å
194	A	95.9	Very high	95.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-56.2	-44.8	174.1	0	0	0	0	0	111.7	D190 F191 M197 A198 A225 F226 F271	D190-A194 WeakPolarHBondContact O-CB 3.47Å; D190-A194 PolarHBondContact O-N 3.34Å; F191-A194 PolarHBondContact O-N 2.87Å; A194-M197 PolarHBondContact O-N 3.13Å; A194-A198 WeakPolarHBondContact O-CB 3.29Å; A194-A198 PolarHBondContact O-N 2.86Å; A194-A225 HydrophobicContact CB-CB 3.82Å; A194-F226 HydrophobicContact CB-CB 3.94Å; A194-F271 HydrophobicContact CB-CZ 4.25Å
195	K	95.5	Very high	95.1	Very high	58 Å²	58	30 Å²	30	25%	0.252	13%	0.133	S	C	.	.	H	α-helix	trans	-61.4	-47.7	174.8	-175.8	176.9	175.3	-166.6	0	112.1	F191 Y192 Q193 M197 A198 E199 E229 W486	F191-K195 WeakPolarHBondContact O-CB 3.44Å; F191-K195 PolarHBondContact O-N 3.07Å; Y192-K195 PolarHBondContact O-N 2.71Å; Q193-K195 VanDerWaalsContact C-N 3.3Å; Q193-K195 PolarHBondContact O-N 3.45Å; K195-M197 PolarHBondContact O-N 3.08Å; K195-A198 PolarHBondContact O-N 3.46Å; K195-E199 WeakPolarHBondContact CE-OE1 3.41Å; K195-E199 WeakPolarHBondContact O-CG 3.36Å; K195-E199 PolarHBondContact O-N 3.11Å; K195-E229 HydrophobicContact CB-CG 4.26Å; K195-W486 HydrophobicContact CB-CZ2 4.47Å; K195-W486 HydrophobicContact CD-CZ2 3.94Å; K195-W486 HydrophobicContact CG-CZ2 4.15Å
196	A	96.2	Very high	95	Very high	0 Å²	0	30 Å²	30	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.6	-44.9	177.7	0	0	0	0	0	111.8	Y192 Q193 A198 E199 I200 L319 W486	Y192-A196 WeakPolarHBondContact O-CB 3.34Å; Y192-A196 PolarHBondContact O-N 3.48Å; Q193-A196 PolarHBondContact O-N 3.38Å; A196-A198 PolarHBondContact O-N 3.16Å; A196-E199 PolarHBondContact O-N 2.86Å; A196-I200 VanDerWaalsContact O-CG1 3.3Å; A196-I200 WeakPolarHBondContact O-CG1 3.36Å; A196-I200 PolarHBondContact O-N 3.43Å; A196-L319 HydrophobicContact CB-CD2 3.63Å; A196-W486 HydrophobicContact CB-CB 4.11Å; A196-W486 HydrophobicContact CB-CD2 3.7Å; A196-W486 HydrophobicContact CB-CE3 4.41Å; A196-W486 HydrophobicContact CB-CG 3.52Å
197	M	97.1	Very high	94.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-61.8	-44.3	176.9	-68.1	173.3	83.7	0	0	111.9	Q193 A194 K195 E199 I200 L201 F226 V269 F271 V294 L319	Q193-M197 HydrophobicContact CG-SD 4.12Å; Q193-M197 VanDerWaalsContact O-CG 3.26Å; Q193-M197 WeakPolarHBondContact O-CG 3.3Å; Q193-M197 PolarHBondContact O-N 3.08Å; A194-M197 PolarHBondContact O-N 3.13Å; K195-M197 PolarHBondContact O-N 3.08Å; M197-E199 VanDerWaalsContact C-N 3.31Å; M197-E199 PolarHBondContact O-N 3.29Å; M197-I200 WeakPolarHBondContact O-CB 3.46Å; M197-I200 PolarHBondContact O-N 2.84Å; M197-L201 WeakPolarHBondContact O-CG 3.45Å; M197-L201 PolarHBondContact O-N 2.97Å; M197-L201 VanDerWaalsContact O-N 3.08Å; M197-F226 HydrophobicContact CB-CD2 4.05Å; M197-F226 HydrophobicContact CB-CE2 4.21Å; M197-V269 HydrophobicContact CE-CG1 3.61Å; M197-F271 HydrophobicContact CE-CD2 4.43Å; M197-F271 HydrophobicContact CE-CE2 4Å; M197-F271 HydrophobicContact SD-CD2 4.28Å; M197-F271 HydrophobicContact SD-CE1 4.5Å; M197-F271 HydrophobicContact SD-CE2 3.38Å; M197-F271 WeakPolarHBondContact SD-CE2 3.35Å; M197-F271 HydrophobicContact SD-CZ 3.53Å; M197-F271 VanDerWaalsContact SD-CZ 3.53Å; M197-V294 HydrophobicContact CE-CG1 3.89Å; M197-V294 WeakPolarHBondContact CE-O 3.38Å; M197-V294 HydrophobicContact CG-CG1 4.43Å; M197-L319 HydrophobicContact CG-CD1 3.63Å; M197-L319 HydrophobicContact CG-CD2 3.82Å; M197-L319 HydrophobicContact CG-CG 4.39Å
198	A	96.7	Very high	94.8	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64.2	-34.6	176.8	0	0	0	0	0	112.8	A194 K195 A196 L201 R202 F226 E229	A194-A198 WeakPolarHBondContact O-CB 3.29Å; A194-A198 PolarHBondContact O-N 2.86Å; K195-A198 PolarHBondContact O-N 3.46Å; A196-A198 PolarHBondContact O-N 3.16Å; A198-L201 PolarHBondContact O-N 2.9Å; A198-R202 WeakPolarHBondContact O-CB 3.39Å; A198-R202 PolarHBondContact O-N 3.49Å; A198-F226 HydrophobicContact CB-CD2 4.44Å; A198-F226 HydrophobicContact CB-CE2 4.23Å; A198-E229 HydrophobicContact CB-CB 3.8Å
199	E	96.2	Very high	94.9	Very high	36 Å²	36	31.8 Å²	31.8	17%	0.168	14%	0.143	C	C	.	.	H	α-helix	trans	-68.7	-37.6	173.8	-74	174.8	-172.2	0	0	112.4	K195 A196 M197 R202 F203 R233 W486 L490	K195-E199 WeakPolarHBondContact CE-OE1 3.41Å; K195-E199 WeakPolarHBondContact O-CG 3.36Å; K195-E199 PolarHBondContact O-N 3.11Å; A196-E199 PolarHBondContact O-N 2.86Å; M197-E199 VanDerWaalsContact C-N 3.31Å; M197-E199 PolarHBondContact O-N 3.29Å; E199-R202 PolarHBondContact O-N 3.2Å; E199-F203 WeakPolarHBondContact O-CB 3.43Å; E199-F203 PolarHBondContact O-N 3.49Å; E199-R233 IonicContact OE1-NH2 2.98Å; E199-R233 PolarHBondContact OE1-NH2 3.2Å; E199-W486 PolarHBondContact OE2-NE1 3.44Å; E199-L490 HydrophobicContact CB-CB 4.22Å; E199-L490 HydrophobicContact CB-CD2 3.98Å
200	I	96.3	Very high	95	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.4	-47.5	173.3	-67.5	165.2	0	0	0	110.2	A196 M197 R202 F203 F204 I317 L319 I468 L490 L492	A196-I200 VanDerWaalsContact O-CG1 3.3Å; A196-I200 WeakPolarHBondContact O-CG1 3.36Å; A196-I200 PolarHBondContact O-N 3.43Å; M197-I200 WeakPolarHBondContact O-CB 3.46Å; M197-I200 PolarHBondContact O-N 2.84Å; I200-R202 VanDerWaalsContact C-N 3.29Å; I200-R202 PolarHBondContact O-N 3Å; I200-F203 WeakPolarHBondContact O-CB 3.45Å; I200-F203 PolarHBondContact O-N 3.49Å; I200-F204 HydrophobicContact CG2-CD2 4.07Å; I200-F204 HydrophobicContact CG2-CE2 3.92Å; I200-F204 VanDerWaalsContact O-CD2 3.28Å; I200-F204 WeakPolarHBondContact O-CD2 3.4Å; I200-F204 PolarHBondContact O-N 3.48Å; I200-I317 HydrophobicContact CD1-CG2 4.33Å; I200-I317 HydrophobicContact CG2-CD1 4.27Å; I200-I317 HydrophobicContact CG2-CG2 4.32Å; I200-L319 HydrophobicContact CD1-CD1 3.76Å; I200-L319 HydrophobicContact CD1-CD2 4.49Å; I200-L319 HydrophobicContact CD1-CG 4.31Å; I200-I468 HydrophobicContact CD1-CD1 3.97Å; I200-I468 HydrophobicContact CD1-CG1 4.44Å; I200-I468 HydrophobicContact CD1-CG2 4.27Å; I200-I468 HydrophobicContact CG1-CD1 4.29Å; I200-L490 HydrophobicContact CG1-CD1 3.8Å; I200-L490 HydrophobicContact CG1-CD2 4.08Å; I200-L492 HydrophobicContact CG1-CD1 4.27Å
201	L	96.6	Very high	95.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.9	-40.5	177.6	-60.6	-172.7	0	0	0	111.9	M197 A198 F204 N205 W206 V209 F226 I235 V267 V269 V294	M197-L201 WeakPolarHBondContact O-CG 3.45Å; M197-L201 PolarHBondContact O-N 2.97Å; M197-L201 VanDerWaalsContact O-N 3.08Å; A198-L201 PolarHBondContact O-N 2.9Å; L201-F204 PolarHBondContact O-N 2.95Å; L201-N205 PolarHBondContact O-N 2.92Å; L201-W206 HydrophobicContact CB-CB 4.48Å; L201-W206 HydrophobicContact CD2-CE3 3.5Å; L201-W206 HydrophobicContact CD2-CZ3 4.05Å; L201-W206 PolarHBondContact O-N 3.17Å; L201-V209 HydrophobicContact CD1-CG1 3.92Å; L201-V209 HydrophobicContact CD1-CG2 4.06Å; L201-V209 HydrophobicContact CD2-CG1 4.36Å; L201-F226 HydrophobicContact CD1-CE2 3.77Å; L201-F226 HydrophobicContact CD1-CZ 3.47Å; L201-F226 VanDerWaalsContact CD1-CZ 3.47Å; L201-I235 HydrophobicContact CB-CD1 3.73Å; L201-I235 HydrophobicContact CD1-CD1 4.3Å; L201-I235 HydrophobicContact CD1-CG2 4.17Å; L201-V267 HydrophobicContact CD2-CG1 3.96Å; L201-V269 HydrophobicContact CD1-CG2 4.02Å; L201-V269 HydrophobicContact CD2-CG2 4.38Å; L201-V294 HydrophobicContact CD2-CG2 3.99Å
202	R	95	Very high	95.4	Very high	131 Å²	131	27.5 Å²	27.5	49%	0.494	12%	0.123	S	C	.	.	H	α-helix	trans	-64.4	-39.1	176.7	-179.3	59	179.9	169.9	4.5	112.1	A198 E199 I200 F204 N205	A198-R202 WeakPolarHBondContact O-CB 3.39Å; A198-R202 PolarHBondContact O-N 3.49Å; E199-R202 PolarHBondContact O-N 3.2Å; I200-R202 VanDerWaalsContact C-N 3.29Å; I200-R202 PolarHBondContact O-N 3Å; R202-F204 VanDerWaalsContact C-N 3.29Å; R202-F204 PolarHBondContact O-N 3.47Å; R202-N205 PolarHBondContact O-N 3.15Å; R202-N205 VanDerWaalsContact O-N 3.16Å
203	F	94.9	Very high	95.4	Very high	96 Å²	96	23.7 Å²	23.7	42%	0.421	11%	0.109	S	C	.	.	H	α-helix	trans	-59.4	-39.9	177.6	-178.5	-91.6	0	0	0	112	E199 I200 N205 L490 L492 N494	E199-F203 WeakPolarHBondContact O-CB 3.43Å; E199-F203 PolarHBondContact O-N 3.49Å; I200-F203 WeakPolarHBondContact O-CB 3.45Å; I200-F203 PolarHBondContact O-N 3.49Å; F203-N205 VanDerWaalsContact C-N 3.34Å; F203-L490 HydrophobicContact CB-CD2 4.07Å; F203-L492 HydrophobicContact CB-CD1 4.48Å; F203-L492 HydrophobicContact CD1-CD1 3.91Å; F203-L492 HydrophobicContact CE1-CB 4.31Å; F203-L492 HydrophobicContact CE1-CD1 4.32Å; F203-L492 HydrophobicContact CG-CD1 4.14Å; F203-L492 HydrophobicContact CZ-CB 4.26Å; F203-N494 HydrophobicContact CE1-CB 4.45Å
204	F	93.6	Very high	95.2	Very high	10 Å²	10	23.7 Å²	23.7	4%	0.044	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	5.6	177.7	-65.6	-64.2	0	0	0	114.8	I200 L201 R202 W206 I317 L492 I497 W499 L504	I200-F204 HydrophobicContact CG2-CD2 4.07Å; I200-F204 HydrophobicContact CG2-CE2 3.92Å; I200-F204 VanDerWaalsContact O-CD2 3.28Å; I200-F204 WeakPolarHBondContact O-CD2 3.4Å; I200-F204 PolarHBondContact O-N 3.48Å; L201-F204 PolarHBondContact O-N 2.95Å; R202-F204 VanDerWaalsContact C-N 3.29Å; R202-F204 PolarHBondContact O-N 3.47Å; F204-W206 HydrophobicContact CB-CD2 3.6Å; F204-W206 HydrophobicContact CB-CE3 3.92Å; F204-W206 HydrophobicContact CB-CG 4.07Å; F204-W206 HydrophobicContact CB-CH2 4.28Å; F204-W206 HydrophobicContact CB-CZ2 3.95Å; F204-W206 HydrophobicContact CB-CZ3 4.26Å; F204-W206 HydrophobicContact CD2-CE3 4.15Å; F204-W206 AromaticContact CD2-CH2 3.84Å; F204-W206 HydrophobicContact CD2-CH2 3.84Å; F204-W206 HydrophobicContact CD2-CZ2 4.28Å; F204-W206 AromaticContact CD2-CZ3 3.76Å; F204-W206 HydrophobicContact CD2-CZ3 3.76Å; F204-W206 HydrophobicContact CE2-CH2 4.48Å; F204-W206 HydrophobicContact CG-CD2 4.44Å; F204-W206 HydrophobicContact CG-CE3 4.42Å; F204-W206 HydrophobicContact CG-CH2 4.13Å; F204-W206 HydrophobicContact CG-CZ2 4.09Å; F204-W206 HydrophobicContact CG-CZ3 4.28Å; F204-W206 PolarHBondContact O-N 3.34Å; F204-I317 HydrophobicContact CD2-CD1 4.4Å; F204-I317 HydrophobicContact CE2-CD1 3.61Å; F204-I317 HydrophobicContact CZ-CD1 4.18Å; F204-L492 HydrophobicContact CE2-CD1 4.21Å; F204-L492 HydrophobicContact CZ-CD1 4.4Å; F204-I497 HydrophobicContact CE1-CD1 4.44Å; F204-I497 HydrophobicContact CZ-CD1 3.67Å; F204-W499 HydrophobicContact CD1-CZ2 4.15Å; F204-W499 HydrophobicContact CE1-CH2 4.45Å; F204-W499 AromaticContact CE1-CZ2 3.75Å; F204-W499 HydrophobicContact CE1-CZ2 3.75Å; F204-W499 HydrophobicContact CZ-CH2 4.34Å; F204-W499 AromaticContact CZ-CZ2 3.98Å; F204-W499 HydrophobicContact CZ-CZ2 3.98Å; F204-L504 HydrophobicContact CB-CD1 4.31Å; F204-L504 HydrophobicContact CD1-CD1 3.53Å; F204-L504 HydrophobicContact CD1-CD2 4.22Å; F204-L504 HydrophobicContact CE1-CD1 4.17Å; F204-L504 HydrophobicContact CG-CD1 4.13Å
205	N	93.4	Very high	94.8	Very high	111 Å²	111	28.3 Å²	28.3	59%	0.594	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.2	32.9	-174.3	-62.8	-47.5	0	0	0	114	L201 R202 F203	L201-N205 PolarHBondContact O-N 2.92Å; R202-N205 PolarHBondContact O-N 3.15Å; R202-N205 VanDerWaalsContact O-N 3.16Å; F203-N205 VanDerWaalsContact C-N 3.34Å
206	W	94.8	Very high	94.2	Very high	2 Å²	2	27 Å²	27	1%	0.008	13%	0.133	C	C	.	.			trans	-82.2	117.5	173.3	-63.1	-28.2	0	0	0	110.1	L201 F204 V209 V267 I292 V294 I317 W499 L504 P505	L201-W206 HydrophobicContact CB-CB 4.48Å; L201-W206 HydrophobicContact CD2-CE3 3.5Å; L201-W206 HydrophobicContact CD2-CZ3 4.05Å; L201-W206 PolarHBondContact O-N 3.17Å; F204-W206 HydrophobicContact CB-CD2 3.6Å; F204-W206 HydrophobicContact CB-CE3 3.92Å; F204-W206 HydrophobicContact CB-CG 4.07Å; F204-W206 HydrophobicContact CB-CH2 4.28Å; F204-W206 HydrophobicContact CB-CZ2 3.95Å; F204-W206 HydrophobicContact CB-CZ3 4.26Å; F204-W206 HydrophobicContact CD2-CE3 4.15Å; F204-W206 AromaticContact CD2-CH2 3.84Å; F204-W206 HydrophobicContact CD2-CH2 3.84Å; F204-W206 HydrophobicContact CD2-CZ2 4.28Å; F204-W206 AromaticContact CD2-CZ3 3.76Å; F204-W206 HydrophobicContact CD2-CZ3 3.76Å; F204-W206 HydrophobicContact CE2-CH2 4.48Å; F204-W206 HydrophobicContact CG-CD2 4.44Å; F204-W206 HydrophobicContact CG-CE3 4.42Å; F204-W206 HydrophobicContact CG-CH2 4.13Å; F204-W206 HydrophobicContact CG-CZ2 4.09Å; F204-W206 HydrophobicContact CG-CZ3 4.28Å; F204-W206 PolarHBondContact O-N 3.34Å; W206-V209 HydrophobicContact CB-CG1 4.42Å; W206-V267 HydrophobicContact CD2-CG2 3.6Å; W206-V267 HydrophobicContact CE3-CB 4.5Å; W206-V267 HydrophobicContact CE3-CG1 4.03Å; W206-V267 HydrophobicContact CE3-CG2 3.8Å; W206-V267 HydrophobicContact CG-CG2 4.04Å; W206-V267 HydrophobicContact CH2-CG2 4.19Å; W206-V267 HydrophobicContact CZ2-CG2 4.05Å; W206-V267 HydrophobicContact CZ3-CG1 4.15Å; W206-V267 HydrophobicContact CZ3-CG2 4.08Å; W206-I292 HydrophobicContact CH2-CG2 3.81Å; W206-I292 HydrophobicContact CZ2-CG2 4.4Å; W206-I292 HydrophobicContact CZ3-CG2 4.47Å; W206-V294 HydrophobicContact CZ3-CG2 4.02Å; W206-I317 HydrophobicContact CH2-CD1 4.39Å; W206-W499 AromaticContact CH2-CH2 3.6Å; W206-W499 HydrophobicContact CH2-CH2 3.6Å; W206-W499 HydrophobicContact CH2-CZ3 4.07Å; W206-W499 AromaticContact CZ2-CH2 3.81Å; W206-W499 HydrophobicContact CZ2-CH2 3.81Å; W206-W499 HydrophobicContact CZ2-CZ2 4.42Å; W206-W499 HydrophobicContact CZ2-CZ3 4.23Å; W206-L504 HydrophobicContact CZ2-CD1 3.91Å; W206-P505 HydrophobicContact CZ2-CG 4.35Å; W206-P505 PolarHBondContact NE1-O 3.31Å
207	T	92.8	Very high	93.8	Very high	38 Å²	38	28.8 Å²	28.8	23%	0.233	14%	0.143	C	C	.	.			trans	-113.8	-9	-172.3	56.9	0	0	0	0	113.5	C236 S507 Q508	T207-C236 PolarHBondContact O-N 3.39Å; T207-S507 PolarHBondContact N-O 2.97Å; T207-Q508 WeakPolarHBondContact OG1-CB 3.49Å
208	Y	94.3	Very high	93.4	Very high	13 Å²	13	30 Å²	30	5%	0.051	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	108.9	-180	-169.1	-115.9	0	0	0	110.3	C236 A238 N264 A265 S507 C509	Y208-C236 HydrophobicContact CD2-CB 3.78Å; Y208-C236 HydrophobicContact CE2-CB 4.4Å; Y208-A238 HydrophobicContact CD1-CB 4.07Å; Y208-A238 HydrophobicContact CD2-CB 4.25Å; Y208-A238 HydrophobicContact CE1-CB 3.44Å; Y208-A238 VanDerWaalsContact CE1-CB 3.44Å; Y208-A238 HydrophobicContact CE2-CB 3.65Å; Y208-A238 HydrophobicContact CG-CB 4.44Å; Y208-A238 WeakPolarHBondContact OH-CB 3.37Å; Y208-N264 HydrophobicContact CD1-CB 4.14Å; Y208-N264 HydrophobicContact CE1-CB 4.2Å; Y208-A265 HydrophobicContact CD1-CB 3.81Å; Y208-A265 HydrophobicContact CE1-CB 3.92Å; Y208-S507 PolarHBondContact N-O 2.01Å; Y208-S507 WeakPolarHBondContact O-CB 3.27Å; Y208-S507 PolarHBondContact O-OG 3.07Å; Y208-C509 HydrophobicContact CD1-CB 4.11Å; Y208-C509 HydrophobicContact CD2-CB 3.65Å; Y208-C509 HydrophobicContact CE1-CB 4.45Å; Y208-C509 HydrophobicContact CE2-CB 4.05Å; Y208-C509 HydrophobicContact CG-CB 3.68Å
209	V	96.3	Very high	93.2	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	157.3	-172.9	-57.2	0	0	0	0	111.4	L201 W206 F226 I235 C236 I237 A238 V267 V269	L201-V209 HydrophobicContact CD1-CG1 3.92Å; L201-V209 HydrophobicContact CD1-CG2 4.06Å; L201-V209 HydrophobicContact CD2-CG1 4.36Å; W206-V209 HydrophobicContact CB-CG1 4.42Å; V209-F226 HydrophobicContact CG2-CE1 4.48Å; V209-F226 HydrophobicContact CG2-CZ 4.36Å; V209-I235 HydrophobicContact CG1-CG2 4.45Å; V209-I235 HydrophobicContact CG2-CG2 4.1Å; V209-C236 PolarHBondContact N-O 3.13Å; V209-I237 CarbonylContact O-C 3.52Å; V209-I237 VanDerWaalsContact O-CA 3.28Å; V209-I237 WeakPolarHBondContact O-CA 3.42Å; V209-A238 PolarHBondContact O-N 3.5Å; V209-V267 HydrophobicContact CG1-CB 3.96Å; V209-V267 HydrophobicContact CG1-CG1 4.09Å; V209-V269 HydrophobicContact CB-CG2 4.42Å; V209-V269 HydrophobicContact CG2-CG2 4.17Å
210	S	96.4	Very high	92.9	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.007	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	154.9	169.2	-57.7	0	0	0	0	110.8	A265 V267 A268 V269	S210-A265 WeakPolarHBondContact OG-CB 3.07Å; S210-V267 PolarHBondContact N-O 3.03Å; S210-A268 CarbonylContact O-C 3.48Å; S210-A268 WeakPolarHBondContact O-CA 3.38Å; S210-V269 PolarHBondContact O-N 2.92Å
211	T	96.9	Very high	92.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	143.4	-179.2	51.2	0	0	0	0	111.2	I223 F226 I237 T239 S240 E241 V269	T211-I223 HydrophobicContact CG2-CD1 3.73Å; T211-I223 HydrophobicContact CG2-CG1 4.11Å; T211-F226 HydrophobicContact CG2-CD1 4Å; T211-F226 HydrophobicContact CG2-CE1 3.71Å; T211-I237 HydrophobicContact CG2-CG1 4.32Å; T211-I237 HydrophobicContact CG2-CG2 4.07Å; T211-T239 PolarHBondContact N-O 3.37Å; T211-T239 PolarHBondContact OG1-O 3.44Å; T211-S240 WeakPolarHBondContact OG1-CA 3.49Å; T211-S240 WeakPolarHBondContact OG1-CB 3.41Å; T211-S240 PolarHBondContact OG1-OG 3Å; T211-E241 PolarHBondContact O-N 3.2Å; T211-V269 CarbonylContact C-O 3.58Å; T211-V269 WeakPolarHBondContact CA-O 3.37Å; T211-V269 HydrophobicContact CG2-CB 4.15Å
212	V	95.9	Very high	92.6	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	130.2	172.4	-162.8	0	0	0	0	110.4	E241 V243 V255 L259 V269 L270 F271 L272 L280	V212-E241 VanDerWaalsContact CA-O 3.3Å; V212-E241 WeakPolarHBondContact CA-O 3.22Å; V212-E241 HydrophobicContact CG1-CB 4.47Å; V212-V243 HydrophobicContact CG1-CG1 3.94Å; V212-V243 HydrophobicContact CG1-CG2 4.32Å; V212-V255 HydrophobicContact CG1-CG1 4Å; V212-V255 HydrophobicContact CG2-CG1 4.28Å; V212-L259 HydrophobicContact CG2-CD1 3.92Å; V212-L259 HydrophobicContact CG2-CD2 4.14Å; V212-V269 PolarHBondContact N-O 2.89Å; V212-L270 HydrophobicContact CB-CD2 3.75Å; V212-L270 HydrophobicContact CG2-CD2 3.81Å; V212-F271 PolarHBondContact O-N 3.38Å; V212-L272 HydrophobicContact CB-CD2 4.43Å; V212-L272 HydrophobicContact CG1-CD2 4.05Å; V212-L280 HydrophobicContact CB-CD2 4.45Å; V212-L280 HydrophobicContact CG1-CD2 4.19Å; V212-L280 HydrophobicContact CG2-CD2 4.41Å
213	A	94.8	Very high	92.6	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.008	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	143	-179.2	0	0	0	0	0	112.9	G219 I223 E241 K242 V243 F271 L272	A213-G219 WeakPolarHBondContact CB-O 3.33Å; A213-I223 HydrophobicContact CB-CB 3.99Å; A213-I223 HydrophobicContact CB-CG2 3.72Å; A213-E241 PolarHBondContact N-O 2.89Å; A213-K242 CarbonylContact O-C 3.48Å; A213-K242 VanDerWaalsContact O-CA 3.29Å; A213-K242 WeakPolarHBondContact O-CA 3.31Å; A213-V243 PolarHBondContact O-N 3.4Å; A213-F271 WeakPolarHBondContact CA-O 3.45Å; A213-L272 VanDerWaalsContact C-CD2 3.45Å
214	S	90.4	Very high	92.5	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.007	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	140.1	169.5	-73.5	0	0	0	0	110.2	G216 G219 V243 F271 L272 R273 D276	S214-G216 PolarHBondContact O-N 2.9Å; S214-G219 WeakPolarHBondContact O-CA 3.4Å; S214-V243 CarbonylContact C-O 3.55Å; S214-V243 WeakPolarHBondContact CA-O 3.45Å; S214-F271 PolarHBondContact N-O 3.14Å; S214-L272 VanDerWaalsContact N-CD2 3.32Å; S214-L272 WeakPolarHBondContact OG-CA 3.34Å; S214-R273 PolarHBondContact OG-N 3.39Å; S214-D276 VanDerWaalsContact CB-OD2 3.31Å; S214-D276 WeakPolarHBondContact CB-OD2 3.48Å; S214-D276 WeakPolarHBondContact OG-CB 3.25Å; S214-D276 PolarHBondContact OG-OD2 3.28Å
215	E	86.7	Confident	92.6	Very high	96 Å²	96	27.2 Å²	27.2	45%	0.449	15%	0.145	S	C	.	.	S	Bend	trans	-57.3	131.8	168.4	-75.2	-179	168.7	0	0	111	V243 G244 R245	E215-V243 PolarHBondContact N-O 3.42Å; E215-G244 VanDerWaalsContact OE2-CA 3.26Å; E215-G244 WeakPolarHBondContact OE2-CA 3.35Å; E215-R245 PolarHBondContact OE2-N 2.87Å
216	G	83.9	Confident	92.8	Very high	30 Å²	30	22 Å²	22	31%	0.309	12%	0.117	S	C	.	.	S	Bend	trans	120.2	172.3	179.1	0	0	0	0	0	113.3	S214 Y218 G219 E220	S214-G216 PolarHBondContact O-N 2.9Å; G216-Y218 VanDerWaalsContact C-N 3.25Å; G216-Y218 PolarHBondContact O-N 2.89Å; G216-Y218 VanDerWaalsContact O-N 3.14Å; G216-G219 PolarHBondContact O-N 3.35Å; G216-E220 WeakPolarHBondContact O-CG 3.42Å; G216-E220 PolarHBondContact O-N 3.08Å; G216-E220 VanDerWaalsContact O-N 3.17Å
217	D	86.8	Confident	92.8	Very high	38 Å²	38	23.7 Å²	23.7	20%	0.203	13%	0.125	C	C	.	.	H	α-helix	trans	-62	-27	-169.4	-66.2	-71.1	0	0	0	114.7	I151 S171 K173 T221	I151-D217 HydrophobicContact CD1-CB 3.58Å; S171-D217 PolarHBondContact OG-O 3.41Å; K173-D217 HydrophobicContact CD-CB 4.49Å; K173-D217 WeakPolarHBondContact CD-OD1 3.47Å; K173-D217 IonicContact NZ-OD1 3.21Å; K173-D217 PolarHBondContact NZ-OD1 3.32Å; D217-T221 WeakPolarHBondContact O-CB 3.49Å; D217-T221 WeakPolarHBondContact O-CG2 3.37Å; D217-T221 PolarHBondContact O-N 3.5Å; D217-T221 PolarHBondContact O-OG1 3.25Å
218	Y	89.5	Confident	92.8	Very high	25 Å²	25	26.8 Å²	26.8	10%	0.098	14%	0.137	C	C	.	.	H	α-helix	trans	-70.8	-61.4	176.7	170.6	-105.2	0	0	0	111.7	T170 D190 G216 E220 G222 R273 S296 D297 G298	T170-Y218 WeakPolarHBondContact OG1-CE2 3.5Å; D190-Y218 VanDerWaalsContact OD2-CD2 3.28Å; D190-Y218 WeakPolarHBondContact OD2-CD2 3.33Å; G216-Y218 VanDerWaalsContact C-N 3.25Å; G216-Y218 PolarHBondContact O-N 2.89Å; G216-Y218 VanDerWaalsContact O-N 3.14Å; Y218-E220 PolarHBondContact O-N 3.46Å; Y218-G222 PolarHBondContact O-N 2.9Å; Y218-R273 HydrophobicContact CD1-CG 4.3Å; Y218-S296 VanDerWaalsContact OH-CB 3.25Å; Y218-S296 WeakPolarHBondContact OH-CB 3.45Å; Y218-S296 PolarHBondContact OH-OG 2.96Å; Y218-D297 PolarHBondContact OH-OD1 3.06Å; Y218-G298 PolarHBondContact OH-N 3.47Å
219	G	91.3	Very high	92.8	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.01	14%	0.137	C	C	.	.	H	α-helix	trans	-65.4	-42.9	-173.2	0	0	0	0	0	112.8	A213 S214 G216 I223 F271	A213-G219 WeakPolarHBondContact CB-O 3.33Å; S214-G219 WeakPolarHBondContact O-CA 3.4Å; G216-G219 PolarHBondContact O-N 3.35Å; G219-I223 WeakPolarHBondContact O-CB 3.11Å; G219-I223 WeakPolarHBondContact O-CG2 3.44Å; G219-I223 PolarHBondContact O-N 2.74Å; G219-F271 VanDerWaalsContact CA-O 3.3Å; G219-F271 WeakPolarHBondContact CA-O 3.46Å
220	E	90.9	Very high	92.8	Very high	66 Å²	66	26.7 Å²	26.7	31%	0.308	14%	0.137	S	C	.	.	H	α-helix	trans	-69.3	-45.2	-177.6	-63.4	-167.2	152.9	0	0	112.9	G216 Y218 I223 E224 K242	G216-E220 WeakPolarHBondContact O-CG 3.42Å; G216-E220 PolarHBondContact O-N 3.08Å; G216-E220 VanDerWaalsContact O-N 3.17Å; Y218-E220 PolarHBondContact O-N 3.46Å; E220-I223 WeakPolarHBondContact O-CG2 3.48Å; E220-E224 WeakPolarHBondContact O-CB 3.14Å; E220-E224 PolarHBondContact O-N 3.5Å; E220-K242 IonicContact OE1-NZ 2.68Å; E220-K242 PolarHBondContact OE1-NZ 3.3Å
221	T	91.8	Very high	92.5	Very high	15 Å²	15	33.4 Å²	33.4	9%	0.092	16%	0.162	C	C	.	.	H	α-helix	trans	-74.3	-33.9	-179.5	67.2	0	0	0	0	112.1	S171 K173 D217 A225	S171-T221 PolarHBondContact OG-OG1 2.94Å; S171-T221 VanDerWaalsContact OG-OG1 3.09Å; K173-T221 HydrophobicContact CD-CG2 3.84Å; K173-T221 HydrophobicContact CG-CG2 4.01Å; D217-T221 WeakPolarHBondContact O-CB 3.49Å; D217-T221 WeakPolarHBondContact O-CG2 3.37Å; D217-T221 PolarHBondContact O-N 3.5Å; D217-T221 PolarHBondContact O-OG1 3.25Å; T221-A225 WeakPolarHBondContact O-CB 3.04Å; T221-A225 PolarHBondContact O-N 3.13Å
222	G	93.8	Very high	92.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63.5	-46.3	174.3	0	0	0	0	0	111.7	Y218 A225 F226	Y218-G222 PolarHBondContact O-N 2.9Å; G222-A225 PolarHBondContact O-N 3.06Å; G222-F226 PolarHBondContact O-N 3.47Å
223	I	94.9	Very high	92.1	Very high	9 Å²	9	41.6 Å²	41.6	5%	0.046	20%	0.2	C	C	.	.	H	α-helix	trans	-68	-40.9	177.9	-154	68.6	0	0	0	111.9	T211 A213 G219 E220 A225 F226 E227 V269 F271	T211-I223 HydrophobicContact CG2-CD1 3.73Å; T211-I223 HydrophobicContact CG2-CG1 4.11Å; A213-I223 HydrophobicContact CB-CB 3.99Å; A213-I223 HydrophobicContact CB-CG2 3.72Å; G219-I223 WeakPolarHBondContact O-CB 3.11Å; G219-I223 WeakPolarHBondContact O-CG2 3.44Å; G219-I223 PolarHBondContact O-N 2.74Å; E220-I223 WeakPolarHBondContact O-CG2 3.48Å; I223-A225 VanDerWaalsContact C-N 3.32Å; I223-A225 PolarHBondContact O-N 3.42Å; I223-F226 HydrophobicContact CD1-CB 4.42Å; I223-F226 HydrophobicContact CD1-CD1 3.94Å; I223-F226 HydrophobicContact CD1-CG 4.45Å; I223-F226 CarbonylContact O-C 3.56Å; I223-F226 WeakPolarHBondContact O-CA 3.27Å; I223-F226 WeakPolarHBondContact O-CB 3.36Å; I223-F226 PolarHBondContact O-N 3.15Å; I223-E227 WeakPolarHBondContact O-CG 3.17Å; I223-E227 PolarHBondContact O-N 3.3Å; I223-V269 HydrophobicContact CD1-CG1 4.14Å; I223-F271 HydrophobicContact CB-CB 4.32Å; I223-F271 HydrophobicContact CB-CD2 4.45Å; I223-F271 HydrophobicContact CD1-CB 4.34Å; I223-F271 HydrophobicContact CD1-CD2 3.6Å; I223-F271 HydrophobicContact CD1-CE2 4.39Å; I223-F271 HydrophobicContact CD1-CG 4.37Å
224	E	94.2	Very high	91.9	Very high	113 Å²	113	47.1 Å²	47.1	53%	0.528	23%	0.229	S	C	.	.	H	α-helix	trans	-58.5	-43.2	176.8	-175.8	178.9	-173.6	0	0	111.8	E220 F226 E227 Q228	E220-E224 WeakPolarHBondContact O-CB 3.14Å; E220-E224 PolarHBondContact O-N 3.5Å; E224-F226 VanDerWaalsContact C-N 3.33Å; E224-F226 PolarHBondContact O-N 3.08Å; E224-E227 PolarHBondContact O-N 2.97Å; E224-Q228 WeakPolarHBondContact O-CG 3.47Å; E224-Q228 PolarHBondContact O-N 3.46Å
225	A	94.9	Very high	92	Very high	12 Å²	12	47.1 Å²	47.1	10%	0.099	23%	0.229	C	C	.	.	H	α-helix	trans	-62	-41.2	173.6	0	0	0	0	0	111.7	F191 A194 T221 G222 I223 Q228 E229	F191-A225 HydrophobicContact CD2-CB 4.47Å; A194-A225 HydrophobicContact CB-CB 3.82Å; T221-A225 WeakPolarHBondContact O-CB 3.04Å; T221-A225 PolarHBondContact O-N 3.13Å; G222-A225 PolarHBondContact O-N 3.06Å; I223-A225 VanDerWaalsContact C-N 3.32Å; I223-A225 PolarHBondContact O-N 3.42Å; A225-Q228 PolarHBondContact O-N 3.26Å; A225-E229 WeakPolarHBondContact O-CG 3.47Å; A225-E229 PolarHBondContact O-N 2.93Å; A225-E229 VanDerWaalsContact O-N 3.09Å
226	F	96.7	Very high	92.3	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.5	-42.5	174.9	169.1	-93.1	0	0	0	112.3	A194 M197 A198 L201 V209 T211 G222 I223 E224 Q228 E229 A230 V269 F271	A194-F226 HydrophobicContact CB-CB 3.94Å; M197-F226 HydrophobicContact CB-CD2 4.05Å; M197-F226 HydrophobicContact CB-CE2 4.21Å; A198-F226 HydrophobicContact CB-CD2 4.44Å; A198-F226 HydrophobicContact CB-CE2 4.23Å; L201-F226 HydrophobicContact CD1-CE2 3.77Å; L201-F226 HydrophobicContact CD1-CZ 3.47Å; L201-F226 VanDerWaalsContact CD1-CZ 3.47Å; V209-F226 HydrophobicContact CG2-CE1 4.48Å; V209-F226 HydrophobicContact CG2-CZ 4.36Å; T211-F226 HydrophobicContact CG2-CD1 4Å; T211-F226 HydrophobicContact CG2-CE1 3.71Å; G222-F226 PolarHBondContact O-N 3.47Å; I223-F226 HydrophobicContact CD1-CB 4.42Å; I223-F226 HydrophobicContact CD1-CD1 3.94Å; I223-F226 HydrophobicContact CD1-CG 4.45Å; I223-F226 CarbonylContact O-C 3.56Å; I223-F226 WeakPolarHBondContact O-CA 3.27Å; I223-F226 WeakPolarHBondContact O-CB 3.36Å; I223-F226 PolarHBondContact O-N 3.15Å; E224-F226 VanDerWaalsContact C-N 3.33Å; E224-F226 PolarHBondContact O-N 3.08Å; F226-Q228 PolarHBondContact O-N 3.37Å; F226-E229 PolarHBondContact O-N 3.27Å; F226-A230 HydrophobicContact CE1-CB 4.19Å; F226-A230 HydrophobicContact CZ-CB 4.08Å; F226-A230 VanDerWaalsContact O-CB 3.24Å; F226-A230 WeakPolarHBondContact O-CB 3.43Å; F226-A230 PolarHBondContact O-N 3.09Å; F226-V269 HydrophobicContact CD1-CG1 3.98Å; F226-V269 HydrophobicContact CD2-CG1 4.17Å; F226-V269 HydrophobicContact CE1-CB 4.16Å; F226-V269 HydrophobicContact CE1-CG1 3.88Å; F226-V269 HydrophobicContact CE1-CG2 4.07Å; F226-V269 HydrophobicContact CE2-CG1 4.05Å; F226-V269 HydrophobicContact CE2-CG2 4.25Å; F226-V269 HydrophobicContact CG-CG1 4.14Å; F226-V269 HydrophobicContact CZ-CB 4.22Å; F226-V269 HydrophobicContact CZ-CG1 3.93Å; F226-V269 HydrophobicContact CZ-CG2 3.69Å; F226-F271 HydrophobicContact CB-CE2 3.81Å; F226-F271 HydrophobicContact CB-CZ 4.49Å; F226-F271 HydrophobicContact CG-CE2 4.35Å
227	E	94.8	Very high	92.8	Very high	38 Å²	38	43.4 Å²	43.4	18%	0.178	21%	0.206	C	C	.	.	H	α-helix	trans	-60.9	-36.2	178.8	-54.4	-160.6	164.8	0	0	111.7	I223 E224 R231 I237 S240	I223-E227 WeakPolarHBondContact O-CG 3.17Å; I223-E227 PolarHBondContact O-N 3.3Å; E224-E227 PolarHBondContact O-N 2.97Å; E227-R231 VanDerWaalsContact O-CG 3.22Å; E227-R231 WeakPolarHBondContact O-CG 3.35Å; E227-R231 PolarHBondContact O-N 3.45Å; E227-R231 VanDerWaalsContact O-N 3.09Å; E227-R231 IonicContact OE2-NH2 3.01Å; E227-R231 PolarHBondContact OE2-NH2 3.29Å; E227-I237 HydrophobicContact CB-CD1 3.56Å; E227-I237 VanDerWaalsContact CD-CD1 3.5Å; E227-I237 HydrophobicContact CG-CD1 3.32Å; E227-S240 PolarHBondContact OE1-OG 3.31Å
228	Q	93.8	Very high	93	Very high	103 Å²	103	42.1 Å²	42.1	48%	0.481	20%	0.2	S	C	.	.	H	α-helix	trans	-67.4	-47.9	175	-67	176.6	12.6	0	0	111.6	E224 A225 F226 A230 R231 M232	E224-Q228 WeakPolarHBondContact O-CG 3.47Å; E224-Q228 PolarHBondContact O-N 3.46Å; A225-Q228 PolarHBondContact O-N 3.26Å; F226-Q228 PolarHBondContact O-N 3.37Å; Q228-A230 VanDerWaalsContact C-N 3.31Å; Q228-A230 PolarHBondContact O-N 3.08Å; Q228-R231 PolarHBondContact O-N 3.24Å; Q228-M232 WeakPolarHBondContact O-CG 3.08Å; Q228-M232 PolarHBondContact O-N 3.43Å
229	E	95.1	Very high	93.2	Very high	12 Å²	12	42.3 Å²	42.3	6%	0.056	20%	0.204	C	C	.	.	H	α-helix	trans	-64.6	-33.7	178.3	-70.8	-65.5	143.2	0	0	113	F191 K195 A198 A225 F226 M232 R233	F191-E229 HydrophobicContact CE2-CG 4.41Å; F191-E229 VanDerWaalsContact CE2-OE1 3.26Å; F191-E229 WeakPolarHBondContact CE2-OE1 3.44Å; F191-E229 VanDerWaalsContact CZ-OE1 3.27Å; F191-E229 WeakPolarHBondContact CZ-OE1 3.49Å; K195-E229 HydrophobicContact CB-CG 4.26Å; A198-E229 HydrophobicContact CB-CB 3.8Å; A225-E229 WeakPolarHBondContact O-CG 3.47Å; A225-E229 PolarHBondContact O-N 2.93Å; A225-E229 VanDerWaalsContact O-N 3.09Å; F226-E229 PolarHBondContact O-N 3.27Å; E229-M232 HydrophobicContact CG-CE 4.25Å; E229-M232 WeakPolarHBondContact OE1-CE 3.44Å; E229-R233 PolarHBondContact O-NH1 3.24Å; E229-R233 IonicContact OE2-CZ 2.82Å; E229-R233 IonicContact OE2-NH1 3.37Å; E229-R233 PolarHBondContact OE2-NH1 2.84Å; E229-R233 IonicContact OE2-NH2 3.84Å; E229-R233 PolarHBondContact OE2-NH2 2.95Å
230	A	94.5	Very high	93.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-67.2	-46.6	174.9	0	0	0	0	0	111.7	F226 Q228 M232 R233 N234 I235	F226-A230 HydrophobicContact CE1-CB 4.19Å; F226-A230 HydrophobicContact CZ-CB 4.08Å; F226-A230 VanDerWaalsContact O-CB 3.24Å; F226-A230 WeakPolarHBondContact O-CB 3.43Å; F226-A230 PolarHBondContact O-N 3.09Å; Q228-A230 VanDerWaalsContact C-N 3.31Å; Q228-A230 PolarHBondContact O-N 3.08Å; A230-M232 VanDerWaalsContact C-N 3.31Å; A230-M232 PolarHBondContact O-N 3.49Å; A230-R233 CarbonylContact O-C 3.54Å; A230-R233 PolarHBondContact O-N 2.87Å; A230-N234 PolarHBondContact O-N 3.33Å; A230-I235 CarbonylContact C-O 3.57Å; A230-I235 HydrophobicContact CB-CB 4.05Å; A230-I235 HydrophobicContact CB-CG2 4.38Å; A230-I235 PolarHBondContact O-N 3.2Å
231	R	91.8	Very high	93.4	Very high	141 Å²	141	43.6 Å²	43.6	53%	0.532	22%	0.216	S	C	.	.	H	α-helix	trans	-58.5	-41.8	176.5	-75.4	171.3	-163.1	-175.2	9.8	112	E227 Q228 R233 N234 Y526	E227-R231 VanDerWaalsContact O-CG 3.22Å; E227-R231 WeakPolarHBondContact O-CG 3.35Å; E227-R231 PolarHBondContact O-N 3.45Å; E227-R231 VanDerWaalsContact O-N 3.09Å; E227-R231 IonicContact OE2-NH2 3.01Å; E227-R231 PolarHBondContact OE2-NH2 3.29Å; Q228-R231 PolarHBondContact O-N 3.24Å; R231-R233 PolarHBondContact O-N 3.25Å; R231-R233 VanDerWaalsContact O-N 3.16Å; R231-N234 PolarHBondContact O-N 3.08Å; R231-Y526 WeakPolarHBondContact CG-OH 3.2Å
232	M	91.7	Very high	93.3	Very high	125 Å²	125	48 Å²	48	62%	0.616	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-18.1	177	-70.3	-170.7	-71.3	0	0	113.7	Q228 E229 A230	Q228-M232 WeakPolarHBondContact O-CG 3.08Å; Q228-M232 PolarHBondContact O-N 3.43Å; E229-M232 HydrophobicContact CG-CE 4.25Å; E229-M232 WeakPolarHBondContact OE1-CE 3.44Å; A230-M232 VanDerWaalsContact C-N 3.31Å; A230-M232 PolarHBondContact O-N 3.49Å
233	R	92.1	Very high	93	Very high	48 Å²	48	48 Å²	48	18%	0.181	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110	14.5	-179.3	-69.9	171.9	-178.5	72.6	-6.9	113.3	E199 E229 A230 R231 I235	E199-R233 IonicContact OE1-NH2 2.98Å; E199-R233 PolarHBondContact OE1-NH2 3.2Å; E229-R233 PolarHBondContact O-NH1 3.24Å; E229-R233 IonicContact OE2-CZ 2.82Å; E229-R233 IonicContact OE2-NH1 3.37Å; E229-R233 PolarHBondContact OE2-NH1 2.84Å; E229-R233 IonicContact OE2-NH2 3.84Å; E229-R233 PolarHBondContact OE2-NH2 2.95Å; A230-R233 CarbonylContact O-C 3.54Å; A230-R233 PolarHBondContact O-N 2.87Å; R231-R233 PolarHBondContact O-N 3.25Å; R231-R233 VanDerWaalsContact O-N 3.16Å; R233-I235 VanDerWaalsContact C-N 3.33Å; R233-I235 HydrophobicContact CB-CD1 4.09Å; R233-I235 HydrophobicContact CB-CG1 4.32Å; R233-I235 PolarHBondContact O-N 2.96Å
234	N	90.1	Very high	92	Very high	116 Å²	116	48 Å²	48	62%	0.62	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.5	38.8	-177.5	-57.8	-46.8	0	0	0	113.6	A230 R231	A230-N234 PolarHBondContact O-N 3.33Å; R231-N234 PolarHBondContact O-N 3.08Å
235	I	93.4	Very high	90.4	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.01	23%	0.233	C	C	.	.			trans	-108	122.4	175.8	-56.9	167.1	0	0	0	108.7	L201 V209 A230 R233 Y526	L201-I235 HydrophobicContact CB-CD1 3.73Å; L201-I235 HydrophobicContact CD1-CD1 4.3Å; L201-I235 HydrophobicContact CD1-CG2 4.17Å; V209-I235 HydrophobicContact CG1-CG2 4.45Å; V209-I235 HydrophobicContact CG2-CG2 4.1Å; A230-I235 CarbonylContact C-O 3.57Å; A230-I235 HydrophobicContact CB-CB 4.05Å; A230-I235 HydrophobicContact CB-CG2 4.38Å; A230-I235 PolarHBondContact O-N 3.2Å; R233-I235 VanDerWaalsContact C-N 3.33Å; R233-I235 HydrophobicContact CB-CD1 4.09Å; R233-I235 HydrophobicContact CB-CG1 4.32Å; R233-I235 PolarHBondContact O-N 2.96Å; I235-Y526 PolarHBondContact O-OH 3.41Å
236	C	92.4	Very high	88.3	Confident	6 Å²	6	52.8 Å²	52.8	4%	0.041	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	155.2	177.7	-81.3	0	0	0	0	113.9	T207 Y208 V209 Y526 C527	T207-C236 PolarHBondContact O-N 3.39Å; Y208-C236 HydrophobicContact CD2-CB 3.78Å; Y208-C236 HydrophobicContact CE2-CB 4.4Å; V209-C236 PolarHBondContact N-O 3.13Å; C236-Y526 WeakPolarHBondContact SG-CE2 3.41Å; C236-Y526 VanDerWaalsContact SG-CZ 3.58Å; C236-C527 HydrophobicContact CB-CB 3.88Å; C236-C527 WeakPolarHBondContact CB-SG 3.39Å; C236-C527 WeakPolarHBondContact SG-CB 3.41Å; C236-C527 PolarHBondContact SG-N 3.22Å; C236-C527 CovalentContact SG-SG 1.99Å; C236-C527 PolarHBondContact SG-SG 3.09Å
237	I	93.7	Very high	86.2	Confident	42 Å²	42	59.9 Å²	59.9	22%	0.215	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	117.6	175.5	-59.3	162.2	0	0	0	108.5	V209 T211 E227 T239	V209-I237 CarbonylContact O-C 3.52Å; V209-I237 VanDerWaalsContact O-CA 3.28Å; V209-I237 WeakPolarHBondContact O-CA 3.42Å; T211-I237 HydrophobicContact CG2-CG1 4.32Å; T211-I237 HydrophobicContact CG2-CG2 4.07Å; E227-I237 HydrophobicContact CB-CD1 3.56Å; E227-I237 VanDerWaalsContact CD-CD1 3.5Å; E227-I237 HydrophobicContact CG-CD1 3.32Å; I237-T239 WeakPolarHBondContact CG2-O 3.45Å
238	A	92.1	Very high	84.5	Confident	11 Å²	11	60.3 Å²	60.3	9%	0.091	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	-43.5	-178	0	0	0	0	0	112.7	Y208 V209 K262 A265	Y208-A238 HydrophobicContact CD1-CB 4.07Å; Y208-A238 HydrophobicContact CD2-CB 4.25Å; Y208-A238 HydrophobicContact CE1-CB 3.44Å; Y208-A238 VanDerWaalsContact CE1-CB 3.44Å; Y208-A238 HydrophobicContact CE2-CB 3.65Å; Y208-A238 HydrophobicContact CG-CB 4.44Å; Y208-A238 WeakPolarHBondContact OH-CB 3.37Å; V209-A238 PolarHBondContact O-N 3.5Å; A238-K262 HydrophobicContact CB-CB 4.1Å; A238-K262 HydrophobicContact CB-CG 4.1Å; A238-K262 WeakPolarHBondContact O-CE 3.45Å; A238-A265 HydrophobicContact CB-CB 3.64Å
239	T	92.6	Very high	82.8	Confident	29 Å²	29	61.8 Å²	61.8	18%	0.178	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	151.6	170.7	-166.6	0	0	0	0	108.9	T211 I237 E241 L259	T211-T239 PolarHBondContact N-O 3.37Å; T211-T239 PolarHBondContact OG1-O 3.44Å; I237-T239 WeakPolarHBondContact CG2-O 3.45Å; T239-E241 HydrophobicContact CG2-CG 4.18Å; T239-E241 PolarHBondContact OG1-OE1 2.81Å; T239-L259 HydrophobicContact CG2-CD2 3.74Å
240	S	93.5	Very high	81.2	Confident	53 Å²	53	69.7 Å²	69.7	37%	0.371	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	105.1	179.4	-165.7	0	0	0	0	108.4	T211 E227	T211-S240 WeakPolarHBondContact OG1-CA 3.49Å; T211-S240 WeakPolarHBondContact OG1-CB 3.41Å; T211-S240 PolarHBondContact OG1-OG 3Å; E227-S240 PolarHBondContact OE1-OG 3.31Å
241	E	93.4	Very high	80.4	Confident	41 Å²	41	71.3 Å²	71.3	19%	0.192	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	152.7	-174.1	-63.4	-62.5	146.7	0	0	111.4	T211 V212 A213 T239 V255 Q258 L259	T211-E241 PolarHBondContact O-N 3.2Å; V212-E241 VanDerWaalsContact CA-O 3.3Å; V212-E241 WeakPolarHBondContact CA-O 3.22Å; V212-E241 HydrophobicContact CG1-CB 4.47Å; A213-E241 PolarHBondContact N-O 2.89Å; T239-E241 HydrophobicContact CG2-CG 4.18Å; T239-E241 PolarHBondContact OG1-OE1 2.81Å; E241-V255 HydrophobicContact CB-CG1 3.73Å; E241-V255 HydrophobicContact CB-CG2 4.21Å; E241-V255 HydrophobicContact CG-CG1 4.14Å; E241-Q258 HydrophobicContact CG-CB 4.16Å; E241-L259 HydrophobicContact CG-CD2 4.23Å
242	K	90.7	Very high	80.3	Confident	107 Å²	107	65.2 Å²	65.2	47%	0.465	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	143.8	177.2	-64.5	-175.4	178.6	-171.5	0	110.9	A213 E220	A213-K242 CarbonylContact O-C 3.48Å; A213-K242 VanDerWaalsContact O-CA 3.29Å; A213-K242 WeakPolarHBondContact O-CA 3.31Å; E220-K242 IonicContact OE1-NZ 2.68Å; E220-K242 PolarHBondContact OE1-NZ 3.3Å
243	V	87.4	Confident	80.2	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	133.1	176.7	-66.6	0	0	0	0	110.9	V212 A213 S214 E215 Y252 V255 L272 D276	V212-V243 HydrophobicContact CG1-CG1 3.94Å; V212-V243 HydrophobicContact CG1-CG2 4.32Å; A213-V243 PolarHBondContact O-N 3.4Å; S214-V243 CarbonylContact C-O 3.55Å; S214-V243 WeakPolarHBondContact CA-O 3.45Å; E215-V243 PolarHBondContact N-O 3.42Å; V243-Y252 HydrophobicContact CB-CD1 4.03Å; V243-Y252 HydrophobicContact CB-CE1 3.56Å; V243-Y252 HydrophobicContact CG1-CD1 3.71Å; V243-Y252 HydrophobicContact CG1-CE1 3.79Å; V243-Y252 HydrophobicContact CG2-CE1 4Å; V243-V255 HydrophobicContact CG1-CB 4.29Å; V243-V255 HydrophobicContact CG1-CG1 4.28Å; V243-V255 HydrophobicContact CG1-CG2 3.79Å; V243-L272 HydrophobicContact CG2-CD2 3.47Å; V243-L272 VanDerWaalsContact CG2-CD2 3.47Å; V243-D276 HydrophobicContact CG2-CB 4.06Å
244	G	74.1	Confident	80.1	Confident	8 Å²	8	61.3 Å²	61.3	8%	0.082	33%	0.326	C	S	.	.			trans	178.9	-165.2	-175.6	0	0	0	0	0	115.8	E215 S246	E215-G244 VanDerWaalsContact OE2-CA 3.26Å; E215-G244 WeakPolarHBondContact OE2-CA 3.35Å; G244-S246 PolarHBondContact O-N 3.46Å
245	R	60.8	Low	80.2	Confident	131 Å²	131	56.1 Å²	56.1	49%	0.494	30%	0.298	S	S	.	.	S	Bend	trans	-74.9	13.1	-137.2	-84.2	179.3	179	177.9	5.4	118.6	E215	E215-R245 PolarHBondContact OE2-N 2.87Å
246	S	50.1	Low	80.2	Confident	95 Å²	95	56 Å²	56	66%	0.664	30%	0.298	S	S	*	.	S	Bend	trans	-119	115.8	-179.9	57.4	0	0	0	0	114.1	G244	G244-S246 PolarHBondContact O-N 3.46Å
247	N	51.8	Low	80.2	Confident	150 Å²	150	61.6 Å²	61.6	80%	0.802	32%	0.318	S	S	*	.	S	Bend	trans	50.3	55.5	-179.3	-72.6	-21.1	0	0	0	115.1	K249 K250 S251	N247-K249 PolarHBondContact O-N 3.31Å; N247-K249 VanDerWaalsContact O-N 3.09Å; N247-K250 PolarHBondContact O-N 2.69Å; N247-S251 PolarHBondContact O-N 2.69Å
248	A	59	Low	80.1	Confident	47 Å²	47	63.2 Å²	63.2	39%	0.388	33%	0.325	S	S	.	.	H	α-helix	trans	-31.9	-54.1	-173.4	0	0	0	0	0	116.8	K250 S251 Y252	A248-K250 PolarHBondContact O-N 3.19Å; A248-S251 PolarHBondContact O-N 2.89Å; A248-Y252 HydrophobicContact CB-CE2 3.96Å; A248-Y252 WeakPolarHBondContact O-CD2 3.42Å; A248-Y252 PolarHBondContact O-N 2.98Å; A248-Y252 VanDerWaalsContact O-N 3.13Å
249	K	59	Low	80.2	Confident	134 Å²	134	62.7 Å²	62.7	58%	0.583	32%	0.321	S	S	*	.	H	α-helix	trans	-66.6	-40.1	-171.9	-70.8	-175	179.7	-179.5	0	114.2	N247 S251	N247-K249 PolarHBondContact O-N 3.31Å; N247-K249 VanDerWaalsContact O-N 3.09Å; K249-S251 VanDerWaalsContact C-N 3.31Å
250	K	60.3	Low	80.1	Confident	178 Å²	178	67.9 Å²	67.9	77%	0.774	34%	0.341	S	S	*	.	H	α-helix	trans	-74.6	-26.1	177.7	-72.7	-173.2	179.1	-178.7	0	111.9	N247 A248 A254	N247-K250 PolarHBondContact O-N 2.69Å; A248-K250 PolarHBondContact O-N 3.19Å; K250-A254 WeakPolarHBondContact O-CB 3.44Å; K250-A254 PolarHBondContact O-N 3.34Å
251	S	78.8	Confident	80	Confident	34 Å²	34	71.4 Å²	71.4	24%	0.238	35%	0.351	C	S	.	.	H	α-helix	trans	-69.8	-47.7	177.7	178.7	0	0	0	0	111.8	N247 A248 K249 E253 A254 V255	N247-S251 PolarHBondContact O-N 2.69Å; A248-S251 PolarHBondContact O-N 2.89Å; K249-S251 VanDerWaalsContact C-N 3.31Å; S251-E253 PolarHBondContact O-N 3.47Å; S251-A254 WeakPolarHBondContact O-CB 3.19Å; S251-A254 PolarHBondContact O-N 3.08Å; S251-V255 PolarHBondContact O-N 3.31Å
252	Y	88.8	Confident	79.9	Confident	12 Å²	12	72.8 Å²	72.8	5%	0.047	36%	0.357	C	S	.	.	H	α-helix	trans	-63.6	-43.3	178.9	-65.1	-67.2	0	0	0	113.3	V243 A248 A254 V255 I256 D276 E279 L280	V243-Y252 HydrophobicContact CB-CD1 4.03Å; V243-Y252 HydrophobicContact CB-CE1 3.56Å; V243-Y252 HydrophobicContact CG1-CD1 3.71Å; V243-Y252 HydrophobicContact CG1-CE1 3.79Å; V243-Y252 HydrophobicContact CG2-CE1 4Å; A248-Y252 HydrophobicContact CB-CE2 3.96Å; A248-Y252 WeakPolarHBondContact O-CD2 3.42Å; A248-Y252 PolarHBondContact O-N 2.98Å; A248-Y252 VanDerWaalsContact O-N 3.13Å; Y252-A254 VanDerWaalsContact C-N 3.28Å; Y252-A254 PolarHBondContact O-N 3.06Å; Y252-V255 PolarHBondContact O-N 3.09Å; Y252-I256 WeakPolarHBondContact O-CG1 3.27Å; Y252-I256 PolarHBondContact O-N 3.32Å; Y252-D276 HydrophobicContact CE1-CB 4.36Å; Y252-D276 PolarHBondContact OH-OD1 3.41Å; Y252-D276 VanDerWaalsContact OH-OD1 3.04Å; Y252-E279 HydrophobicContact CD2-CB 3.73Å; Y252-E279 HydrophobicContact CE1-CB 4.32Å; Y252-E279 HydrophobicContact CE2-CB 3.49Å; Y252-E279 VanDerWaalsContact CE2-CB 3.49Å; Y252-E279 HydrophobicContact CE2-CG 4.11Å; Y252-E279 HydrophobicContact CG-CB 4.3Å; Y252-L280 HydrophobicContact CD1-CB 4.2Å; Y252-L280 HydrophobicContact CD1-CD1 4.12Å
253	E	89.6	Confident	79.7	Confident	47 Å²	47	72 Å²	72	22%	0.22	36%	0.362	C	S	.	.	H	α-helix	trans	-63.2	-35.1	175.5	-71.5	-178.5	-163	0	0	112.3	S251 R257 A283 L287	S251-E253 PolarHBondContact O-N 3.47Å; E253-R257 VanDerWaalsContact O-CG 3.31Å; E253-R257 WeakPolarHBondContact O-CG 3.46Å; E253-R257 PolarHBondContact O-N 2.73Å; E253-R257 IonicContact OE2-CZ 2.76Å; E253-R257 IonicContact OE2-NH1 2.8Å; E253-R257 IonicContact OE2-NH2 2.7Å; E253-R257 PolarHBondContact OE2-NH2 3.45Å; E253-A283 HydrophobicContact CG-CB 4.27Å; E253-L287 HydrophobicContact CB-CD1 4.2Å; E253-L287 HydrophobicContact CG-CD1 4.33Å
254	A	90.1	Very high	79.9	Confident	45 Å²	45	75.8 Å²	75.8	37%	0.372	38%	0.383	S	S	.	.	H	α-helix	trans	-64.6	-43.3	175.5	0	0	0	0	0	111	K250 S251 Y252 R257 Q258	K250-A254 WeakPolarHBondContact O-CB 3.44Å; K250-A254 PolarHBondContact O-N 3.34Å; S251-A254 WeakPolarHBondContact O-CB 3.19Å; S251-A254 PolarHBondContact O-N 3.08Å; Y252-A254 VanDerWaalsContact C-N 3.28Å; Y252-A254 PolarHBondContact O-N 3.06Å; A254-R257 WeakPolarHBondContact O-CB 3.28Å; A254-R257 PolarHBondContact O-N 3.44Å; A254-Q258 WeakPolarHBondContact O-CG 3.4Å; A254-Q258 PolarHBondContact O-N 3.16Å
255	V	92.2	Very high	80.8	Confident	6 Å²	6	75.4 Å²	75.4	4%	0.036	38%	0.379	C	S	.	.	H	α-helix	trans	-59.1	-49.2	174.9	169.3	0	0	0	0	111	V212 E241 V243 S251 Y252 R257 Q258 L259 L280	V212-V255 HydrophobicContact CG1-CG1 4Å; V212-V255 HydrophobicContact CG2-CG1 4.28Å; E241-V255 HydrophobicContact CB-CG1 3.73Å; E241-V255 HydrophobicContact CB-CG2 4.21Å; E241-V255 HydrophobicContact CG-CG1 4.14Å; V243-V255 HydrophobicContact CG1-CB 4.29Å; V243-V255 HydrophobicContact CG1-CG1 4.28Å; V243-V255 HydrophobicContact CG1-CG2 3.79Å; S251-V255 PolarHBondContact O-N 3.31Å; Y252-V255 PolarHBondContact O-N 3.09Å; V255-R257 VanDerWaalsContact C-N 3.27Å; V255-R257 PolarHBondContact O-N 2.87Å; V255-Q258 WeakPolarHBondContact O-CA 3.5Å; V255-Q258 WeakPolarHBondContact O-CB 3.46Å; V255-Q258 PolarHBondContact O-N 3.03Å; V255-L259 HydrophobicContact CG1-CG 4.45Å; V255-L259 WeakPolarHBondContact O-CG 3.41Å; V255-L259 PolarHBondContact O-N 2.64Å; V255-L280 HydrophobicContact CB-CD1 4.49Å; V255-L280 HydrophobicContact CG1-CD1 4.11Å
256	I	93.6	Very high	82.3	Confident	1 Å²	1	73.5 Å²	73.5	1%	0.005	38%	0.375	C	S	.	.	H	α-helix	trans	-58.2	-40.2	176.5	-63.9	-58.9	0	0	0	111.8	Y252 Q258 L259 F260 L280 A283 A284 L287 T289 F291 W293	Y252-I256 WeakPolarHBondContact O-CG1 3.27Å; Y252-I256 PolarHBondContact O-N 3.32Å; I256-Q258 VanDerWaalsContact C-N 3.33Å; I256-Q258 PolarHBondContact O-N 3.36Å; I256-L259 HydrophobicContact CD1-CD1 4.2Å; I256-L259 PolarHBondContact O-N 3.4Å; I256-F260 WeakPolarHBondContact O-CB 3.37Å; I256-F260 PolarHBondContact O-N 2.98Å; I256-L280 HydrophobicContact CD1-CD1 3.62Å; I256-L280 HydrophobicContact CD1-CG 4.02Å; I256-L280 HydrophobicContact CG1-CD1 3.96Å; I256-A283 HydrophobicContact CG1-CB 4.35Å; I256-A284 HydrophobicContact CD1-CB 3.89Å; I256-A284 HydrophobicContact CG1-CB 4.25Å; I256-L287 HydrophobicContact CB-CD1 3.84Å; I256-L287 HydrophobicContact CG2-CD1 3.61Å; I256-T289 HydrophobicContact CG2-CG2 4.4Å; I256-T289 WeakPolarHBondContact CG2-OG1 3.22Å; I256-F291 HydrophobicContact CG2-CE2 4.4Å; I256-W293 HydrophobicContact CD1-CH2 4.11Å
257	R	92.4	Very high	84.5	Confident	123 Å²	123	69 Å²	69	46%	0.464	34%	0.344	S	S	.	.	H	α-helix	trans	-64	-36	174.7	-71.5	178.8	-168.4	109.1	6.9	112.4	E253 A254 V255 F260 Q261 L287	E253-R257 VanDerWaalsContact O-CG 3.31Å; E253-R257 WeakPolarHBondContact O-CG 3.46Å; E253-R257 PolarHBondContact O-N 2.73Å; E253-R257 IonicContact OE2-CZ 2.76Å; E253-R257 IonicContact OE2-NH1 2.8Å; E253-R257 IonicContact OE2-NH2 2.7Å; E253-R257 PolarHBondContact OE2-NH2 3.45Å; A254-R257 WeakPolarHBondContact O-CB 3.28Å; A254-R257 PolarHBondContact O-N 3.44Å; V255-R257 VanDerWaalsContact C-N 3.27Å; V255-R257 PolarHBondContact O-N 2.87Å; R257-F260 PolarHBondContact O-N 3.5Å; R257-Q261 WeakPolarHBondContact O-CG 3.02Å; R257-Q261 PolarHBondContact O-N 3.27Å; R257-L287 HydrophobicContact CG-CD1 4.34Å
258	Q	92.1	Very high	86.7	Confident	76 Å²	76	61.9 Å²	61.9	36%	0.355	31%	0.306	S	S	.	.	H	α-helix	trans	-67.4	-43.6	174.7	-67.2	-64	-2.1	0	0	111.7	E241 A254 V255 I256 F260 Q261	E241-Q258 HydrophobicContact CG-CB 4.16Å; A254-Q258 WeakPolarHBondContact O-CG 3.4Å; A254-Q258 PolarHBondContact O-N 3.16Å; V255-Q258 WeakPolarHBondContact O-CA 3.5Å; V255-Q258 WeakPolarHBondContact O-CB 3.46Å; V255-Q258 PolarHBondContact O-N 3.03Å; I256-Q258 VanDerWaalsContact C-N 3.33Å; I256-Q258 PolarHBondContact O-N 3.36Å; Q258-F260 VanDerWaalsContact C-N 3.25Å; Q258-F260 PolarHBondContact O-N 3.2Å; Q258-Q261 WeakPolarHBondContact O-CB 3.47Å; Q258-Q261 PolarHBondContact O-N 3.12Å; Q258-Q261 VanDerWaalsContact O-N 3.13Å; Q258-Q261 VanDerWaalsContact OE1-NE2 3.1Å
259	L	93.3	Very high	88.5	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-57.4	-42.3	173.9	-60.1	-175.3	0	0	0	111.1	V212 T239 E241 V255 I256 Q261 K262 F291	V212-L259 HydrophobicContact CG2-CD1 3.92Å; V212-L259 HydrophobicContact CG2-CD2 4.14Å; T239-L259 HydrophobicContact CG2-CD2 3.74Å; E241-L259 HydrophobicContact CG-CD2 4.23Å; V255-L259 HydrophobicContact CG1-CG 4.45Å; V255-L259 WeakPolarHBondContact O-CG 3.41Å; V255-L259 PolarHBondContact O-N 2.64Å; I256-L259 HydrophobicContact CD1-CD1 4.2Å; I256-L259 PolarHBondContact O-N 3.4Å; L259-Q261 VanDerWaalsContact C-N 3.27Å; L259-Q261 PolarHBondContact O-N 3.3Å; L259-K262 PolarHBondContact O-N 3.29Å; L259-K262 VanDerWaalsContact O-N 3.13Å; L259-F291 HydrophobicContact CB-CE1 4.08Å; L259-F291 HydrophobicContact CB-CE2 4.41Å; L259-F291 HydrophobicContact CB-CZ 3.75Å
260	F	90.8	Very high	90.3	Very high	137 Å²	137	53.3 Å²	53.3	60%	0.601	26%	0.26	S	S	*	.	H	α-helix	trans	-68.4	-21.4	-179.8	-162.1	-96.8	0	0	0	114.2	I256 R257 Q258 K262 T289 F291	I256-F260 WeakPolarHBondContact O-CB 3.37Å; I256-F260 PolarHBondContact O-N 2.98Å; R257-F260 PolarHBondContact O-N 3.5Å; Q258-F260 VanDerWaalsContact C-N 3.25Å; Q258-F260 PolarHBondContact O-N 3.2Å; F260-K262 PolarHBondContact O-N 2.97Å; F260-T289 HydrophobicContact CD2-CG2 3.96Å; F260-T289 HydrophobicContact CE2-CG2 4.22Å; F260-F291 HydrophobicContact CD2-CZ 4.5Å
261	Q	91.6	Very high	92	Very high	127 Å²	127	44.9 Å²	44.9	59%	0.593	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-12.7	173.4	-71.3	173.7	32.9	0	0	112.8	R257 Q258 L259 P263	R257-Q261 WeakPolarHBondContact O-CG 3.02Å; R257-Q261 PolarHBondContact O-N 3.27Å; Q258-Q261 WeakPolarHBondContact O-CB 3.47Å; Q258-Q261 PolarHBondContact O-N 3.12Å; Q258-Q261 VanDerWaalsContact O-N 3.13Å; Q258-Q261 VanDerWaalsContact OE1-NE2 3.1Å; L259-Q261 VanDerWaalsContact C-N 3.27Å; L259-Q261 PolarHBondContact O-N 3.3Å; Q261-P263 VanDerWaalsContact C-CD 3.48Å; Q261-P263 WeakPolarHBondContact O-CD 3.43Å
262	K	90.9	Very high	92.7	Very high	71 Å²	71	43.4 Å²	43.4	31%	0.309	21%	0.213	S	C	.	.			trans	-110.8	75.9	177.6	-60.2	-63.8	-172	160.7	0	109.9	A238 L259 F260 N264 A265	A238-K262 HydrophobicContact CB-CB 4.1Å; A238-K262 HydrophobicContact CB-CG 4.1Å; A238-K262 WeakPolarHBondContact O-CE 3.45Å; L259-K262 PolarHBondContact O-N 3.29Å; L259-K262 VanDerWaalsContact O-N 3.13Å; F260-K262 PolarHBondContact O-N 2.97Å; K262-N264 PolarHBondContact O-N 3.34Å; K262-N264 VanDerWaalsContact O-N 3.14Å; K262-A265 HydrophobicContact CB-CB 4.18Å; K262-A265 PolarHBondContact O-N 3.45Å
263	P	87.9	Confident	92.6	Very high	89 Å²	89	45 Å²	45	58%	0.578	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-27.3	-170.4	25.6	-36	0	0	0	113.9	Q261 A265 H266	Q261-P263 VanDerWaalsContact C-CD 3.48Å; Q261-P263 WeakPolarHBondContact O-CD 3.43Å; P263-A265 VanDerWaalsContact C-N 3.27Å; P263-A265 PolarHBondContact O-N 2.96Å; P263-H266 PolarHBondContact O-CE1 3.26Å; P263-H266 PolarHBondContact O-NE2 3.1Å
264	N	90.1	Very high	92.4	Very high	80 Å²	80	43.1 Å²	43.1	43%	0.428	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-11.1	179.6	-63	-1.6	0	0	0	113.1	Y208 K262 H266 Q508 C509	Y208-N264 HydrophobicContact CD1-CB 4.14Å; Y208-N264 HydrophobicContact CE1-CB 4.2Å; K262-N264 PolarHBondContact O-N 3.34Å; K262-N264 VanDerWaalsContact O-N 3.14Å; N264-H266 PolarHBondContact O-N 3.32Å; N264-Q508 WeakPolarHBondContact CB-O 3.46Å; N264-C509 PolarHBondContact ND2-O 3.34Å
265	A	93.2	Very high	92.1	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.008	20%	0.201	C	C	.	.			trans	-97.2	81.7	176.6	0	0	0	0	0	110.1	Y208 S210 A238 K262 P263 V267	Y208-A265 HydrophobicContact CD1-CB 3.81Å; Y208-A265 HydrophobicContact CE1-CB 3.92Å; S210-A265 WeakPolarHBondContact OG-CB 3.07Å; A238-A265 HydrophobicContact CB-CB 3.64Å; K262-A265 HydrophobicContact CB-CB 4.18Å; K262-A265 PolarHBondContact O-N 3.45Å; P263-A265 VanDerWaalsContact C-N 3.27Å; P263-A265 PolarHBondContact O-N 2.96Å; A265-V267 VanDerWaalsContact C-N 3.31Å
266	H	93.4	Very high	91.9	Very high	90 Å²	90	42.5 Å²	42.5	42%	0.417	20%	0.201	S	C	.	.			trans	-77.4	-17.9	-178.9	-66.3	-70.3	0	0	0	113.7	P263 N264 I292 T506 S507	P263-H266 PolarHBondContact O-CE1 3.26Å; P263-H266 PolarHBondContact O-NE2 3.1Å; N264-H266 PolarHBondContact O-N 3.32Å; H266-I292 PolarHBondContact O-N 3.17Å; H266-T506 PolarHBondContact CD2-O 2.8Å; H266-S507 PolarHBondContact N-OG 3.08Å
267	V	96.3	Very high	91.8	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	131.8	-178.8	179.5	0	0	0	0	110.1	L201 W206 V209 S210 A265 I292 V294 S507	L201-V267 HydrophobicContact CD2-CG1 3.96Å; W206-V267 HydrophobicContact CD2-CG2 3.6Å; W206-V267 HydrophobicContact CE3-CB 4.5Å; W206-V267 HydrophobicContact CE3-CG1 4.03Å; W206-V267 HydrophobicContact CE3-CG2 3.8Å; W206-V267 HydrophobicContact CG-CG2 4.04Å; W206-V267 HydrophobicContact CH2-CG2 4.19Å; W206-V267 HydrophobicContact CZ2-CG2 4.05Å; W206-V267 HydrophobicContact CZ3-CG1 4.15Å; W206-V267 HydrophobicContact CZ3-CG2 4.08Å; V209-V267 HydrophobicContact CG1-CB 3.96Å; V209-V267 HydrophobicContact CG1-CG1 4.09Å; S210-V267 PolarHBondContact N-O 3.03Å; A265-V267 VanDerWaalsContact C-N 3.31Å; V267-I292 WeakPolarHBondContact CA-O 3.4Å; V267-I292 HydrophobicContact CG2-CB 4.14Å; V267-I292 HydrophobicContact CG2-CG2 4.44Å; V267-V294 HydrophobicContact CG1-CG2 3.77Å; V267-S507 PolarHBondContact N-OG 3.18Å
268	A	96.9	Very high	91.7	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.008	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	121.1	177.2	0	0	0	0	0	111	S210 F291 I292 W293 V294	S210-A268 CarbonylContact O-C 3.48Å; S210-A268 WeakPolarHBondContact O-CA 3.38Å; A268-F291 HydrophobicContact CB-CB 4.32Å; A268-I292 PolarHBondContact N-O 2.87Å; A268-W293 HydrophobicContact CB-CE3 3.77Å; A268-W293 HydrophobicContact CB-CZ3 3.78Å; A268-W293 WeakPolarHBondContact O-CA 3.44Å; A268-V294 PolarHBondContact O-N 3.11Å
269	V	98	Very high	91.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	124.9	-179.4	175.6	0	0	0	0	109.9	M197 L201 V209 S210 T211 V212 I223 F226 F271 V294	M197-V269 HydrophobicContact CE-CG1 3.61Å; L201-V269 HydrophobicContact CD1-CG2 4.02Å; L201-V269 HydrophobicContact CD2-CG2 4.38Å; V209-V269 HydrophobicContact CB-CG2 4.42Å; V209-V269 HydrophobicContact CG2-CG2 4.17Å; S210-V269 PolarHBondContact O-N 2.92Å; T211-V269 CarbonylContact C-O 3.58Å; T211-V269 WeakPolarHBondContact CA-O 3.37Å; T211-V269 HydrophobicContact CG2-CB 4.15Å; V212-V269 PolarHBondContact N-O 2.89Å; I223-V269 HydrophobicContact CD1-CG1 4.14Å; F226-V269 HydrophobicContact CD1-CG1 3.98Å; F226-V269 HydrophobicContact CD2-CG1 4.17Å; F226-V269 HydrophobicContact CE1-CB 4.16Å; F226-V269 HydrophobicContact CE1-CG1 3.88Å; F226-V269 HydrophobicContact CE1-CG2 4.07Å; F226-V269 HydrophobicContact CE2-CG1 4.05Å; F226-V269 HydrophobicContact CE2-CG2 4.25Å; F226-V269 HydrophobicContact CG-CG1 4.14Å; F226-V269 HydrophobicContact CZ-CB 4.22Å; F226-V269 HydrophobicContact CZ-CG1 3.93Å; F226-V269 HydrophobicContact CZ-CG2 3.69Å; V269-F271 HydrophobicContact CG1-CD2 4.44Å; V269-V294 CarbonylContact C-O 3.59Å; V269-V294 VanDerWaalsContact CA-O 3.31Å; V269-V294 WeakPolarHBondContact CA-O 3.31Å; V269-V294 HydrophobicContact CG2-CB 4.39Å
270	L	97.1	Very high	91.5	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	112.3	-169.8	-54.1	-175.5	0	0	0	112.6	V212 L272 L280 W293 V294 A295 S296 W299	V212-L270 HydrophobicContact CB-CD2 3.75Å; V212-L270 HydrophobicContact CG2-CD2 3.81Å; L270-L272 HydrophobicContact CB-CD1 4.19Å; L270-L272 HydrophobicContact CB-CG 4.09Å; L270-L272 HydrophobicContact CD1-CD1 4.23Å; L270-L272 HydrophobicContact CD2-CD1 4.09Å; L270-L272 HydrophobicContact CG-CD1 4.41Å; L270-L280 HydrophobicContact CD2-CD2 4.03Å; L270-W293 HydrophobicContact CD1-CB 4.25Å; L270-W293 HydrophobicContact CD1-CD2 4.25Å; L270-W293 HydrophobicContact CD1-CE3 3.67Å; L270-W293 HydrophobicContact CD1-CZ3 4.37Å; L270-W293 HydrophobicContact CD2-CE3 4.08Å; L270-W293 HydrophobicContact CD2-CZ3 4.25Å; L270-W293 HydrophobicContact CG-CE3 4.12Å; L270-V294 PolarHBondContact N-O 2.84Å; L270-A295 HydrophobicContact CB-CB 4.05Å; L270-A295 HydrophobicContact CD1-CB 4.41Å; L270-S296 PolarHBondContact O-N 3.45Å; L270-S296 PolarHBondContact O-OG 3.49Å; L270-W299 HydrophobicContact CD1-CE3 3.95Å; L270-W299 HydrophobicContact CD1-CZ3 3.74Å
271	F	95.8	Very high	91.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	68.8	165.1	-88.6	-90.4	0	0	0	109.8	Q193 A194 M197 V212 A213 S214 G219 I223 F226 V269	Q193-F271 HydrophobicContact CG-CE1 4.46Å; Q193-F271 HydrophobicContact CG-CZ 4.37Å; Q193-F271 VanDerWaalsContact OE1-CE1 3.24Å; A194-F271 HydrophobicContact CB-CZ 4.25Å; M197-F271 HydrophobicContact CE-CD2 4.43Å; M197-F271 HydrophobicContact CE-CE2 4Å; M197-F271 HydrophobicContact SD-CD2 4.28Å; M197-F271 HydrophobicContact SD-CE1 4.5Å; M197-F271 HydrophobicContact SD-CE2 3.38Å; M197-F271 WeakPolarHBondContact SD-CE2 3.35Å; M197-F271 HydrophobicContact SD-CZ 3.53Å; M197-F271 VanDerWaalsContact SD-CZ 3.53Å; V212-F271 PolarHBondContact O-N 3.38Å; A213-F271 WeakPolarHBondContact CA-O 3.45Å; S214-F271 PolarHBondContact N-O 3.14Å; G219-F271 VanDerWaalsContact CA-O 3.3Å; G219-F271 WeakPolarHBondContact CA-O 3.46Å; I223-F271 HydrophobicContact CB-CB 4.32Å; I223-F271 HydrophobicContact CB-CD2 4.45Å; I223-F271 HydrophobicContact CD1-CB 4.34Å; I223-F271 HydrophobicContact CD1-CD2 3.6Å; I223-F271 HydrophobicContact CD1-CE2 4.39Å; I223-F271 HydrophobicContact CD1-CG 4.37Å; F226-F271 HydrophobicContact CB-CE2 3.81Å; F226-F271 HydrophobicContact CB-CZ 4.49Å; F226-F271 HydrophobicContact CG-CE2 4.35Å; V269-F271 HydrophobicContact CG1-CD2 4.44Å
272	L	92	Very high	91.6	Very high	3 Å²	3	27.7 Å²	27.7	2%	0.016	14%	0.138	C	C	.	.			trans	-114.5	148.3	-172.6	-59.7	-177.1	0	0	0	111.9	V212 A213 S214 V243 L270 A277 L280 G298	V212-L272 HydrophobicContact CB-CD2 4.43Å; V212-L272 HydrophobicContact CG1-CD2 4.05Å; A213-L272 VanDerWaalsContact C-CD2 3.45Å; S214-L272 VanDerWaalsContact N-CD2 3.32Å; S214-L272 WeakPolarHBondContact OG-CA 3.34Å; V243-L272 HydrophobicContact CG2-CD2 3.47Å; V243-L272 VanDerWaalsContact CG2-CD2 3.47Å; L270-L272 HydrophobicContact CB-CD1 4.19Å; L270-L272 HydrophobicContact CB-CG 4.09Å; L270-L272 HydrophobicContact CD1-CD1 4.23Å; L270-L272 HydrophobicContact CD2-CD1 4.09Å; L270-L272 HydrophobicContact CG-CD1 4.41Å; L272-A277 HydrophobicContact CB-CB 4.09Å; L272-A277 HydrophobicContact CD1-CB 4.34Å; L272-L280 HydrophobicContact CD1-CB 4.37Å; L272-L280 HydrophobicContact CD1-CD2 3.49Å; L272-L280 VanDerWaalsContact CD1-CD2 3.49Å; L272-G298 WeakPolarHBondContact O-CA 3.42Å
273	R	87.6	Confident	91.7	Very high	45 Å²	45	24.4 Å²	24.4	17%	0.17	12%	0.123	C	C	.	.			trans	-70.5	155.5	162.7	-58.3	178.5	-59.8	148.1	11.9	108.9	S214 Y218 D275 D276 A277	S214-R273 PolarHBondContact OG-N 3.39Å; Y218-R273 HydrophobicContact CD1-CG 4.3Å; R273-D275 VanDerWaalsContact C-N 3.25Å; R273-D275 PolarHBondContact O-N 3.05Å; R273-D276 IonicContact CZ-OD2 3.17Å; R273-D276 VanDerWaalsContact CZ-OD2 3.3Å; R273-D276 IonicContact NE-OD2 3.27Å; R273-D276 PolarHBondContact NE-OD2 3.46Å; R273-D276 IonicContact NH2-OD1 2.66Å; R273-D276 PolarHBondContact NH2-OD1 3.22Å; R273-D276 IonicContact NH2-OD2 3.67Å; R273-D276 PolarHBondContact NH2-OD2 2.94Å; R273-D276 PolarHBondContact O-N 3.33Å; R273-D276 VanDerWaalsContact O-N 3.14Å; R273-A277 WeakPolarHBondContact O-CB 3.49Å; R273-A277 PolarHBondContact O-N 3.07Å
274	S	85.3	Confident	91.9	Very high	8 Å²	8	20.1 Å²	20.1	6%	0.056	10%	0.096	C	C	.	.	H	α-helix	trans	-48	-46.2	179	42.9	0	0	0	0	114.1	R60 D276 A277 R278	R60-S274 PolarHBondContact NH1-OG 3.44Å; R60-S274 VanDerWaalsContact NH2-CB 3.31Å; S274-D276 VanDerWaalsContact C-N 3.32Å; S274-D276 PolarHBondContact O-N 3.06Å; S274-A277 PolarHBondContact O-N 3.15Å; S274-R278 WeakPolarHBondContact O-CB 3.24Å; S274-R278 PolarHBondContact O-N 3.14Å
275	D	83.2	Confident	92.1	Very high	30 Å²	30	17.3 Å²	17.3	16%	0.16	8%	0.083	C	C	.	.	H	α-helix	trans	-70.1	-38.3	-171.8	-44.1	-19.9	0	0	0	109.8	R273 E279	R273-D275 VanDerWaalsContact C-N 3.25Å; R273-D275 PolarHBondContact O-N 3.05Å; D275-E279 WeakPolarHBondContact O-CG 3.44Å; D275-E279 PolarHBondContact O-N 3.49Å
276	D	87.9	Confident	92	Very high	9 Å²	9	23.4 Å²	23.4	5%	0.048	11%	0.106	C	C	.	.	H	α-helix	trans	-72.8	-37.6	177.4	-54.5	-33.5	0	0	0	110.6	S214 V243 Y252 R273 S274 L280	S214-D276 VanDerWaalsContact CB-OD2 3.31Å; S214-D276 WeakPolarHBondContact CB-OD2 3.48Å; S214-D276 WeakPolarHBondContact OG-CB 3.25Å; S214-D276 PolarHBondContact OG-OD2 3.28Å; V243-D276 HydrophobicContact CG2-CB 4.06Å; Y252-D276 HydrophobicContact CE1-CB 4.36Å; Y252-D276 PolarHBondContact OH-OD1 3.41Å; Y252-D276 VanDerWaalsContact OH-OD1 3.04Å; R273-D276 IonicContact CZ-OD2 3.17Å; R273-D276 VanDerWaalsContact CZ-OD2 3.3Å; R273-D276 IonicContact NE-OD2 3.27Å; R273-D276 PolarHBondContact NE-OD2 3.46Å; R273-D276 IonicContact NH2-OD1 2.66Å; R273-D276 PolarHBondContact NH2-OD1 3.22Å; R273-D276 IonicContact NH2-OD2 3.67Å; R273-D276 PolarHBondContact NH2-OD2 2.94Å; R273-D276 PolarHBondContact O-N 3.33Å; R273-D276 VanDerWaalsContact O-N 3.14Å; S274-D276 VanDerWaalsContact C-N 3.32Å; S274-D276 PolarHBondContact O-N 3.06Å; D276-L280 VanDerWaalsContact O-CB 3.27Å; D276-L280 WeakPolarHBondContact O-CB 3.16Å; D276-L280 PolarHBondContact O-N 3Å
277	A	91.7	Very high	91.9	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.008	10%	0.1	C	C	.	.	H	α-helix	trans	-62.3	-47.2	174.6	0	0	0	0	0	111.7	L272 R273 S274 E279 L280 I281 W299 I305	L272-A277 HydrophobicContact CB-CB 4.09Å; L272-A277 HydrophobicContact CD1-CB 4.34Å; R273-A277 WeakPolarHBondContact O-CB 3.49Å; R273-A277 PolarHBondContact O-N 3.07Å; S274-A277 PolarHBondContact O-N 3.15Å; A277-E279 PolarHBondContact O-N 2.99Å; A277-L280 PolarHBondContact O-N 2.74Å; A277-I281 VanDerWaalsContact O-CG1 3.26Å; A277-I281 WeakPolarHBondContact O-CG1 3.38Å; A277-I281 PolarHBondContact O-N 3.33Å; A277-W299 HydrophobicContact CB-CE3 4.43Å; A277-I305 HydrophobicContact CB-CG2 4.07Å
278	R	90.1	Very high	91.6	Very high	85 Å²	85	29.2 Å²	29.2	32%	0.321	14%	0.14	S	C	.	.	H	α-helix	trans	-58.4	-47.6	177.4	-177.8	177.4	68.5	-155.8	-2	111.8	S274 A282 I305	S274-R278 WeakPolarHBondContact O-CB 3.24Å; S274-R278 PolarHBondContact O-N 3.14Å; R278-A282 WeakPolarHBondContact O-CB 3.39Å; R278-A282 PolarHBondContact O-N 3.14Å; R278-I305 HydrophobicContact CB-CG2 4.38Å
279	E	88.9	Confident	91	Very high	54 Å²	54	30.1 Å²	30.1	25%	0.252	15%	0.145	S	C	.	.	H	α-helix	trans	-68.7	-34.8	179.4	-68.3	-62.1	140.7	0	0	112.5	Y252 D275 A277 A282 A283	Y252-E279 HydrophobicContact CD2-CB 3.73Å; Y252-E279 HydrophobicContact CE1-CB 4.32Å; Y252-E279 HydrophobicContact CE2-CB 3.49Å; Y252-E279 VanDerWaalsContact CE2-CB 3.49Å; Y252-E279 HydrophobicContact CE2-CG 4.11Å; Y252-E279 HydrophobicContact CG-CB 4.3Å; D275-E279 WeakPolarHBondContact O-CG 3.44Å; D275-E279 PolarHBondContact O-N 3.49Å; A277-E279 PolarHBondContact O-N 2.99Å; E279-A282 PolarHBondContact O-N 3.26Å; E279-A283 WeakPolarHBondContact O-CB 3.28Å; E279-A283 PolarHBondContact O-N 3.43Å
280	L	92	Very high	90.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-66.8	-45.3	176.5	-173.8	71.5	0	0	0	111.8	V212 Y252 V255 I256 L270 L272 D276 A277 A282 A283 A284	V212-L280 HydrophobicContact CB-CD2 4.45Å; V212-L280 HydrophobicContact CG1-CD2 4.19Å; V212-L280 HydrophobicContact CG2-CD2 4.41Å; Y252-L280 HydrophobicContact CD1-CB 4.2Å; Y252-L280 HydrophobicContact CD1-CD1 4.12Å; V255-L280 HydrophobicContact CB-CD1 4.49Å; V255-L280 HydrophobicContact CG1-CD1 4.11Å; I256-L280 HydrophobicContact CD1-CD1 3.62Å; I256-L280 HydrophobicContact CD1-CG 4.02Å; I256-L280 HydrophobicContact CG1-CD1 3.96Å; L270-L280 HydrophobicContact CD2-CD2 4.03Å; L272-L280 HydrophobicContact CD1-CB 4.37Å; L272-L280 HydrophobicContact CD1-CD2 3.49Å; L272-L280 VanDerWaalsContact CD1-CD2 3.49Å; D276-L280 VanDerWaalsContact O-CB 3.27Å; D276-L280 WeakPolarHBondContact O-CB 3.16Å; D276-L280 PolarHBondContact O-N 3Å; A277-L280 PolarHBondContact O-N 2.74Å; L280-A282 VanDerWaalsContact C-N 3.34Å; L280-A282 PolarHBondContact O-N 3.41Å; L280-A283 WeakPolarHBondContact O-CB 3.48Å; L280-A283 PolarHBondContact O-N 3.4Å; L280-A284 PolarHBondContact O-N 3.1Å
281	I	93.5	Very high	90.1	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-62.8	-43.2	175.6	-61.5	165.8	0	0	0	110.1	A277 A283 A284 A285 W299 I305 V306 N309 T312	A277-I281 VanDerWaalsContact O-CG1 3.26Å; A277-I281 WeakPolarHBondContact O-CG1 3.38Å; A277-I281 PolarHBondContact O-N 3.33Å; I281-A283 VanDerWaalsContact C-N 3.29Å; I281-A283 PolarHBondContact O-N 3.19Å; I281-A284 PolarHBondContact O-N 2.78Å; I281-A285 PolarHBondContact O-N 2.84Å; I281-W299 HydrophobicContact CD1-CD2 4.36Å; I281-W299 HydrophobicContact CD1-CE3 4.03Å; I281-W299 HydrophobicContact CD1-CH2 3.13Å; I281-W299 HydrophobicContact CD1-CZ2 3.48Å; I281-W299 VanDerWaalsContact CD1-CZ2 3.48Å; I281-W299 HydrophobicContact CD1-CZ3 3.42Å; I281-W299 VanDerWaalsContact CD1-CZ3 3.42Å; I281-W299 HydrophobicContact CG1-CH2 3.82Å; I281-W299 HydrophobicContact CG1-CZ3 3.89Å; I281-I305 HydrophobicContact CD1-CG2 3.83Å; I281-V306 HydrophobicContact CD1-CG1 4.32Å; I281-N309 HydrophobicContact CG2-CB 3.68Å; I281-T312 HydrophobicContact CG2-CG2 4.12Å
282	A	92	Very high	90	Very high	11 Å²	11	36.2 Å²	36.2	9%	0.091	19%	0.185	C	C	.	.	H	α-helix	trans	-62.2	-36.3	176	0	0	0	0	0	112.2	R278 E279 L280 R286	R278-A282 WeakPolarHBondContact O-CB 3.39Å; R278-A282 PolarHBondContact O-N 3.14Å; E279-A282 PolarHBondContact O-N 3.26Å; L280-A282 VanDerWaalsContact C-N 3.34Å; L280-A282 PolarHBondContact O-N 3.41Å; A282-R286 VanDerWaalsContact O-CG 3.31Å; A282-R286 WeakPolarHBondContact O-CG 3.42Å; A282-R286 PolarHBondContact O-N 2.88Å; A282-R286 VanDerWaalsContact O-N 3.09Å
283	A	91.8	Very high	90.2	Very high	1 Å²	1	36 Å²	36	1%	0.008	18%	0.184	C	C	.	.	H	α-helix	trans	-67.4	-41.7	173.8	0	0	0	0	0	111.9	E253 I256 E279 L280 I281 A285 R286 L287	E253-A283 HydrophobicContact CG-CB 4.27Å; I256-A283 HydrophobicContact CG1-CB 4.35Å; E279-A283 WeakPolarHBondContact O-CB 3.28Å; E279-A283 PolarHBondContact O-N 3.43Å; L280-A283 WeakPolarHBondContact O-CB 3.48Å; L280-A283 PolarHBondContact O-N 3.4Å; I281-A283 VanDerWaalsContact C-N 3.29Å; I281-A283 PolarHBondContact O-N 3.19Å; A283-A285 VanDerWaalsContact C-N 3.33Å; A283-A285 PolarHBondContact O-N 3.31Å; A283-R286 PolarHBondContact O-N 3.04Å; A283-L287 WeakPolarHBondContact O-CG 3.4Å; A283-L287 PolarHBondContact O-N 3.31Å
284	A	93.1	Very high	90.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.8	-40.6	174.8	0	0	0	0	0	112	I256 L280 I281 L287 N288 T289 W293 T312	I256-A284 HydrophobicContact CD1-CB 3.89Å; I256-A284 HydrophobicContact CG1-CB 4.25Å; L280-A284 PolarHBondContact O-N 3.1Å; I281-A284 PolarHBondContact O-N 2.78Å; A284-L287 CarbonylContact O-C 3.54Å; A284-L287 PolarHBondContact O-N 3.24Å; A284-N288 PolarHBondContact O-N 2.03Å; A284-N288 VanDerWaalsContact O-N 3.16Å; A284-T289 PolarHBondContact O-N 3.13Å; A284-T289 PolarHBondContact O-OG1 3.39Å; A284-W293 HydrophobicContact CB-CH2 4.29Å; A284-W293 HydrophobicContact CB-CZ2 4.03Å; A284-T312 HydrophobicContact CB-CG2 3.75Å
285	A	93.4	Very high	91.3	Very high	20 Å²	20	33.6 Å²	33.6	17%	0.165	17%	0.174	C	C	.	.	H	α-helix	trans	-62.9	-43.3	175.3	0	0	0	0	0	112.2	I281 A283 L287 N288 N309 T312	I281-A285 PolarHBondContact O-N 2.84Å; A283-A285 VanDerWaalsContact C-N 3.33Å; A283-A285 PolarHBondContact O-N 3.31Å; A285-L287 PolarHBondContact O-N 3.48Å; A285-N288 PolarHBondContact O-N 3.47Å; A285-N288 VanDerWaalsContact O-N 3.08Å; A285-N288 PolarHBondContact O-OD1 3Å; A285-N309 HydrophobicContact CB-CB 4.26Å; A285-N309 WeakPolarHBondContact CB-OD1 3.34Å; A285-T312 HydrophobicContact CB-CG2 4.46Å; A285-T312 WeakPolarHBondContact CB-OG1 3.16Å
286	R	92.1	Very high	91.9	Very high	130 Å²	130	32.2 Å²	32.2	49%	0.491	17%	0.166	S	C	.	.	H	α-helix	trans	-62.7	-30	176.5	-72.2	173.4	-166.5	154.9	13.8	113.3	A282 A283 N288	A282-R286 VanDerWaalsContact O-CG 3.31Å; A282-R286 WeakPolarHBondContact O-CG 3.42Å; A282-R286 PolarHBondContact O-N 2.88Å; A282-R286 VanDerWaalsContact O-N 3.09Å; A283-R286 PolarHBondContact O-N 3.04Å; R286-N288 VanDerWaalsContact C-N 3.35Å
287	L	91.3	Very high	92.1	Very high	54 Å²	54	32 Å²	32	28%	0.283	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	1.4	177.9	-64.7	175.1	0	0	0	112.9	E253 I256 R257 A283 A284 A285 T289	E253-L287 HydrophobicContact CB-CD1 4.2Å; E253-L287 HydrophobicContact CG-CD1 4.33Å; I256-L287 HydrophobicContact CB-CD1 3.84Å; I256-L287 HydrophobicContact CG2-CD1 3.61Å; R257-L287 HydrophobicContact CG-CD1 4.34Å; A283-L287 WeakPolarHBondContact O-CG 3.4Å; A283-L287 PolarHBondContact O-N 3.31Å; A284-L287 CarbonylContact O-C 3.54Å; A284-L287 PolarHBondContact O-N 3.24Å; A285-L287 PolarHBondContact O-N 3.48Å; L287-T289 HydrophobicContact CB-CG2 4.19Å; L287-T289 PolarHBondContact O-N 3.1Å
288	N	89.2	Confident	91.9	Very high	157 Å²	157	32.3 Å²	32.3	84%	0.84	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	52	38.9	-175.2	-68.4	-25.3	0	0	0	113.1	A284 A285 R286	A284-N288 PolarHBondContact O-N 2.03Å; A284-N288 VanDerWaalsContact O-N 3.16Å; A285-N288 PolarHBondContact O-N 3.47Å; A285-N288 VanDerWaalsContact O-N 3.08Å; A285-N288 PolarHBondContact O-OD1 3Å; R286-N288 VanDerWaalsContact C-N 3.35Å
289	T	85.7	Confident	92	Very high	20 Å²	20	28.4 Å²	28.4	12%	0.123	15%	0.154	C	C	.	.			trans	-110	138.3	177.9	55.7	0	0	0	0	110.7	I256 F260 A284 L287	I256-T289 HydrophobicContact CG2-CG2 4.4Å; I256-T289 WeakPolarHBondContact CG2-OG1 3.22Å; F260-T289 HydrophobicContact CD2-CG2 3.96Å; F260-T289 HydrophobicContact CE2-CG2 4.22Å; A284-T289 PolarHBondContact O-N 3.13Å; A284-T289 PolarHBondContact O-OG1 3.39Å; L287-T289 HydrophobicContact CB-CG2 4.19Å; L287-T289 PolarHBondContact O-N 3.1Å
290	S	83.2	Confident	92.1	Very high	98 Å²	98	25.8 Å²	25.8	69%	0.685	14%	0.142	S	C	*	.			trans	-121.2	134.3	174.9	64.4	0	0	0	0	110.6
291	F	92.1	Very high	92	Very high	19 Å²	19	27 Å²	27	8%	0.083	15%	0.152	C	C	.	.			trans	-123.9	160.2	170	-62.9	-90.5	0	0	0	108.5	I256 L259 F260 A268 W293	I256-F291 HydrophobicContact CG2-CE2 4.4Å; L259-F291 HydrophobicContact CB-CE1 4.08Å; L259-F291 HydrophobicContact CB-CE2 4.41Å; L259-F291 HydrophobicContact CB-CZ 3.75Å; F260-F291 HydrophobicContact CD2-CZ 4.5Å; A268-F291 HydrophobicContact CB-CB 4.32Å; F291-W293 HydrophobicContact CB-CD2 4.25Å; F291-W293 HydrophobicContact CB-CE3 4.2Å; F291-W293 HydrophobicContact CB-CH2 3.96Å; F291-W293 HydrophobicContact CB-CZ2 3.97Å; F291-W293 HydrophobicContact CB-CZ3 4.07Å; F291-W293 AromaticContact CD2-CH2 3.53Å; F291-W293 HydrophobicContact CD2-CH2 3.53Å; F291-W293 AromaticContact CD2-CZ2 3.86Å; F291-W293 HydrophobicContact CD2-CZ2 3.86Å; F291-W293 HydrophobicContact CD2-CZ3 4.21Å; F291-W293 HydrophobicContact CE2-CH2 4.43Å; F291-W293 HydrophobicContact CG-CH2 4.1Å; F291-W293 HydrophobicContact CG-CZ2 4.39Å; F291-W293 HydrophobicContact CG-CZ3 4.39Å; F291-W293 PolarHBondContact O-N 2.88Å; F291-W293 PolarHBondContact O-NE1 3Å
292	I	94.9	Very high	91.6	Very high	13 Å²	13	28 Å²	28	7%	0.067	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	114.9	162.6	-61.6	-52.9	0	0	0	107.9	W206 H266 V267 A268 W499 P500 P505	W206-I292 HydrophobicContact CH2-CG2 3.81Å; W206-I292 HydrophobicContact CZ2-CG2 4.4Å; W206-I292 HydrophobicContact CZ3-CG2 4.47Å; H266-I292 PolarHBondContact O-N 3.17Å; V267-I292 WeakPolarHBondContact CA-O 3.4Å; V267-I292 HydrophobicContact CG2-CB 4.14Å; V267-I292 HydrophobicContact CG2-CG2 4.44Å; A268-I292 PolarHBondContact N-O 2.87Å; I292-W499 HydrophobicContact CD1-CE3 4.12Å; I292-W499 HydrophobicContact CD1-CZ3 4.27Å; I292-W499 HydrophobicContact CG1-CZ3 4.48Å; I292-W499 HydrophobicContact CG2-CZ3 3.97Å; I292-P500 HydrophobicContact CD1-CG 4.45Å; I292-P505 HydrophobicContact CD1-CG 4.12Å; I292-P505 HydrophobicContact CG1-CB 4.44Å; I292-P505 HydrophobicContact CG1-CG 3.47Å; I292-P505 VanDerWaalsContact CG1-CG 3.47Å
293	W	96.1	Very high	91.3	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	129.3	-179.7	-48.5	104.7	0	0	0	109.9	I256 A268 L270 A284 F291 W299 T312 A316 I317	I256-W293 HydrophobicContact CD1-CH2 4.11Å; A268-W293 HydrophobicContact CB-CE3 3.77Å; A268-W293 HydrophobicContact CB-CZ3 3.78Å; A268-W293 WeakPolarHBondContact O-CA 3.44Å; L270-W293 HydrophobicContact CD1-CB 4.25Å; L270-W293 HydrophobicContact CD1-CD2 4.25Å; L270-W293 HydrophobicContact CD1-CE3 3.67Å; L270-W293 HydrophobicContact CD1-CZ3 4.37Å; L270-W293 HydrophobicContact CD2-CE3 4.08Å; L270-W293 HydrophobicContact CD2-CZ3 4.25Å; L270-W293 HydrophobicContact CG-CE3 4.12Å; A284-W293 HydrophobicContact CB-CH2 4.29Å; A284-W293 HydrophobicContact CB-CZ2 4.03Å; F291-W293 HydrophobicContact CB-CD2 4.25Å; F291-W293 HydrophobicContact CB-CE3 4.2Å; F291-W293 HydrophobicContact CB-CH2 3.96Å; F291-W293 HydrophobicContact CB-CZ2 3.97Å; F291-W293 HydrophobicContact CB-CZ3 4.07Å; F291-W293 AromaticContact CD2-CH2 3.53Å; F291-W293 HydrophobicContact CD2-CH2 3.53Å; F291-W293 AromaticContact CD2-CZ2 3.86Å; F291-W293 HydrophobicContact CD2-CZ2 3.86Å; F291-W293 HydrophobicContact CD2-CZ3 4.21Å; F291-W293 HydrophobicContact CE2-CH2 4.43Å; F291-W293 HydrophobicContact CG-CH2 4.1Å; F291-W293 HydrophobicContact CG-CZ2 4.39Å; F291-W293 HydrophobicContact CG-CZ3 4.39Å; F291-W293 PolarHBondContact O-N 2.88Å; F291-W293 PolarHBondContact O-NE1 3Å; W293-W299 HydrophobicContact CB-CH2 4.16Å; W293-W299 HydrophobicContact CB-CZ3 3.96Å; W293-W299 HydrophobicContact CG-CH2 4.09Å; W293-W299 HydrophobicContact CG-CZ3 4.08Å; W293-T312 PolarHBondContact NE1-O 3.36Å; W293-A316 HydrophobicContact CB-CB 3.88Å; W293-A316 HydrophobicContact CG-CB 4.45Å; W293-A316 CarbonylContact O-C 3.56Å; W293-A316 WeakPolarHBondContact O-CA 3.39Å; W293-I317 PolarHBondContact O-N 3.3Å
294	V	97.8	Very high	91	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	105.1	167.3	-177.7	0	0	0	0	107.4	M197 L201 W206 V267 A268 V269 L270 I317	M197-V294 HydrophobicContact CE-CG1 3.89Å; M197-V294 WeakPolarHBondContact CE-O 3.38Å; M197-V294 HydrophobicContact CG-CG1 4.43Å; L201-V294 HydrophobicContact CD2-CG2 3.99Å; W206-V294 HydrophobicContact CZ3-CG2 4.02Å; V267-V294 HydrophobicContact CG1-CG2 3.77Å; A268-V294 PolarHBondContact O-N 3.11Å; V269-V294 CarbonylContact C-O 3.59Å; V269-V294 VanDerWaalsContact CA-O 3.31Å; V269-V294 WeakPolarHBondContact CA-O 3.31Å; V269-V294 HydrophobicContact CG2-CB 4.39Å; L270-V294 PolarHBondContact N-O 2.84Å; V294-I317 CarbonylContact C-O 3.57Å; V294-I317 VanDerWaalsContact CA-O 3.24Å; V294-I317 WeakPolarHBondContact CA-O 3.45Å
295	A	96.8	Very high	90.7	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.008	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	145.7	-167.2	0	0	0	0	0	113.9	L270 W299 I317 T318 L319	L270-A295 HydrophobicContact CB-CB 4.05Å; L270-A295 HydrophobicContact CD1-CB 4.41Å; A295-W299 HydrophobicContact CB-CB 3.81Å; A295-W299 HydrophobicContact CB-CD2 4.06Å; A295-W299 HydrophobicContact CB-CE3 3.65Å; A295-W299 HydrophobicContact CB-CG 4.19Å; A295-W299 HydrophobicContact CB-CZ3 4.44Å; A295-I317 PolarHBondContact N-O 3.21Å; A295-T318 HydrophobicContact CB-CG2 4.08Å; A295-T318 WeakPolarHBondContact O-CA 3.34Å; A295-L319 PolarHBondContact O-N 3.12Å
296	S	95.5	Very high	90.7	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.007	17%	0.173	C	C	.	.			trans	-67.1	175.7	168.9	56.5	0	0	0	0	112.8	Y218 L270 G298 W299 G300 L319	Y218-S296 VanDerWaalsContact OH-CB 3.25Å; Y218-S296 WeakPolarHBondContact OH-CB 3.45Å; Y218-S296 PolarHBondContact OH-OG 2.96Å; L270-S296 PolarHBondContact O-N 3.45Å; L270-S296 PolarHBondContact O-OG 3.49Å; S296-G298 PolarHBondContact O-N 3.42Å; S296-W299 PolarHBondContact O-N 3.43Å; S296-G300 PolarHBondContact O-N 3.4Å; S296-L319 CarbonylContact C-O 3.51Å
297	D	92.1	Very high	90.5	Very high	5 Å²	5	33.1 Å²	33.1	3%	0.027	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-7.1	-179.4	78.5	-51.7	0	0	0	114.1	Q193 Y218 W299 L319 K390	Q193-D297 PolarHBondContact NE2-OD1 2.97Å; Y218-D297 PolarHBondContact OH-OD1 3.06Å; D297-W299 PolarHBondContact O-N 3.24Å; D297-L319 WeakPolarHBondContact CA-O 3.36Å; D297-L319 PolarHBondContact N-O 3.43Å; D297-K390 VanDerWaalsContact OD2-CE 3.26Å; D297-K390 WeakPolarHBondContact OD2-CE 3.44Å; D297-K390 IonicContact OD2-NZ 3.8Å; D297-K390 PolarHBondContact OD2-NZ 2.95Å
298	G	89.1	Confident	90.5	Very high	8 Å²	8	33.2 Å²	33.2	8%	0.082	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-34	163.5	0	0	0	0	0	112.3	R60 Y218 L272 S296	R60-G298 PolarHBondContact NH2-O 3.47Å; Y218-G298 PolarHBondContact OH-N 3.47Å; L272-G298 WeakPolarHBondContact O-CA 3.42Å; S296-G298 PolarHBondContact O-N 3.42Å
299	W	91.9	Very high	90.6	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.008	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-58.3	166.5	-171.6	-34	0	0	0	110.5	L270 A277 I281 W293 A295 S296 D297 I305 V306 A313 A316 T318 Y480	L270-W299 HydrophobicContact CD1-CE3 3.95Å; L270-W299 HydrophobicContact CD1-CZ3 3.74Å; A277-W299 HydrophobicContact CB-CE3 4.43Å; I281-W299 HydrophobicContact CD1-CD2 4.36Å; I281-W299 HydrophobicContact CD1-CE3 4.03Å; I281-W299 HydrophobicContact CD1-CH2 3.13Å; I281-W299 HydrophobicContact CD1-CZ2 3.48Å; I281-W299 VanDerWaalsContact CD1-CZ2 3.48Å; I281-W299 HydrophobicContact CD1-CZ3 3.42Å; I281-W299 VanDerWaalsContact CD1-CZ3 3.42Å; I281-W299 HydrophobicContact CG1-CH2 3.82Å; I281-W299 HydrophobicContact CG1-CZ3 3.89Å; W293-W299 HydrophobicContact CB-CH2 4.16Å; W293-W299 HydrophobicContact CB-CZ3 3.96Å; W293-W299 HydrophobicContact CG-CH2 4.09Å; W293-W299 HydrophobicContact CG-CZ3 4.08Å; A295-W299 HydrophobicContact CB-CB 3.81Å; A295-W299 HydrophobicContact CB-CD2 4.06Å; A295-W299 HydrophobicContact CB-CE3 3.65Å; A295-W299 HydrophobicContact CB-CG 4.19Å; A295-W299 HydrophobicContact CB-CZ3 4.44Å; S296-W299 PolarHBondContact O-N 3.43Å; D297-W299 PolarHBondContact O-N 3.24Å; W299-I305 HydrophobicContact CB-CD1 4.29Å; W299-I305 HydrophobicContact CD2-CG2 4.13Å; W299-I305 HydrophobicContact CG-CD1 4.2Å; W299-I305 HydrophobicContact CG-CG2 4.23Å; W299-I305 WeakPolarHBondContact O-CD1 3.41Å; W299-V306 HydrophobicContact CH2-CG1 4.48Å; W299-V306 HydrophobicContact CZ2-CG1 3.42Å; W299-V306 VanDerWaalsContact CZ2-CG1 3.42Å; W299-A313 HydrophobicContact CH2-CB 4.25Å; W299-A313 HydrophobicContact CZ2-CB 4.03Å; W299-A316 HydrophobicContact CH2-CB 4.18Å; W299-A316 HydrophobicContact CZ2-CB 4.25Å; W299-T318 HydrophobicContact CD2-CG2 4.16Å; W299-T318 HydrophobicContact CG-CG2 4.07Å; W299-Y480 AromaticContact NE1-CE1 4Å; W299-Y480 AromaticContact NE1-CZ 3.79Å; W299-Y480 PolarHBondContact NE1-OH 3.01Å
300	G	91	Very high	91	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	-143.7	-177.4	0	0	0	0	0	112.9	S296 T318	S296-G300 PolarHBondContact O-N 3.4Å; G300-T318 VanDerWaalsContact O-CB 3.29Å; G300-T318 WeakPolarHBondContact O-CB 3.46Å; G300-T318 PolarHBondContact O-OG1 3.23Å
301	A	89	Confident	91.3	Very high	25 Å²	25	30.5 Å²	30.5	21%	0.207	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	39.2	176.9	0	0	0	0	0	112.5	F469 Y480	A301-F469 HydrophobicContact CB-CD1 4.41Å; A301-F469 HydrophobicContact CB-CD2 4.09Å; A301-F469 HydrophobicContact CB-CE2 4.26Å; A301-F469 HydrophobicContact CB-CG 4.16Å; A301-Y480 VanDerWaalsContact C-CE2 3.46Å; A301-Y480 HydrophobicContact CB-CD1 4.18Å; A301-Y480 HydrophobicContact CB-CD2 4.12Å; A301-Y480 HydrophobicContact CB-CG 3.86Å; A301-Y480 WeakPolarHBondContact O-CD2 3.29Å
302	Q	86	Confident	91.4	Very high	23 Å²	23	30.5 Å²	30.5	11%	0.107	17%	0.173	C	C	.	.			trans	-89.4	119.7	-175.4	-69.7	167.3	43.9	0	0	112.1	R60 S304 I305 Y480	R60-Q302 VanDerWaalsContact NH2-CD 3.34Å; Q302-S304 VanDerWaalsContact C-N 3.28Å; Q302-S304 PolarHBondContact O-N 3.15Å; Q302-I305 HydrophobicContact CB-CD1 4Å; Q302-I305 HydrophobicContact CB-CG1 4.16Å; Q302-I305 PolarHBondContact O-N 3.34Å; Q302-Y480 PolarHBondContact O-OH 2.86Å
303	E	85.8	Confident	91.3	Very high	55 Å²	55	29.9 Å²	29.9	26%	0.257	17%	0.169	S	C	.	.	H	α-helix	trans	-67.4	-28.3	176.9	-70.2	-63.5	163.6	0	0	112.6	I305 V306 K307 Y480	E303-I305 PolarHBondContact O-N 3.29Å; E303-I305 VanDerWaalsContact O-N 3.14Å; E303-V306 WeakPolarHBondContact O-CG2 3.22Å; E303-V306 PolarHBondContact O-N 3.21Å; E303-K307 PolarHBondContact O-N 2.98Å; E303-Y480 HydrophobicContact CG-CE2 4.33Å; E303-Y480 VanDerWaalsContact OE1-CD2 3.29Å; E303-Y480 WeakPolarHBondContact OE1-CD2 3.22Å
304	S	84	Confident	91.2	Very high	50 Å²	50	31.9 Å²	31.9	35%	0.35	18%	0.179	S	C	.	.	H	α-helix	trans	-63.6	-20.3	-179.8	62.3	0	0	0	0	114.4	Q302	Q302-S304 VanDerWaalsContact C-N 3.28Å; Q302-S304 PolarHBondContact O-N 3.15Å
305	I	88.8	Confident	90.9	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-81.8	-37.9	179.7	-64.4	178.5	0	0	0	111.5	A277 R278 I281 W299 Q302 E303	A277-I305 HydrophobicContact CB-CG2 4.07Å; R278-I305 HydrophobicContact CB-CG2 4.38Å; I281-I305 HydrophobicContact CD1-CG2 3.83Å; W299-I305 HydrophobicContact CB-CD1 4.29Å; W299-I305 HydrophobicContact CD2-CG2 4.13Å; W299-I305 HydrophobicContact CG-CD1 4.2Å; W299-I305 HydrophobicContact CG-CG2 4.23Å; W299-I305 WeakPolarHBondContact O-CD1 3.41Å; Q302-I305 HydrophobicContact CB-CD1 4Å; Q302-I305 HydrophobicContact CB-CG1 4.16Å; Q302-I305 PolarHBondContact O-N 3.34Å; E303-I305 PolarHBondContact O-N 3.29Å; E303-I305 VanDerWaalsContact O-N 3.14Å
306	V	91.6	Very high	90.8	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-94.1	-14.1	-175	-65.5	0	0	0	0	113.3	I281 W299 E303 G308 N309 E310 A313 Y471 Y480	I281-V306 HydrophobicContact CD1-CG1 4.32Å; W299-V306 HydrophobicContact CH2-CG1 4.48Å; W299-V306 HydrophobicContact CZ2-CG1 3.42Å; W299-V306 VanDerWaalsContact CZ2-CG1 3.42Å; E303-V306 WeakPolarHBondContact O-CG2 3.22Å; E303-V306 PolarHBondContact O-N 3.21Å; V306-G308 PolarHBondContact O-N 3.31Å; V306-N309 CarbonylContact O-C 3.32Å; V306-N309 WeakPolarHBondContact O-CA 3.28Å; V306-N309 PolarHBondContact O-N 3.44Å; V306-E310 PolarHBondContact O-N 3.29Å; V306-A313 HydrophobicContact CB-CB 4.09Å; V306-A313 HydrophobicContact CG1-CB 3.53Å; V306-Y471 HydrophobicContact CG2-CE2 3.79Å; V306-Y480 WeakPolarHBondContact CG1-OH 3.28Å
307	K	89.1	Confident	90.9	Very high	163 Å²	163	31.8 Å²	31.8	71%	0.709	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.3	121.2	-178.3	-171.3	173.2	-176.1	172.7	0	112.9	E303 N309	E303-K307 PolarHBondContact O-N 2.98Å; K307-N309 VanDerWaalsContact C-N 3.3Å
308	G	89.9	Confident	91.1	Very high	56 Å²	56	31.6 Å²	31.6	58%	0.577	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.8	-0.6	-178.4	0	0	0	0	0	115.3	V306 E310	V306-G308 PolarHBondContact O-N 3.31Å; G308-E310 VanDerWaalsContact C-OE2 3.31Å; G308-E310 WeakPolarHBondContact CA-OE2 3.49Å; G308-E310 VanDerWaalsContact N-CD 3.33Å; G308-E310 PolarHBondContact N-OE1 3.37Å; G308-E310 PolarHBondContact N-OE2 3.25Å
309	N	93.1	Very high	91.4	Very high	36 Å²	36	31.2 Å²	31.2	19%	0.193	17%	0.173	C	C	.	.			trans	-134.7	33	177	-55.6	-75.8	0	0	0	111.6	I281 A285 V306 K307 I311 T312 A313	I281-N309 HydrophobicContact CG2-CB 3.68Å; A285-N309 HydrophobicContact CB-CB 4.26Å; A285-N309 WeakPolarHBondContact CB-OD1 3.34Å; V306-N309 CarbonylContact O-C 3.32Å; V306-N309 WeakPolarHBondContact O-CA 3.28Å; V306-N309 PolarHBondContact O-N 3.44Å; K307-N309 VanDerWaalsContact C-N 3.3Å; N309-I311 VanDerWaalsContact C-N 3.31Å; N309-I311 PolarHBondContact O-N 3.48Å; N309-T312 PolarHBondContact O-N 2.82Å; N309-T312 VanDerWaalsContact O-N 3.1Å; N309-A313 PolarHBondContact O-N 3.17Å
310	E	92.4	Very high	91.4	Very high	61 Å²	61	32 Å²	32	29%	0.285	18%	0.177	S	C	.	.	H	α-helix	trans	-61	-38.5	-170.8	-61.4	81.5	179.2	0	0	112.2	V306 G308 T312 A313 E314 Y471 Y478	V306-E310 PolarHBondContact O-N 3.29Å; G308-E310 VanDerWaalsContact C-OE2 3.31Å; G308-E310 WeakPolarHBondContact CA-OE2 3.49Å; G308-E310 VanDerWaalsContact N-CD 3.33Å; G308-E310 PolarHBondContact N-OE1 3.37Å; G308-E310 PolarHBondContact N-OE2 3.25Å; E310-T312 VanDerWaalsContact C-N 3.3Å; E310-T312 PolarHBondContact O-N 3.42Å; E310-A313 PolarHBondContact O-N 3.05Å; E310-E314 PolarHBondContact O-N 3.36Å; E310-Y471 HydrophobicContact CB-CE1 4.31Å; E310-Y471 WeakPolarHBondContact CB-OH 3.37Å; E310-Y471 VanDerWaalsContact CG-OH 3.23Å; E310-Y471 WeakPolarHBondContact CG-OH 3.38Å; E310-Y471 WeakPolarHBondContact O-CE1 2.74Å; E310-Y478 HydrophobicContact CB-CD1 4.29Å; E310-Y478 HydrophobicContact CB-CD2 3.71Å; E310-Y478 HydrophobicContact CB-CE2 4.11Å; E310-Y478 HydrophobicContact CB-CG 3.82Å; E310-Y478 HydrophobicContact CG-CD2 4.32Å
311	I	91	Very high	91.5	Very high	121 Å²	121	32.1 Å²	32.1	62%	0.621	18%	0.178	S	C	*	.	H	α-helix	trans	-61.7	-39.4	178	-60.3	169.3	0	0	0	111	N309 A313 E314	N309-I311 VanDerWaalsContact C-N 3.31Å; N309-I311 PolarHBondContact O-N 3.48Å; I311-A313 VanDerWaalsContact C-N 3.31Å; I311-A313 PolarHBondContact O-N 2.67Å; I311-E314 WeakPolarHBondContact O-CB 3.23Å; I311-E314 PolarHBondContact O-N 3.17Å
312	T	93.1	Very high	91.6	Very high	18 Å²	18	32.5 Å²	32.5	11%	0.11	18%	0.18	C	C	.	.	H	α-helix	trans	-73.2	-25.9	-178.6	-53.6	0	0	0	0	112.3	I281 A284 A285 W293 N309 E310	I281-T312 HydrophobicContact CG2-CG2 4.12Å; A284-T312 HydrophobicContact CB-CG2 3.75Å; A285-T312 HydrophobicContact CB-CG2 4.46Å; A285-T312 WeakPolarHBondContact CB-OG1 3.16Å; W293-T312 PolarHBondContact NE1-O 3.36Å; N309-T312 PolarHBondContact O-N 2.82Å; N309-T312 VanDerWaalsContact O-N 3.1Å; E310-T312 VanDerWaalsContact C-N 3.3Å; E310-T312 PolarHBondContact O-N 3.42Å
313	A	93.8	Very high	91.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-87.7	-8.6	177.7	0	0	0	0	0	113.3	W299 V306 N309 E310 I311 G315 A316 Y471	W299-A313 HydrophobicContact CH2-CB 4.25Å; W299-A313 HydrophobicContact CZ2-CB 4.03Å; V306-A313 HydrophobicContact CB-CB 4.09Å; V306-A313 HydrophobicContact CG1-CB 3.53Å; N309-A313 PolarHBondContact O-N 3.17Å; E310-A313 PolarHBondContact O-N 3.05Å; I311-A313 VanDerWaalsContact C-N 3.31Å; I311-A313 PolarHBondContact O-N 2.67Å; A313-G315 PolarHBondContact O-N 2.95Å; A313-A316 WeakPolarHBondContact O-CB 3.42Å; A313-A316 PolarHBondContact O-N 2.8Å; A313-A316 VanDerWaalsContact O-N 3.09Å; A313-Y471 HydrophobicContact CB-CD1 3.76Å; A313-Y471 HydrophobicContact CB-CE1 3.84Å; A313-Y471 WeakPolarHBondContact O-CD1 3.12Å
314	E	92.6	Very high	91.7	Very high	42 Å²	42	32 Å²	32	20%	0.196	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	131	-177.8	-167.3	-179.9	-165.5	0	0	111.8	E310 I311 R473 Y478 P500	E310-E314 PolarHBondContact O-N 3.36Å; I311-E314 WeakPolarHBondContact O-CB 3.23Å; I311-E314 PolarHBondContact O-N 3.17Å; E314-R473 WeakPolarHBondContact OE1-CB 3.46Å; E314-Y478 HydrophobicContact CB-CE1 4.34Å; E314-Y478 HydrophobicContact CG-CE1 4.21Å; E314-P500 HydrophobicContact CB-CG 4.26Å; E314-P500 HydrophobicContact CG-CB 4.39Å; E314-P500 HydrophobicContact CG-CG 4.03Å; E314-P500 WeakPolarHBondContact O-CG 3.34Å
315	G	92	Very high	91.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.1	5.9	-176.3	0	0	0	0	0	114.6	A313 Y471	A313-G315 PolarHBondContact O-N 2.95Å; G315-Y471 PolarHBondContact N-O 3.08Å
316	A	95.6	Very high	92	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	136.6	174.9	0	0	0	0	0	111.4	W293 W299 A313 T318 S470 Y471	W293-A316 HydrophobicContact CB-CB 3.88Å; W293-A316 HydrophobicContact CG-CB 4.45Å; W293-A316 CarbonylContact O-C 3.56Å; W293-A316 WeakPolarHBondContact O-CA 3.39Å; W299-A316 HydrophobicContact CH2-CB 4.18Å; W299-A316 HydrophobicContact CZ2-CB 4.25Å; A313-A316 WeakPolarHBondContact O-CB 3.42Å; A313-A316 PolarHBondContact O-N 2.8Å; A313-A316 VanDerWaalsContact O-N 3.09Å; A316-T318 HydrophobicContact CB-CG2 4.46Å; A316-S470 CarbonylContact O-C 3.48Å; A316-S470 WeakPolarHBondContact O-CA 2.94Å; A316-Y471 PolarHBondContact O-N 3.05Å
317	I	96.7	Very high	91.9	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	122.1	168.9	-62.2	178.5	0	0	0	107.8	I200 F204 W206 W293 V294 A295 I468 F469 W499	I200-I317 HydrophobicContact CD1-CG2 4.33Å; I200-I317 HydrophobicContact CG2-CD1 4.27Å; I200-I317 HydrophobicContact CG2-CG2 4.32Å; F204-I317 HydrophobicContact CD2-CD1 4.4Å; F204-I317 HydrophobicContact CE2-CD1 3.61Å; F204-I317 HydrophobicContact CZ-CD1 4.18Å; W206-I317 HydrophobicContact CH2-CD1 4.39Å; W293-I317 PolarHBondContact O-N 3.3Å; V294-I317 CarbonylContact C-O 3.57Å; V294-I317 VanDerWaalsContact CA-O 3.24Å; V294-I317 WeakPolarHBondContact CA-O 3.45Å; A295-I317 PolarHBondContact N-O 3.21Å; I317-I468 HydrophobicContact CG2-CG2 3.64Å; I317-F469 CarbonylContact C-O 3.52Å; I317-F469 WeakPolarHBondContact CA-O 3.41Å; I317-W499 HydrophobicContact CD1-CH2 3.84Å
318	T	96.1	Very high	92.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	147.3	-179.4	70.7	0	0	0	0	110.7	A295 W299 G300 A316 F469 Y480	A295-T318 HydrophobicContact CB-CG2 4.08Å; A295-T318 WeakPolarHBondContact O-CA 3.34Å; W299-T318 HydrophobicContact CD2-CG2 4.16Å; W299-T318 HydrophobicContact CG-CG2 4.07Å; G300-T318 VanDerWaalsContact O-CB 3.29Å; G300-T318 WeakPolarHBondContact O-CB 3.46Å; G300-T318 PolarHBondContact O-OG1 3.23Å; A316-T318 HydrophobicContact CB-CG2 4.46Å; T318-F469 PolarHBondContact N-O 3.06Å; T318-F469 PolarHBondContact O-N 3.38Å; T318-Y480 HydrophobicContact CG2-CE1 4.41Å
319	L	95	Very high	92.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	140.2	173.6	-72.3	76.3	0	0	0	108.6	Q193 A196 M197 I200 A295 S296 D297	Q193-L319 HydrophobicContact CG-CD2 4.06Å; A196-L319 HydrophobicContact CB-CD2 3.63Å; M197-L319 HydrophobicContact CG-CD1 3.63Å; M197-L319 HydrophobicContact CG-CD2 3.82Å; M197-L319 HydrophobicContact CG-CG 4.39Å; I200-L319 HydrophobicContact CD1-CD1 3.76Å; I200-L319 HydrophobicContact CD1-CD2 4.49Å; I200-L319 HydrophobicContact CD1-CG 4.31Å; A295-L319 PolarHBondContact O-N 3.12Å; S296-L319 CarbonylContact C-O 3.51Å; D297-L319 WeakPolarHBondContact CA-O 3.36Å; D297-L319 PolarHBondContact N-O 3.43Å
320	E	92.9	Very high	92.2	Very high	19 Å²	19	28.7 Å²	28.7	9%	0.089	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	148.9	170.3	-172	163.7	-125.2	0	0	109.3	A322 S389 Y466 N467 F469	E320-A322 PolarHBondContact O-N 3.42Å; E320-S389 VanDerWaalsContact CD-CB 3.48Å; E320-S389 WeakPolarHBondContact OE1-CB 3.39Å; E320-S389 PolarHBondContact OE1-OG 3.34Å; E320-Y466 CarbonylContact O-C 3.52Å; E320-Y466 WeakPolarHBondContact O-CA 2.94Å; E320-Y466 WeakPolarHBondContact O-CB 3.48Å; E320-N467 PolarHBondContact N-O 2.86Å; E320-N467 PolarHBondContact O-N 3.28Å; E320-F469 HydrophobicContact CB-CD2 4.22Å; E320-F469 HydrophobicContact CB-CE2 3.96Å
321	L	92.7	Very high	92.2	Very high	3 Å²	3	33.6 Å²	33.6	2%	0.016	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	136	174.5	-67.8	173.2	0	0	0	110	V187 P188 A323 K390 F393 Y466	V187-L321 HydrophobicContact CB-CD1 3.94Å; V187-L321 HydrophobicContact CG1-CD1 3.54Å; P188-L321 HydrophobicContact CG-CD2 3.58Å; L321-A323 PolarHBondContact O-N 3.4Å; L321-K390 HydrophobicContact CD1-CD 4.45Å; L321-K390 HydrophobicContact CD1-CG 4.45Å; L321-F393 HydrophobicContact CB-CE2 3.53Å; L321-F393 HydrophobicContact CB-CZ 3.75Å; L321-F393 HydrophobicContact CD1-CD2 4.17Å; L321-F393 HydrophobicContact CD1-CE2 3.77Å; L321-F393 HydrophobicContact CD1-CZ 4.22Å; L321-F393 HydrophobicContact CG-CE2 4.3Å; L321-Y466 HydrophobicContact CD2-CD1 3.97Å; L321-Y466 HydrophobicContact CD2-CE1 3.46Å; L321-Y466 VanDerWaalsContact CD2-CE1 3.46Å; L321-Y466 HydrophobicContact CG-CE1 4.4Å
322	A	90.8	Very high	92.3	Very high	32 Å²	32	29.5 Å²	29.5	26%	0.264	16%	0.157	S	C	.	.			trans	-65.8	101.9	178.4	0	0	0	0	0	110	E320 R465	E320-A322 PolarHBondContact O-N 3.42Å; A322-R465 HydrophobicContact CB-CB 3.69Å; A322-R465 WeakPolarHBondContact CB-O 3.24Å; A322-R465 PolarHBondContact N-O 3.34Å
323	A	88.3	Confident	92.3	Very high	20 Å²	20	28.8 Å²	28.8	17%	0.165	15%	0.153	C	C	.	.			trans	-129.4	145.9	-178	0	0	0	0	0	111.4	L321 S389 M392 F393	L321-A323 PolarHBondContact O-N 3.4Å; A323-S389 WeakPolarHBondContact CB-O 3.49Å; A323-M392 HydrophobicContact CB-CB 4.46Å; A323-M392 HydrophobicContact CB-CE 3.88Å; A323-M392 HydrophobicContact CB-SD 4.41Å; A323-F393 HydrophobicContact CB-CE2 3.91Å; A323-F393 HydrophobicContact CB-CZ 4.36Å
324	N	86.8	Confident	92.2	Very high	49 Å²	49	31 Å²	31	26%	0.262	16%	0.164	S	C	.	.			trans	-100.6	139	174.1	-67.3	-42.6	0	0	0	109.7	M392 P447 S450	N324-M392 HydrophobicContact CB-SD 4.19Å; N324-M392 PolarHBondContact N-SD 3.1Å; N324-M392 VanDerWaalsContact N-SD 3.42Å; N324-P447 HydrophobicContact CB-CG 4.13Å; N324-S450 PolarHBondContact ND2-OG 3Å
325	P	87.1	Confident	92.1	Very high	82 Å²	82	33 Å²	33	53%	0.532	18%	0.183	S	C	.	.			trans	-64	147	172.9	28.1	-33.6	0	0	0	109.9	P327	P325-P327 VanDerWaalsContact O-CD 3.32Å; P325-P327 WeakPolarHBondContact O-CD 3.31Å
326	I	91.5	Very high	92	Very high	8 Å²	8	34.3 Å²	34.3	4%	0.041	19%	0.19	C	C	.	.			trans	-109.3	94.4	176.8	-58.5	-176.5	0	0	0	108.6	D328 F329 N330 I391 M392 V395 F445	I326-D328 HydrophobicContact CG2-CB 4.25Å; I326-D328 PolarHBondContact O-N 3.26Å; I326-F329 HydrophobicContact CB-CB 4.04Å; I326-F329 HydrophobicContact CG2-CB 3.83Å; I326-F329 WeakPolarHBondContact O-CB 3.25Å; I326-F329 PolarHBondContact O-N 3.14Å; I326-N330 PolarHBondContact O-N 3.25Å; I326-N330 PolarHBondContact O-OD1 3.38Å; I326-I391 HydrophobicContact CD1-CG2 4.39Å; I326-M392 HydrophobicContact CD1-CB 4.26Å; I326-M392 HydrophobicContact CD1-CG 4.48Å; I326-V395 HydrophobicContact CD1-CB 4.28Å; I326-V395 HydrophobicContact CD1-CG2 4.02Å; I326-F445 HydrophobicContact CG2-CB 3.82Å; I326-F445 HydrophobicContact CG2-CD2 4.3Å; I326-F445 HydrophobicContact CG2-CG 4.07Å
327	P	90.6	Very high	91.5	Very high	73 Å²	73	37 Å²	37	47%	0.474	20%	0.204	S	C	.	.	H	α-helix	trans	-59.8	-31.1	-177.2	-24.5	35	0	0	0	113.4	P325 N330 R331	P325-P327 VanDerWaalsContact O-CD 3.32Å; P325-P327 WeakPolarHBondContact O-CD 3.31Å; P327-N330 PolarHBondContact O-N 2.92Å; P327-R331 WeakPolarHBondContact O-CG 3.32Å; P327-R331 PolarHBondContact O-N 2.97Å
328	D	92.1	Very high	91	Very high	39 Å²	39	37.8 Å²	37.8	21%	0.209	21%	0.209	C	C	.	.	H	α-helix	trans	-62.5	-40.2	174.9	-71.4	-87.7	0	0	0	113	F70 R74 I326 R331 Y332 F445	F70-D328 HydrophobicContact CZ-CB 3.91Å; R74-D328 IonicContact NH2-OD1 3.3Å; I326-D328 HydrophobicContact CG2-CB 4.25Å; I326-D328 PolarHBondContact O-N 3.26Å; D328-R331 IonicContact OD1-CZ 2.66Å; D328-R331 IonicContact OD1-NH2 3.92Å; D328-R331 PolarHBondContact OD1-NH2 3.23Å; D328-R331 IonicContact OD2-NH2 3.5Å; D328-Y332 WeakPolarHBondContact O-CB 3.32Å; D328-Y332 PolarHBondContact O-N 3.15Å; D328-F445 HydrophobicContact CB-CD1 4.25Å
329	F	93.4	Very high	90.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-67	-42.4	174.7	175.7	-98.1	0	0	0	110.4	Q63 E66 A67 F70 I326 R331 Y332 F333 I391	Q63-F329 HydrophobicContact CB-CE1 4.45Å; Q63-F329 HydrophobicContact CB-CZ 4.37Å; Q63-F329 VanDerWaalsContact O-CZ 3.26Å; Q63-F329 WeakPolarHBondContact O-CZ 3.38Å; E66-F329 HydrophobicContact CB-CE2 4.3Å; E66-F329 HydrophobicContact CB-CZ 4.4Å; A67-F329 VanDerWaalsContact CA-CE2 3.43Å; A67-F329 HydrophobicContact CB-CD2 4.14Å; A67-F329 HydrophobicContact CB-CE2 3.74Å; A67-F329 HydrophobicContact CB-CZ 4.16Å; F70-F329 HydrophobicContact CB-CD2 4.08Å; F70-F329 HydrophobicContact CB-CE2 4.43Å; F70-F329 HydrophobicContact CD1-CD2 4.17Å; F70-F329 HydrophobicContact CE1-CB 4.42Å; F70-F329 HydrophobicContact CG-CD2 4.05Å; I326-F329 HydrophobicContact CB-CB 4.04Å; I326-F329 HydrophobicContact CG2-CB 3.83Å; I326-F329 WeakPolarHBondContact O-CB 3.25Å; I326-F329 PolarHBondContact O-N 3.14Å; F329-R331 VanDerWaalsContact C-N 3.32Å; F329-R331 PolarHBondContact O-N 3.05Å; F329-Y332 AromaticContact CD2-CD1 3.94Å; F329-Y332 HydrophobicContact CD2-CD1 3.94Å; F329-Y332 AromaticContact CE2-CD1 3.92Å; F329-Y332 HydrophobicContact CE2-CD1 3.92Å; F329-Y332 HydrophobicContact CE2-CE1 4.17Å; F329-Y332 CarbonylContact O-C 3.36Å; F329-Y332 WeakPolarHBondContact O-CB 3.33Å; F329-Y332 PolarHBondContact O-N 3.14Å; F329-Y332 VanDerWaalsContact O-N 3.11Å; F329-F333 HydrophobicContact CE1-CB 4.07Å; F329-F333 HydrophobicContact CE1-CD2 4.41Å; F329-F333 HydrophobicContact CE1-CG 4.38Å; F329-F333 HydrophobicContact CZ-CB 4.05Å; F329-F333 AromaticContact CZ-CD2 3.86Å; F329-F333 HydrophobicContact CZ-CD2 3.86Å; F329-F333 HydrophobicContact CZ-CG 4.23Å; F329-F333 WeakPolarHBondContact O-CB 3.41Å; F329-F333 PolarHBondContact O-N 3.2Å; F329-I391 HydrophobicContact CB-CG2 4.46Å; F329-I391 HydrophobicContact CD1-CD1 3.73Å; F329-I391 HydrophobicContact CD1-CG2 3.92Å; F329-I391 HydrophobicContact CE1-CD1 3.45Å; F329-I391 VanDerWaalsContact CE1-CD1 3.45Å; F329-I391 HydrophobicContact CE1-CG1 4.25Å; F329-I391 HydrophobicContact CE1-CG2 4.33Å; F329-I391 HydrophobicContact CG-CG2 4.01Å; F329-I391 HydrophobicContact CZ-CD1 4.35Å
330	N	92.1	Very high	89.8	Confident	34 Å²	34	50.5 Å²	50.5	18%	0.182	27%	0.273	C	S	.	.	H	α-helix	trans	-59.2	-44.9	178.2	-61.7	-0.5	0	0	0	111.2	I326 P327 Y332 F333 L334 F385 P387	I326-N330 PolarHBondContact O-N 3.25Å; I326-N330 PolarHBondContact O-OD1 3.38Å; P327-N330 PolarHBondContact O-N 2.92Å; N330-Y332 VanDerWaalsContact C-N 3.34Å; N330-Y332 PolarHBondContact O-N 3.02Å; N330-F333 PolarHBondContact O-N 2.9Å; N330-L334 VanDerWaalsContact O-CB 3.3Å; N330-L334 WeakPolarHBondContact O-CB 3.41Å; N330-L334 WeakPolarHBondContact O-CG 3.31Å; N330-L334 PolarHBondContact O-N 3.31Å; N330-F385 HydrophobicContact CB-CE1 3.95Å; N330-P387 WeakPolarHBondContact OD1-CB 3.33Å
331	R	92.5	Very high	89.6	Confident	164 Å²	164	50.3 Å²	50.3	62%	0.619	27%	0.272	S	S	*	.	H	α-helix	trans	-61.9	-42	175.1	-72	-174.4	-69.5	172.8	-3.4	112.1	P327 D328 F329 S335	P327-R331 WeakPolarHBondContact O-CG 3.32Å; P327-R331 PolarHBondContact O-N 2.97Å; D328-R331 IonicContact OD1-CZ 2.66Å; D328-R331 IonicContact OD1-NH2 3.92Å; D328-R331 PolarHBondContact OD1-NH2 3.23Å; D328-R331 IonicContact OD2-NH2 3.5Å; F329-R331 VanDerWaalsContact C-N 3.32Å; F329-R331 PolarHBondContact O-N 3.05Å; R331-S335 WeakPolarHBondContact O-CB 3.45Å; R331-S335 PolarHBondContact O-N 3.41Å; R331-S335 PolarHBondContact O-OG 3.27Å
332	Y	93.1	Very high	89.2	Confident	35 Å²	35	58 Å²	58	14%	0.137	31%	0.308	C	S	.	.	H	α-helix	trans	-61.5	-53.8	176.3	161.7	-98.8	0	0	0	111.3	E66 F70 D328 F329 N330 L334 S335 L336 R343	E66-Y332 HydrophobicContact CB-CE1 4.21Å; E66-Y332 PolarHBondContact OE2-OH 2.89Å; F70-Y332 HydrophobicContact CB-CD1 3.87Å; F70-Y332 HydrophobicContact CB-CE1 3.89Å; F70-Y332 HydrophobicContact CB-CG 4.42Å; F70-Y332 AromaticContact CD2-CD1 3.82Å; F70-Y332 HydrophobicContact CD2-CD1 3.82Å; F70-Y332 HydrophobicContact CD2-CD2 4.1Å; F70-Y332 AromaticContact CD2-CG 3.59Å; F70-Y332 HydrophobicContact CD2-CG 3.59Å; F70-Y332 HydrophobicContact CE2-CG 4.32Å; F70-Y332 HydrophobicContact CG-CD1 4.16Å; F70-Y332 HydrophobicContact CG-CG 4.38Å; D328-Y332 WeakPolarHBondContact O-CB 3.32Å; D328-Y332 PolarHBondContact O-N 3.15Å; F329-Y332 AromaticContact CD2-CD1 3.94Å; F329-Y332 HydrophobicContact CD2-CD1 3.94Å; F329-Y332 AromaticContact CE2-CD1 3.92Å; F329-Y332 HydrophobicContact CE2-CD1 3.92Å; F329-Y332 HydrophobicContact CE2-CE1 4.17Å; F329-Y332 CarbonylContact O-C 3.36Å; F329-Y332 WeakPolarHBondContact O-CB 3.33Å; F329-Y332 PolarHBondContact O-N 3.14Å; F329-Y332 VanDerWaalsContact O-N 3.11Å; N330-Y332 VanDerWaalsContact C-N 3.34Å; N330-Y332 PolarHBondContact O-N 3.02Å; Y332-L334 PolarHBondContact O-N 3.1Å; Y332-S335 WeakPolarHBondContact O-CB 3.42Å; Y332-S335 PolarHBondContact O-N 3.23Å; Y332-S335 VanDerWaalsContact O-N 3.07Å; Y332-S335 PolarHBondContact O-OG 2.8Å; Y332-L336 HydrophobicContact CE1-CD1 4.16Å; Y332-L336 HydrophobicContact CE2-CD2 3.99Å; Y332-L336 PolarHBondContact O-N 3.42Å; Y332-R343 PolarHBondContact OH-NH2 2.97Å
333	F	92.6	Very high	89.2	Confident	4 Å²	4	60 Å²	60	2%	0.018	31%	0.309	C	S	.	.	H	α-helix	trans	-62.9	-43.2	-176.6	-169.7	-94.8	0	0	0	112.3	I62 Q63 E66 F329 N330 S335 L336 F347 F350 F385	I62-F333 HydrophobicContact CG2-CE2 4.04Å; I62-F333 HydrophobicContact CG2-CZ 4.21Å; Q63-F333 HydrophobicContact CB-CE2 4.48Å; Q63-F333 HydrophobicContact CG-CE1 4.31Å; Q63-F333 HydrophobicContact CG-CE2 4.04Å; Q63-F333 HydrophobicContact CG-CZ 3.88Å; E66-F333 HydrophobicContact CB-CD2 4.05Å; E66-F333 HydrophobicContact CB-CE2 4.2Å; E66-F333 HydrophobicContact CG-CD2 4.29Å; E66-F333 HydrophobicContact CG-CE2 4.09Å; F329-F333 HydrophobicContact CE1-CB 4.07Å; F329-F333 HydrophobicContact CE1-CD2 4.41Å; F329-F333 HydrophobicContact CE1-CG 4.38Å; F329-F333 HydrophobicContact CZ-CB 4.05Å; F329-F333 AromaticContact CZ-CD2 3.86Å; F329-F333 HydrophobicContact CZ-CD2 3.86Å; F329-F333 HydrophobicContact CZ-CG 4.23Å; F329-F333 WeakPolarHBondContact O-CB 3.41Å; F329-F333 PolarHBondContact O-N 3.2Å; N330-F333 PolarHBondContact O-N 2.9Å; F333-S335 PolarHBondContact O-N 3.16Å; F333-L336 HydrophobicContact CD2-CD1 4.02Å; F333-L336 HydrophobicContact CE2-CD1 4.45Å; F333-L336 WeakPolarHBondContact O-CB 3.32Å; F333-L336 WeakPolarHBondContact O-CG 3.28Å; F333-L336 PolarHBondContact O-N 2.85Å; F333-L336 VanDerWaalsContact O-N 3.17Å; F333-F347 HydrophobicContact CE2-CE2 4.47Å; F333-F350 HydrophobicContact CZ-CE1 4.2Å; F333-F350 HydrophobicContact CZ-CZ 4.35Å; F333-F385 HydrophobicContact CB-CZ 4.42Å; F333-F385 HydrophobicContact CD1-CD2 4.24Å; F333-F385 AromaticContact CD1-CE2 3.38Å; F333-F385 HydrophobicContact CD1-CE2 3.38Å; F333-F385 AromaticContact CD1-CZ 3.76Å; F333-F385 HydrophobicContact CD1-CZ 3.76Å; F333-F385 HydrophobicContact CE1-CD2 4.43Å; F333-F385 AromaticContact CE1-CE2 3.66Å; F333-F385 HydrophobicContact CE1-CE2 3.66Å; F333-F385 HydrophobicContact CE1-CZ 4.41Å; F333-F385 HydrophobicContact CG-CE2 4.32Å; F333-F385 HydrophobicContact CG-CZ 4.3Å
334	L	91	Very high	89.4	Confident	45 Å²	45	59.1 Å²	59.1	24%	0.236	30%	0.301	C	S	.	.	H	α-helix	trans	-67.4	-19.3	177	-67.9	173.7	0	0	0	113.5	N330 Y332 V380 Q382 F385	N330-L334 VanDerWaalsContact O-CB 3.3Å; N330-L334 WeakPolarHBondContact O-CB 3.41Å; N330-L334 WeakPolarHBondContact O-CG 3.31Å; N330-L334 PolarHBondContact O-N 3.31Å; Y332-L334 PolarHBondContact O-N 3.1Å; L334-V380 HydrophobicContact CD2-CB 3.91Å; L334-V380 HydrophobicContact CD2-CG1 3.83Å; L334-Q382 HydrophobicContact CD1-CB 4.17Å; L334-Q382 HydrophobicContact CD1-CG 3.9Å; L334-F385 HydrophobicContact CD1-CD1 4.29Å; L334-F385 HydrophobicContact CD2-CB 3.96Å; L334-F385 HydrophobicContact CD2-CD1 4.23Å; L334-F385 HydrophobicContact CD2-CD2 4.08Å; L334-F385 HydrophobicContact CD2-CG 3.8Å; L334-F385 HydrophobicContact CG-CD1 4.3Å; L334-F385 HydrophobicContact CG-CG 4.37Å
335	S	91.1	Very high	89.6	Confident	86 Å²	86	59 Å²	59	60%	0.601	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-8.2	175.9	76.1	0	0	0	0	113.9	R331 Y332 F333	R331-S335 WeakPolarHBondContact O-CB 3.45Å; R331-S335 PolarHBondContact O-N 3.41Å; R331-S335 PolarHBondContact O-OG 3.27Å; Y332-S335 WeakPolarHBondContact O-CB 3.42Å; Y332-S335 PolarHBondContact O-N 3.23Å; Y332-S335 VanDerWaalsContact O-N 3.07Å; Y332-S335 PolarHBondContact O-OG 2.8Å; F333-S335 PolarHBondContact O-N 3.16Å
336	L	90.3	Very high	89.8	Confident	26 Å²	26	55.4 Å²	55.4	14%	0.136	28%	0.279	C	S	.	.			trans	-70.8	139.2	-179.1	-64.7	176.7	0	0	0	111.4	E66 Y332 F333 F347	E66-L336 HydrophobicContact CG-CD1 4.07Å; Y332-L336 HydrophobicContact CE1-CD1 4.16Å; Y332-L336 HydrophobicContact CE2-CD2 3.99Å; Y332-L336 PolarHBondContact O-N 3.42Å; F333-L336 HydrophobicContact CD2-CD1 4.02Å; F333-L336 HydrophobicContact CE2-CD1 4.45Å; F333-L336 WeakPolarHBondContact O-CB 3.32Å; F333-L336 WeakPolarHBondContact O-CG 3.28Å; F333-L336 PolarHBondContact O-N 2.85Å; F333-L336 VanDerWaalsContact O-N 3.17Å; L336-F347 HydrophobicContact CB-CE1 4.08Å; L336-F347 HydrophobicContact CB-CE2 4.08Å; L336-F347 HydrophobicContact CB-CZ 3.49Å; L336-F347 VanDerWaalsContact CB-CZ 3.49Å; L336-F347 HydrophobicContact CD1-CE2 3.82Å; L336-F347 HydrophobicContact CD1-CZ 4.14Å; L336-F347 HydrophobicContact CG-CZ 4.47Å
337	D	85.6	Confident	89.8	Confident	56 Å²	56	55.1 Å²	55.1	30%	0.299	28%	0.277	S	S	.	.			trans	-125.2	131.5	-178.2	177	-66.5	0	0	0	108.8	V339 K340 N341	D337-V339 PolarHBondContact O-N 3.34Å; D337-V339 WeakPolarHBondContact OD1-CA 3.37Å; D337-V339 VanDerWaalsContact OD1-CB 3.25Å; D337-V339 WeakPolarHBondContact OD1-CB 3.18Å; D337-V339 PolarHBondContact OD1-N 3.45Å; D337-K340 HydrophobicContact CB-CB 4.18Å; D337-K340 HydrophobicContact CB-CD 4.18Å; D337-K340 HydrophobicContact CB-CG 4.23Å; D337-K340 PolarHBondContact O-N 3.11Å; D337-K340 VanDerWaalsContact O-N 3.14Å; D337-K340 PolarHBondContact OD1-N 2.9Å; D337-K340 VanDerWaalsContact OD1-N 3.14Å; D337-N341 VanDerWaalsContact O-CB 3.31Å; D337-N341 WeakPolarHBondContact O-CB 3.26Å; D337-N341 PolarHBondContact O-N 2.67Å
338	P	85.3	Confident	89.7	Confident	18 Å²	18	57.6 Å²	57.6	12%	0.117	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-16.8	-173.7	31.7	-39.2	0	0	0	114.1	F347 W351 L359	P338-F347 HydrophobicContact CB-CD1 4.16Å; P338-F347 HydrophobicContact CB-CE1 4.21Å; P338-W351 HydrophobicContact CB-CB 4.07Å; P338-W351 HydrophobicContact CB-CD2 4.08Å; P338-W351 HydrophobicContact CB-CE3 4.48Å; P338-W351 HydrophobicContact CB-CG 3.89Å; P338-W351 HydrophobicContact CG-CD2 3.73Å; P338-W351 HydrophobicContact CG-CE3 4.31Å; P338-W351 HydrophobicContact CG-CG 3.81Å; P338-W351 HydrophobicContact CG-CZ2 4.36Å; P338-L359 HydrophobicContact CB-CD1 3.63Å; P338-L359 HydrophobicContact CG-CD1 3.95Å; P338-L359 HydrophobicContact CG-CD2 4.1Å
339	V	81	Confident	89.5	Confident	101 Å²	101	57.5 Å²	57.5	61%	0.612	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-31.9	174.3	-175.4	0	0	0	0	110.8	D337 H342	D337-V339 PolarHBondContact O-N 3.34Å; D337-V339 WeakPolarHBondContact OD1-CA 3.37Å; D337-V339 VanDerWaalsContact OD1-CB 3.25Å; D337-V339 WeakPolarHBondContact OD1-CB 3.18Å; D337-V339 PolarHBondContact OD1-N 3.45Å; V339-H342 PolarHBondContact O-CE1 3.15Å; V339-H342 PolarHBondContact O-NE2 2.97Å
340	K	85.4	Confident	89.3	Confident	167 Å²	167	57.6 Å²	57.6	73%	0.726	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-30.6	-179.1	-62.7	177.6	-176.6	168.1	0	113.6	D337 H342	D337-K340 HydrophobicContact CB-CB 4.18Å; D337-K340 HydrophobicContact CB-CD 4.18Å; D337-K340 HydrophobicContact CB-CG 4.23Å; D337-K340 PolarHBondContact O-N 3.11Å; D337-K340 VanDerWaalsContact O-N 3.14Å; D337-K340 PolarHBondContact OD1-N 2.9Å; D337-K340 VanDerWaalsContact OD1-N 3.14Å; K340-H342 VanDerWaalsContact C-N 3.3Å; K340-H342 PolarHBondContact O-N 2.76Å
341	N	87.8	Confident	89.1	Confident	14 Å²	14	56.4 Å²	56.4	8%	0.075	27%	0.27	C	S	.	.			trans	-79.6	76.2	-176.8	-171.1	5.4	0	0	0	111.1	E66 D337 R343 N344 F347	E66-N341 PolarHBondContact OE1-ND2 3.31Å; E66-N341 VanDerWaalsContact OE1-ND2 3.12Å; D337-N341 VanDerWaalsContact O-CB 3.31Å; D337-N341 WeakPolarHBondContact O-CB 3.26Å; D337-N341 PolarHBondContact O-N 2.67Å; N341-R343 WeakPolarHBondContact OD1-CG 3.42Å; N341-N344 PolarHBondContact OD1-N 3.44Å; N341-F347 HydrophobicContact CB-CD1 4.09Å; N341-F347 HydrophobicContact CB-CG 4.49Å; N341-F347 WeakPolarHBondContact ND2-CG 3.49Å
342	H	85.4	Confident	88.9	Confident	164 Å²	164	50.1 Å²	50.1	76%	0.759	25%	0.248	S	C	*	.			trans	-81.2	-14.9	176.5	-60.5	-54.7	0	0	0	113.7	V339 K340 N344	V339-H342 PolarHBondContact O-CE1 3.15Å; V339-H342 PolarHBondContact O-NE2 2.97Å; K340-H342 VanDerWaalsContact C-N 3.3Å; K340-H342 PolarHBondContact O-N 2.76Å; H342-N344 VanDerWaalsContact C-N 3.32Å
343	R	90.8	Very high	88.6	Confident	74 Å²	74	51.3 Å²	51.3	28%	0.279	25%	0.254	S	S	.	.	S	Bend	trans	-73.1	-25.1	-178.2	66	171.3	-175.1	-174.1	3.1	113.3	I29 L69 D73 Y332 N341	I29-R343 WeakPolarHBondContact CG1-O 3.18Å; I29-R343 WeakPolarHBondContact CG2-O 3.44Å; L69-R343 HydrophobicContact CD1-CG 4.46Å; D73-R343 IonicContact OD1-NH1 2.67Å; D73-R343 PolarHBondContact OD1-NH1 3.41Å; D73-R343 IonicContact OD2-CZ 2.7Å; D73-R343 VanDerWaalsContact OD2-CZ 3.3Å; D73-R343 IonicContact OD2-NH1 2.87Å; D73-R343 PolarHBondContact OD2-NH1 3.1Å; D73-R343 IonicContact OD2-NH2 3.63Å; D73-R343 PolarHBondContact OD2-NH2 3.47Å; Y332-R343 PolarHBondContact OH-NH2 2.97Å; N341-R343 WeakPolarHBondContact OD1-CG 3.42Å
344	N	92.1	Very high	88.2	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.016	27%	0.269	C	S	.	.			trans	-108.3	105.6	178.2	-178.8	-6.5	0	0	0	110.3	I29 E66 N341 H342 W346 F347	I29-N344 HydrophobicContact CD1-CB 4.2Å; E66-N344 WeakPolarHBondContact OE1-CB 3.48Å; E66-N344 PolarHBondContact OE1-ND2 3.39Å; N341-N344 PolarHBondContact OD1-N 3.44Å; H342-N344 VanDerWaalsContact C-N 3.32Å; N344-W346 PolarHBondContact O-N 3.08Å; N344-W346 PolarHBondContact OD1-N 2.95Å; N344-F347 HydrophobicContact CB-CB 3.97Å; N344-F347 PolarHBondContact O-N 2.79Å; N344-F347 PolarHBondContact OD1-N 3.2Å
345	P	91	Very high	88.1	Confident	45 Å²	45	55.7 Å²	55.7	29%	0.292	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-17.9	-176.2	29	-34.7	0	0	0	113.3	I29	I29-P345 VanDerWaalsContact CG1-CD 3.42Å; I29-P345 HydrophobicContact CG1-CG 4.22Å
346	W	92.3	Very high	87.8	Confident	7 Å²	7	56.8 Å²	56.8	3%	0.027	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-10.3	-179.8	-56.2	-75.9	0	0	0	113.3	R27 I29 V43 H44 I62 L65 D93 N344 R348 D349 F350	R27-W346 HydrophobicContact CB-CZ2 4Å; R27-W346 WeakPolarHBondContact O-CZ2 3.43Å; I29-W346 HydrophobicContact CD1-CE3 4.17Å; I29-W346 HydrophobicContact CD1-CZ3 3.8Å; I29-W346 HydrophobicContact CG1-CE3 4.36Å; I29-W346 HydrophobicContact CG1-CZ3 3.74Å; V43-W346 HydrophobicContact CG1-CB 3.74Å; V43-W346 HydrophobicContact CG1-CD2 3.89Å; V43-W346 HydrophobicContact CG1-CE3 4.35Å; V43-W346 HydrophobicContact CG1-CG 3.62Å; V43-W346 HydrophobicContact CG2-CD2 4.36Å; V43-W346 HydrophobicContact CG2-CE3 4.18Å; V43-W346 HydrophobicContact CG2-CZ3 4.35Å; H44-W346 AromaticContact CE1-CD1 3.64Å; H44-W346 AromaticContact CE1-NE1 3.88Å; I62-W346 HydrophobicContact CD1-CB 3.92Å; L65-W346 HydrophobicContact CD1-CE3 3.81Å; L65-W346 HydrophobicContact CD1-CZ3 3.76Å; D93-W346 HydrophobicContact CB-CZ2 4.14Å; N344-W346 PolarHBondContact O-N 3.08Å; N344-W346 PolarHBondContact OD1-N 2.95Å; W346-R348 PolarHBondContact O-N 3.48Å; W346-D349 PolarHBondContact O-N 3.11Å; W346-F350 WeakPolarHBondContact O-CB 3.09Å; W346-F350 PolarHBondContact O-N 3.33Å
347	F	90.4	Very high	87.7	Confident	3 Å²	3	56 Å²	56	1%	0.013	26%	0.261	C	S	.	.	H	α-helix	trans	-65.2	-31.2	-177.6	-165.2	-98.9	0	0	0	112.3	I62 F333 L336 P338 N341 N344 F350 W351	I62-F347 HydrophobicContact CG2-CD2 4.13Å; I62-F347 HydrophobicContact CG2-CE2 4.47Å; F333-F347 HydrophobicContact CE2-CE2 4.47Å; L336-F347 HydrophobicContact CB-CE1 4.08Å; L336-F347 HydrophobicContact CB-CE2 4.08Å; L336-F347 HydrophobicContact CB-CZ 3.49Å; L336-F347 VanDerWaalsContact CB-CZ 3.49Å; L336-F347 HydrophobicContact CD1-CE2 3.82Å; L336-F347 HydrophobicContact CD1-CZ 4.14Å; L336-F347 HydrophobicContact CG-CZ 4.47Å; P338-F347 HydrophobicContact CB-CD1 4.16Å; P338-F347 HydrophobicContact CB-CE1 4.21Å; N341-F347 HydrophobicContact CB-CD1 4.09Å; N341-F347 HydrophobicContact CB-CG 4.49Å; N341-F347 WeakPolarHBondContact ND2-CG 3.49Å; N344-F347 HydrophobicContact CB-CB 3.97Å; N344-F347 PolarHBondContact O-N 2.79Å; N344-F347 PolarHBondContact OD1-N 3.2Å; F347-F350 AromaticContact CD2-CD1 3.98Å; F347-F350 HydrophobicContact CD2-CD1 3.98Å; F347-F350 AromaticContact CE2-CD1 3.88Å; F347-F350 HydrophobicContact CE2-CD1 3.88Å; F347-F350 HydrophobicContact CE2-CE1 4.02Å; F347-F350 HydrophobicContact CZ-CD1 4.34Å; F347-F350 HydrophobicContact CZ-CE1 4.33Å; F347-F350 WeakPolarHBondContact O-CB 3.24Å; F347-W351 HydrophobicContact CE1-CE3 4.03Å; F347-W351 HydrophobicContact CE1-CZ3 4.38Å; F347-W351 HydrophobicContact CZ-CE3 4.2Å; F347-W351 HydrophobicContact CZ-CZ3 4.32Å; F347-W351 WeakPolarHBondContact O-CB 3.36Å; F347-W351 PolarHBondContact O-N 2.75Å
348	R	88.1	Confident	87.7	Confident	125 Å²	125	53.6 Å²	53.6	47%	0.472	25%	0.249	S	C	.	.	H	α-helix	trans	-66.4	-47	175.5	-158.5	-179.4	72.8	162.2	3.9	111.7	W346 F350 W351 E352 L359	W346-R348 PolarHBondContact O-N 3.48Å; R348-F350 VanDerWaalsContact C-N 3.31Å; R348-F350 PolarHBondContact O-N 3.07Å; R348-W351 WeakPolarHBondContact O-CB 3.26Å; R348-W351 PolarHBondContact O-N 3.32Å; R348-W351 VanDerWaalsContact O-N 3.14Å; R348-E352 WeakPolarHBondContact O-CG 3.07Å; R348-E352 PolarHBondContact O-N 3.41Å; R348-L359 HydrophobicContact CG-CB 4.39Å; R348-L359 HydrophobicContact CG-CD1 3.53Å
349	D	87.4	Confident	87.4	Confident	36 Å²	36	55.5 Å²	55.5	19%	0.193	26%	0.258	C	S	.	.	H	α-helix	trans	-65.2	-39.1	179.5	-59.5	-11.7	0	0	0	111	R27 V56 W346 W351 E352 Q353	R27-D349 IonicContact CZ-OD2 3.78Å; R27-D349 IonicContact NH1-OD1 3.89Å; R27-D349 IonicContact NH1-OD2 2.61Å; R27-D349 PolarHBondContact NH1-OD2 3.35Å; V56-D349 HydrophobicContact CG2-CB 4.15Å; W346-D349 PolarHBondContact O-N 3.11Å; D349-W351 VanDerWaalsContact C-N 3.34Å; D349-W351 PolarHBondContact O-N 3.42Å; D349-E352 PolarHBondContact O-N 3.08Å; D349-Q353 VanDerWaalsContact O-CB 3.26Å; D349-Q353 WeakPolarHBondContact O-CB 3.09Å; D349-Q353 PolarHBondContact O-N 2.86Å
350	F	89.4	Confident	87	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.009	25%	0.247	C	C	.	.	H	α-helix	trans	-54.2	-49.9	170.2	161.6	-115.3	0	0	0	111.8	V56 E58 I62 F333 W346 F347 R348 Q353 R354	V56-F350 HydrophobicContact CG1-CB 4.1Å; E58-F350 HydrophobicContact CB-CD2 4.16Å; E58-F350 HydrophobicContact CB-CE2 3.76Å; E58-F350 HydrophobicContact CG-CD2 4.21Å; E58-F350 HydrophobicContact CG-CE2 3.38Å; E58-F350 HydrophobicContact CG-CZ 3.97Å; E58-F350 WeakPolarHBondContact OE1-CZ 3.49Å; I62-F350 HydrophobicContact CD1-CB 4.28Å; I62-F350 HydrophobicContact CG1-CB 4.04Å; I62-F350 HydrophobicContact CG1-CD2 4.39Å; I62-F350 HydrophobicContact CG1-CG 4.17Å; I62-F350 HydrophobicContact CG2-CD1 4.18Å; I62-F350 HydrophobicContact CG2-CG 4.25Å; F333-F350 HydrophobicContact CZ-CE1 4.2Å; F333-F350 HydrophobicContact CZ-CZ 4.35Å; W346-F350 WeakPolarHBondContact O-CB 3.09Å; W346-F350 PolarHBondContact O-N 3.33Å; F347-F350 AromaticContact CD2-CD1 3.98Å; F347-F350 HydrophobicContact CD2-CD1 3.98Å; F347-F350 AromaticContact CE2-CD1 3.88Å; F347-F350 HydrophobicContact CE2-CD1 3.88Å; F347-F350 HydrophobicContact CE2-CE1 4.02Å; F347-F350 HydrophobicContact CZ-CD1 4.34Å; F347-F350 HydrophobicContact CZ-CE1 4.33Å; F347-F350 WeakPolarHBondContact O-CB 3.24Å; R348-F350 VanDerWaalsContact C-N 3.31Å; R348-F350 PolarHBondContact O-N 3.07Å; F350-Q353 PolarHBondContact O-N 2.98Å; F350-R354 HydrophobicContact CE2-CB 4.13Å; F350-R354 WeakPolarHBondContact O-CB 3.4Å; F350-R354 PolarHBondContact O-N 3.46Å
351	W	88.4	Confident	85.5	Confident	9 Å²	9	50.2 Å²	50.2	3%	0.034	26%	0.26	C	S	.	.	H	α-helix	trans	-63.4	-47.2	-178.5	-161.3	-90.3	0	0	0	112.1	P338 F347 R348 D349 Q353 R354 F355 L359 L378 V380	P338-W351 HydrophobicContact CB-CB 4.07Å; P338-W351 HydrophobicContact CB-CD2 4.08Å; P338-W351 HydrophobicContact CB-CE3 4.48Å; P338-W351 HydrophobicContact CB-CG 3.89Å; P338-W351 HydrophobicContact CG-CD2 3.73Å; P338-W351 HydrophobicContact CG-CE3 4.31Å; P338-W351 HydrophobicContact CG-CG 3.81Å; P338-W351 HydrophobicContact CG-CZ2 4.36Å; F347-W351 HydrophobicContact CE1-CE3 4.03Å; F347-W351 HydrophobicContact CE1-CZ3 4.38Å; F347-W351 HydrophobicContact CZ-CE3 4.2Å; F347-W351 HydrophobicContact CZ-CZ3 4.32Å; F347-W351 WeakPolarHBondContact O-CB 3.36Å; F347-W351 PolarHBondContact O-N 2.75Å; R348-W351 WeakPolarHBondContact O-CB 3.26Å; R348-W351 PolarHBondContact O-N 3.32Å; R348-W351 VanDerWaalsContact O-N 3.14Å; D349-W351 VanDerWaalsContact C-N 3.34Å; D349-W351 PolarHBondContact O-N 3.42Å; W351-Q353 VanDerWaalsContact C-N 3.33Å; W351-Q353 PolarHBondContact O-N 3.47Å; W351-R354 PolarHBondContact O-N 3.41Å; W351-F355 AromaticContact CD1-CD2 3.79Å; W351-F355 AromaticContact CD2-CD2 3.82Å; W351-F355 HydrophobicContact CD2-CD2 3.82Å; W351-F355 AromaticContact CD2-CE2 3.62Å; W351-F355 HydrophobicContact CD2-CE2 3.62Å; W351-F355 AromaticContact CE2-CD2 3.61Å; W351-F355 AromaticContact CE2-CE2 3.37Å; W351-F355 HydrophobicContact CE3-CD2 4.49Å; W351-F355 AromaticContact CE3-CE2 3.92Å; W351-F355 HydrophobicContact CE3-CE2 3.92Å; W351-F355 AromaticContact CG-CD2 3.96Å; W351-F355 HydrophobicContact CG-CD2 3.96Å; W351-F355 HydrophobicContact CG-CE2 4.26Å; W351-F355 AromaticContact CH2-CE2 3.81Å; W351-F355 HydrophobicContact CH2-CE2 3.81Å; W351-F355 HydrophobicContact CH2-CZ 4.31Å; W351-F355 HydrophobicContact CZ2-CD2 4.14Å; W351-F355 AromaticContact CZ2-CE2 3.48Å; W351-F355 HydrophobicContact CZ2-CE2 3.48Å; W351-F355 VanDerWaalsContact CZ2-CE2 3.48Å; W351-F355 HydrophobicContact CZ2-CZ 4.11Å; W351-F355 HydrophobicContact CZ3-CE2 4.01Å; W351-F355 AromaticContact NE1-CD2 3.59Å; W351-F355 AromaticContact NE1-CE2 3.86Å; W351-F355 WeakPolarHBondContact O-CD2 3.27Å; W351-F355 PolarHBondContact O-N 2.72Å; W351-L359 HydrophobicContact CB-CD1 4.02Å; W351-L359 HydrophobicContact CG-CD1 4.12Å; W351-L378 HydrophobicContact CZ2-CB 4.29Å; W351-L378 HydrophobicContact CZ2-CG 4.4Å; W351-L378 WeakPolarHBondContact CZ2-O 3.31Å; W351-V380 HydrophobicContact CH2-CG2 4.12Å; W351-V380 HydrophobicContact CZ3-CG2 3.79Å
352	E	87.5	Confident	84	Confident	33 Å²	33	53 Å²	53	15%	0.154	29%	0.291	C	S	.	.	H	α-helix	trans	-61.5	-41	177.1	-67.4	-170.6	149	0	0	111.5	R348 D349 Q356 C357 S358 L359	R348-E352 WeakPolarHBondContact O-CG 3.07Å; R348-E352 PolarHBondContact O-N 3.41Å; D349-E352 PolarHBondContact O-N 3.08Å; E352-Q356 VanDerWaalsContact O-CA 3.26Å; E352-Q356 WeakPolarHBondContact O-CA 3.45Å; E352-Q356 PolarHBondContact O-N 2.95Å; E352-C357 VanDerWaalsContact CA-O 3.27Å; E352-C357 WeakPolarHBondContact CA-O 3.19Å; E352-C357 WeakPolarHBondContact CB-O 3.44Å; E352-C357 VanDerWaalsContact CG-O 3.31Å; E352-C357 WeakPolarHBondContact CG-O 3.49Å; E352-C357 PolarHBondContact O-N 2.77Å; E352-S358 WeakPolarHBondContact OE1-CA 3.49Å; E352-S358 PolarHBondContact OE1-OG 3.07Å; E352-L359 HydrophobicContact CG-CB 4.47Å; E352-L359 HydrophobicContact CG-CD1 4.16Å; E352-L359 HydrophobicContact CG-CG 4.2Å; E352-L359 PolarHBondContact OE1-N 3.23Å
353	Q	87.1	Confident	82.8	Confident	59 Å²	59	46 Å²	46	28%	0.276	26%	0.264	S	S	.	.	H	α-helix	trans	-67.4	-44.3	177.7	-171.8	-176.3	-80.6	0	0	112.4	V56 D349 F350 W351 Q356	V56-Q353 PolarHBondContact O-NE2 2.87Å; D349-Q353 VanDerWaalsContact O-CB 3.26Å; D349-Q353 WeakPolarHBondContact O-CB 3.09Å; D349-Q353 PolarHBondContact O-N 2.86Å; F350-Q353 PolarHBondContact O-N 2.98Å; W351-Q353 VanDerWaalsContact C-N 3.33Å; W351-Q353 PolarHBondContact O-N 3.47Å; Q353-Q356 PolarHBondContact O-NE2 2.84Å
354	R	85.8	Confident	81.2	Confident	84 Å²	84	48.6 Å²	48.6	32%	0.317	28%	0.283	S	S	.	.	H	α-helix	trans	-68.3	-42.4	-177.4	-178.2	169.2	174.1	95.8	-11.7	111.9	E58 F350 W351	E58-R354 WeakPolarHBondContact OE1-CD 3.47Å; E58-R354 IonicContact OE1-CZ 3.3Å; E58-R354 IonicContact OE1-NE 3.75Å; E58-R354 PolarHBondContact OE1-NE 2.78Å; E58-R354 IonicContact OE1-NH1 2.69Å; E58-R354 PolarHBondContact OE1-NH1 3.48Å; E58-R354 IonicContact OE1-NH2 2.89Å; E58-R354 IonicContact OE2-CZ 3.55Å; E58-R354 IonicContact OE2-NE 2.84Å; E58-R354 IonicContact OE2-NH1 2.7Å; E58-R354 PolarHBondContact OE2-NH1 2.82Å; F350-R354 HydrophobicContact CE2-CB 4.13Å; F350-R354 WeakPolarHBondContact O-CB 3.4Å; F350-R354 PolarHBondContact O-N 3.46Å; W351-R354 PolarHBondContact O-N 3.41Å
355	F	87	Confident	79.5	Confident	57 Å²	57	49.1 Å²	49.1	25%	0.25	29%	0.289	C	S	.	.	H	α-helix	trans	-96	-4.1	-175.7	-67.5	-71.4	0	0	0	114.6	W351 C357 L378 V380	W351-F355 AromaticContact CD1-CD2 3.79Å; W351-F355 AromaticContact CD2-CD2 3.82Å; W351-F355 HydrophobicContact CD2-CD2 3.82Å; W351-F355 AromaticContact CD2-CE2 3.62Å; W351-F355 HydrophobicContact CD2-CE2 3.62Å; W351-F355 AromaticContact CE2-CD2 3.61Å; W351-F355 AromaticContact CE2-CE2 3.37Å; W351-F355 HydrophobicContact CE3-CD2 4.49Å; W351-F355 AromaticContact CE3-CE2 3.92Å; W351-F355 HydrophobicContact CE3-CE2 3.92Å; W351-F355 AromaticContact CG-CD2 3.96Å; W351-F355 HydrophobicContact CG-CD2 3.96Å; W351-F355 HydrophobicContact CG-CE2 4.26Å; W351-F355 AromaticContact CH2-CE2 3.81Å; W351-F355 HydrophobicContact CH2-CE2 3.81Å; W351-F355 HydrophobicContact CH2-CZ 4.31Å; W351-F355 HydrophobicContact CZ2-CD2 4.14Å; W351-F355 AromaticContact CZ2-CE2 3.48Å; W351-F355 HydrophobicContact CZ2-CE2 3.48Å; W351-F355 VanDerWaalsContact CZ2-CE2 3.48Å; W351-F355 HydrophobicContact CZ2-CZ 4.11Å; W351-F355 HydrophobicContact CZ3-CE2 4.01Å; W351-F355 AromaticContact NE1-CD2 3.59Å; W351-F355 AromaticContact NE1-CE2 3.86Å; W351-F355 WeakPolarHBondContact O-CD2 3.27Å; W351-F355 PolarHBondContact O-N 2.72Å; F355-C357 VanDerWaalsContact C-N 3.28Å; F355-C357 VanDerWaalsContact CB-SG 3.57Å; F355-C357 PolarHBondContact O-N 2.98Å; F355-L378 HydrophobicContact CB-CD2 3.54Å; F355-L378 HydrophobicContact CD1-CD1 3.77Å; F355-L378 HydrophobicContact CD1-CD2 3.5Å; F355-L378 HydrophobicContact CD1-CG 3.66Å; F355-L378 HydrophobicContact CD2-CD2 3.58Å; F355-L378 HydrophobicContact CD2-CG 4.15Å; F355-L378 HydrophobicContact CE1-CD1 3.9Å; F355-L378 HydrophobicContact CE1-CD2 4.03Å; F355-L378 HydrophobicContact CE1-CG 3.69Å; F355-L378 HydrophobicContact CE2-CD2 4.11Å; F355-L378 HydrophobicContact CE2-CG 4.2Å; F355-L378 HydrophobicContact CG-CD1 4.4Å; F355-L378 HydrophobicContact CG-CD2 3.24Å; F355-L378 HydrophobicContact CG-CG 3.89Å; F355-L378 HydrophobicContact CZ-CD2 4.31Å; F355-L378 HydrophobicContact CZ-CG 3.97Å; F355-V380 HydrophobicContact CE2-CG2 4.44Å; F355-V380 HydrophobicContact CZ-CG2 4.26Å
356	Q	86.7	Confident	77.6	Confident	110 Å²	110	52.9 Å²	52.9	51%	0.514	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	48.3	-179.2	-61.8	-69.1	-50.6	0	0	111.6	E352 Q353 L371	E352-Q356 VanDerWaalsContact O-CA 3.26Å; E352-Q356 WeakPolarHBondContact O-CA 3.45Å; E352-Q356 PolarHBondContact O-N 2.95Å; Q353-Q356 PolarHBondContact O-NE2 2.84Å; Q356-L371 WeakPolarHBondContact O-CD2 3.3Å
357	C	86.9	Confident	75.8	Confident	8 Å²	8	56.4 Å²	56.4	5%	0.054	34%	0.344	C	S	.	.			trans	-140.9	166.7	-179.8	65.5	0	0	0	0	110.3	E352 F355 P372 C374	E352-C357 VanDerWaalsContact CA-O 3.27Å; E352-C357 WeakPolarHBondContact CA-O 3.19Å; E352-C357 WeakPolarHBondContact CB-O 3.44Å; E352-C357 VanDerWaalsContact CG-O 3.31Å; E352-C357 WeakPolarHBondContact CG-O 3.49Å; E352-C357 PolarHBondContact O-N 2.77Å; F355-C357 VanDerWaalsContact C-N 3.28Å; F355-C357 VanDerWaalsContact CB-SG 3.57Å; F355-C357 PolarHBondContact O-N 2.98Å; C357-P372 CarbonylContact C-O 3.48Å; C357-P372 VanDerWaalsContact CA-O 3.26Å; C357-P372 WeakPolarHBondContact CA-O 3.35Å; C357-P372 WeakPolarHBondContact CB-O 3.44Å; C357-C374 HydrophobicContact CB-CB 3.9Å; C357-C374 WeakPolarHBondContact CB-SG 3.46Å; C357-C374 VanDerWaalsContact SG-CA 3.52Å; C357-C374 WeakPolarHBondContact SG-CB 3.42Å; C357-C374 CovalentContact SG-SG 2.02Å; C357-C374 PolarHBondContact SG-SG 3.01Å
358	S	85.4	Confident	74.3	Confident	6 Å²	6	58.6 Å²	58.6	4%	0.042	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-111.7	133.8	175.3	-170.6	0	0	0	0	112.2	E352 G360 G363 P372 P373 C374	E352-S358 WeakPolarHBondContact OE1-CA 3.49Å; E352-S358 PolarHBondContact OE1-OG 3.07Å; S358-G360 VanDerWaalsContact C-N 3.34Å; S358-G360 PolarHBondContact OG-N 3.17Å; S358-G360 PolarHBondContact OG-O 3.26Å; S358-G360 VanDerWaalsContact OG-O 3.12Å; S358-G363 WeakPolarHBondContact OG-CA 3.16Å; S358-G363 PolarHBondContact OG-N 2.87Å; S358-P372 PolarHBondContact N-O 3.39Å; S358-P373 WeakPolarHBondContact O-CA 2.92Å; S358-C374 PolarHBondContact O-N 3.13Å
359	L	79.8	Confident	73.2	Confident	59 Å²	59	56.8 Å²	56.8	31%	0.309	37%	0.371	S	S	.	.	S	Bend	trans	-86.1	-8	176.4	-71.2	165.9	0	0	0	112.5	P338 R348 W351 E352 C374	P338-L359 HydrophobicContact CB-CD1 3.63Å; P338-L359 HydrophobicContact CG-CD1 3.95Å; P338-L359 HydrophobicContact CG-CD2 4.1Å; R348-L359 HydrophobicContact CG-CB 4.39Å; R348-L359 HydrophobicContact CG-CD1 3.53Å; W351-L359 HydrophobicContact CB-CD1 4.02Å; W351-L359 HydrophobicContact CG-CD1 4.12Å; E352-L359 HydrophobicContact CG-CB 4.47Å; E352-L359 HydrophobicContact CG-CD1 4.16Å; E352-L359 HydrophobicContact CG-CG 4.2Å; E352-L359 PolarHBondContact OE1-N 3.23Å; L359-C374 HydrophobicContact CD2-CB 3.76Å; L359-C374 HydrophobicContact CG-CB 4.34Å
360	G	71.6	Confident	72.3	Confident	36 Å²	36	60.5 Å²	60.5	37%	0.371	40%	0.397	S	S	.	.	S	Bend	trans	-124.3	171	176.8	0	0	0	0	0	113.1	S358 G362	S358-G360 VanDerWaalsContact C-N 3.34Å; S358-G360 PolarHBondContact OG-N 3.17Å; S358-G360 PolarHBondContact OG-O 3.26Å; S358-G360 VanDerWaalsContact OG-O 3.12Å; G360-G362 PolarHBondContact O-N 3.13Å; G360-G362 VanDerWaalsContact O-N 3.14Å
361	A	54.2	Low	71.7	Confident	121 Å²	121	62.2 Å²	62.2	100%	1	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	101.5	174.5	0	0	0	0	0	110.1
362	G	57.3	Low	71.4	Confident	71 Å²	71	65.6 Å²	65.6	73%	0.732	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.9	32.9	167.7	0	0	0	0	0	117.2	G360 L364	G360-G362 PolarHBondContact O-N 3.13Å; G360-G362 VanDerWaalsContact O-N 3.14Å; G362-L364 PolarHBondContact O-N 2.83Å
363	G	58.6	Low	71.2	Confident	19 Å²	19	69.5 Å²	69.5	20%	0.196	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-65.4	125.8	170.3	0	0	0	0	0	112.7	S358 L371	S358-G363 WeakPolarHBondContact OG-CA 3.16Å; S358-G363 PolarHBondContact OG-N 2.87Å; G363-L371 PolarHBondContact O-N 3.12Å
364	L	58.2	Low	71	Confident	128 Å²	128	67.7 Å²	67.7	67%	0.67	45%	0.451	S	S	*	.	B	Isolated β-bridge	trans	-90.8	124	170.8	-75.6	151.7	0	0	0	108.9	G362 G368	G362-L364 PolarHBondContact O-N 2.83Å; L364-G368 VanDerWaalsContact CD2-O 3.26Å; L364-G368 WeakPolarHBondContact CD2-O 3.43Å
365	G	57.3	Low	70.9	Confident	14 Å²	14	68.9 Å²	68.9	14%	0.144	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-75.7	173.7	173.6	0	0	0	0	0	113	G367 G368 T369	G365-G367 PolarHBondContact O-N 3.38Å; G365-G368 PolarHBondContact O-N 2.8Å; G365-T369 PolarHBondContact N-O 2.86Å
366	L	50.3	Low	70.5	Confident	124 Å²	124	75.6 Å²	75.6	65%	0.649	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	107.2	172.3	-86	145.4	0	0	0	110.2
367	G	53.6	Low	70.1	Confident	80 Å²	80	77.1 Å²	77.1	83%	0.825	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.8	6.1	-176.9	0	0	0	0	0	115.5	G365	G365-G367 PolarHBondContact O-N 3.38Å
368	G	60.5	Low	69.8	Low	50 Å²	50	79.5 Å²	79.5	52%	0.515	52%	0.516	S	S	.	.	S	Bend	trans	79.9	14.4	174.2	0	0	0	0	0	114.7	L364 G365	L364-G368 VanDerWaalsContact CD2-O 3.26Å; L364-G368 WeakPolarHBondContact CD2-O 3.43Å; G365-G368 PolarHBondContact O-N 2.8Å
369	T	63.9	Low	69.7	Low	86 Å²	86	83 Å²	83	53%	0.528	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-85.2	136.6	175.5	45.6	0	0	0	0	110.9	G365 L371	G365-T369 PolarHBondContact N-O 2.86Å; T369-L371 PolarHBondContact O-N 2.04Å
370	P	69.6	Low	69.7	Low	114 Å²	114	80.9 Å²	80.9	74%	0.74	53%	0.53	S	S	*	.	B	Isolated β-bridge	trans	-64.6	126.6	175.1	-18	30	0	0	0	110.8
371	L	75.4	Confident	69.9	Low	39 Å²	39	82.5 Å²	82.5	20%	0.204	53%	0.53	C	S	.	.	P	Polyproline II helix	trans	-79.8	142.6	175.3	-73.4	164.1	0	0	0	110.8	Q356 G363 T369	Q356-L371 WeakPolarHBondContact O-CD2 3.3Å; G363-L371 PolarHBondContact O-N 3.12Å; T369-L371 PolarHBondContact O-N 2.04Å
372	P	83	Confident	71	Confident	79 Å²	79	84.1 Å²	84.1	51%	0.513	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-65.9	152.9	173.5	29.1	-34.4	0	0	0	110.9	C357 S358	C357-P372 CarbonylContact C-O 3.48Å; C357-P372 VanDerWaalsContact CA-O 3.26Å; C357-P372 WeakPolarHBondContact CA-O 3.35Å; C357-P372 WeakPolarHBondContact CB-O 3.44Å; S358-P372 PolarHBondContact N-O 3.39Å
373	P	83.2	Confident	71.7	Confident	115 Å²	115	91.2 Å²	91.2	75%	0.747	52%	0.522	S	S	*	.	B	Isolated β-bridge	trans	-64	138.3	174.9	27.6	-33.7	0	0	0	110.8	S358	S358-P373 WeakPolarHBondContact O-CA 2.92Å
374	C	83.7	Confident	72.4	Confident	21 Å²	21	98.4 Å²	98.4	14%	0.142	54%	0.544	C	S	.	.	P	Polyproline II helix	trans	-66.3	139.7	175.8	-60.5	0	0	0	0	111.5	C357 S358 L359 L378	C357-C374 HydrophobicContact CB-CB 3.9Å; C357-C374 WeakPolarHBondContact CB-SG 3.46Å; C357-C374 VanDerWaalsContact SG-CA 3.52Å; C357-C374 WeakPolarHBondContact SG-CB 3.42Å; C357-C374 CovalentContact SG-SG 2.02Å; C357-C374 PolarHBondContact SG-SG 3.01Å; S358-C374 PolarHBondContact O-N 3.13Å; L359-C374 HydrophobicContact CD2-CB 3.76Å; L359-C374 HydrophobicContact CG-CB 4.34Å; C374-L378 HydrophobicContact CB-CD2 4.47Å
375	D	83.3	Confident	73.4	Confident	109 Å²	109	93.3 Å²	93.3	58%	0.583	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-65.9	143.3	170.5	-166.7	-13.8	0	0	0	110.3	N377 L378	D375-N377 VanDerWaalsContact C-N 3.3Å; D375-N377 PolarHBondContact O-N 3.47Å; D375-N377 PolarHBondContact OD1-N 3.09Å; D375-L378 HydrophobicContact CB-CB 4.46Å; D375-L378 VanDerWaalsContact O-CB 3.25Å; D375-L378 WeakPolarHBondContact O-CB 3.08Å; D375-L378 PolarHBondContact O-N 3.48Å
376	K	77.4	Confident	74.4	Confident	199 Å²	199	98.4 Å²	98.4	87%	0.865	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-22.8	178.6	-66.4	-175.3	178.8	-178	0	113	L378	K376-L378 VanDerWaalsContact C-N 3.34Å
377	N	78.5	Confident	75.9	Confident	141 Å²	141	94.9 Å²	94.9	75%	0.754	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	9.5	177.6	-69.3	-17.5	0	0	0	113.1	D375 S379	D375-N377 VanDerWaalsContact C-N 3.3Å; D375-N377 PolarHBondContact O-N 3.47Å; D375-N377 PolarHBondContact OD1-N 3.09Å; N377-S379 PolarHBondContact O-N 3.26Å
378	L	82.1	Confident	77.6	Confident	58 Å²	58	91.7 Å²	91.7	30%	0.304	49%	0.485	S	S	.	.			trans	-65.5	130.7	178.3	-158.1	66.7	0	0	0	109.1	W351 F355 C374 D375 K376	W351-L378 HydrophobicContact CZ2-CB 4.29Å; W351-L378 HydrophobicContact CZ2-CG 4.4Å; W351-L378 WeakPolarHBondContact CZ2-O 3.31Å; F355-L378 HydrophobicContact CB-CD2 3.54Å; F355-L378 HydrophobicContact CD1-CD1 3.77Å; F355-L378 HydrophobicContact CD1-CD2 3.5Å; F355-L378 HydrophobicContact CD1-CG 3.66Å; F355-L378 HydrophobicContact CD2-CD2 3.58Å; F355-L378 HydrophobicContact CD2-CG 4.15Å; F355-L378 HydrophobicContact CE1-CD1 3.9Å; F355-L378 HydrophobicContact CE1-CD2 4.03Å; F355-L378 HydrophobicContact CE1-CG 3.69Å; F355-L378 HydrophobicContact CE2-CD2 4.11Å; F355-L378 HydrophobicContact CE2-CG 4.2Å; F355-L378 HydrophobicContact CG-CD1 4.4Å; F355-L378 HydrophobicContact CG-CD2 3.24Å; F355-L378 HydrophobicContact CG-CG 3.89Å; F355-L378 HydrophobicContact CZ-CD2 4.31Å; F355-L378 HydrophobicContact CZ-CG 3.97Å; C374-L378 HydrophobicContact CB-CD2 4.47Å; D375-L378 HydrophobicContact CB-CB 4.46Å; D375-L378 VanDerWaalsContact O-CB 3.25Å; D375-L378 WeakPolarHBondContact O-CB 3.08Å; D375-L378 PolarHBondContact O-N 3.48Å; K376-L378 VanDerWaalsContact C-N 3.34Å
379	S	81.9	Confident	78.8	Confident	81 Å²	81	90.7 Å²	90.7	57%	0.566	47%	0.47	S	S	*	.			trans	-140.7	155.1	176.3	54.8	0	0	0	0	109.1	N377 D381	N377-S379 PolarHBondContact O-N 3.26Å; S379-D381 PolarHBondContact O-N 3Å
380	V	80.1	Confident	80.1	Confident	13 Å²	13	87 Å²	87	8%	0.079	45%	0.446	C	S	.	.			trans	-68.2	114.4	171.3	-179.4	0	0	0	0	107.3	L334 W351 F355 Q382 F385	L334-V380 HydrophobicContact CD2-CB 3.91Å; L334-V380 HydrophobicContact CD2-CG1 3.83Å; W351-V380 HydrophobicContact CH2-CG2 4.12Å; W351-V380 HydrophobicContact CZ3-CG2 3.79Å; F355-V380 HydrophobicContact CE2-CG2 4.44Å; F355-V380 HydrophobicContact CZ-CG2 4.26Å; V380-Q382 PolarHBondContact O-N 3.47Å; V380-Q382 VanDerWaalsContact O-N 3.16Å; V380-F385 HydrophobicContact CG1-CB 4.34Å; V380-F385 HydrophobicContact CG1-CD2 4.1Å
381	D	76.4	Confident	81.3	Confident	71 Å²	71	81.9 Å²	81.9	38%	0.38	41%	0.413	S	S	.	.			trans	-63.3	119.1	-179.6	-173.9	-12.9	0	0	0	109.9	S379 R383 Y384 F385	S379-D381 PolarHBondContact O-N 3Å; D381-R383 PolarHBondContact O-N 2.8Å; D381-R383 VanDerWaalsContact O-N 3.12Å; D381-R383 WeakPolarHBondContact OD1-CB 3.11Å; D381-R383 PolarHBondContact OD1-N 3.18Å; D381-Y384 HydrophobicContact CB-CD2 3.91Å; D381-Y384 CarbonylContact O-C 3.55Å; D381-Y384 PolarHBondContact O-N 3.42Å; D381-Y384 VanDerWaalsContact OD2-CD2 3.26Å; D381-Y384 WeakPolarHBondContact OD2-CD2 3.32Å; D381-Y384 VanDerWaalsContact OD2-CE2 3.32Å; D381-Y384 WeakPolarHBondContact OD2-CE2 3.42Å; D381-F385 PolarHBondContact O-N 3Å; D381-F385 VanDerWaalsContact O-N 3.17Å
382	Q	77.2	Confident	82.2	Confident	154 Å²	154	80.8 Å²	80.8	72%	0.72	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-56.6	-27.3	178.7	-174.9	176.3	-3	0	0	112.6	L334 V380 Y384	L334-Q382 HydrophobicContact CD1-CB 4.17Å; L334-Q382 HydrophobicContact CD1-CG 3.9Å; V380-Q382 PolarHBondContact O-N 3.47Å; V380-Q382 VanDerWaalsContact O-N 3.16Å; Q382-Y384 VanDerWaalsContact C-N 3.28Å; Q382-Y384 PolarHBondContact O-N 3.42Å
383	R	72.4	Confident	82.8	Confident	220 Å²	220	77.8 Å²	77.8	83%	0.83	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-71.8	-22.6	178.8	-63.9	177.6	-178.9	179.6	2.1	113.6	D381	D381-R383 PolarHBondContact O-N 2.8Å; D381-R383 VanDerWaalsContact O-N 3.12Å; D381-R383 WeakPolarHBondContact OD1-CB 3.11Å; D381-R383 PolarHBondContact OD1-N 3.18Å
384	Y	71.9	Confident	83.4	Confident	170 Å²	170	72.3 Å²	72.3	67%	0.667	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-118.4	15.2	-177.8	-57.2	-75.2	0	0	0	111.8	D381 Q382	D381-Y384 HydrophobicContact CB-CD2 3.91Å; D381-Y384 CarbonylContact O-C 3.55Å; D381-Y384 PolarHBondContact O-N 3.42Å; D381-Y384 VanDerWaalsContact OD2-CD2 3.26Å; D381-Y384 WeakPolarHBondContact OD2-CD2 3.32Å; D381-Y384 VanDerWaalsContact OD2-CE2 3.32Å; D381-Y384 WeakPolarHBondContact OD2-CE2 3.42Å; Q382-Y384 VanDerWaalsContact C-N 3.28Å; Q382-Y384 PolarHBondContact O-N 3.42Å
385	F	80.6	Confident	84	Confident	22 Å²	22	71.3 Å²	71.3	10%	0.096	34%	0.343	C	S	.	.			trans	-90.1	112.8	173.9	178.3	-105.6	0	0	0	109.5	N330 F333 L334 V380 D381 P387	N330-F385 HydrophobicContact CB-CE1 3.95Å; F333-F385 HydrophobicContact CB-CZ 4.42Å; F333-F385 HydrophobicContact CD1-CD2 4.24Å; F333-F385 AromaticContact CD1-CE2 3.38Å; F333-F385 HydrophobicContact CD1-CE2 3.38Å; F333-F385 AromaticContact CD1-CZ 3.76Å; F333-F385 HydrophobicContact CD1-CZ 3.76Å; F333-F385 HydrophobicContact CE1-CD2 4.43Å; F333-F385 AromaticContact CE1-CE2 3.66Å; F333-F385 HydrophobicContact CE1-CE2 3.66Å; F333-F385 HydrophobicContact CE1-CZ 4.41Å; F333-F385 HydrophobicContact CG-CE2 4.32Å; F333-F385 HydrophobicContact CG-CZ 4.3Å; L334-F385 HydrophobicContact CD1-CD1 4.29Å; L334-F385 HydrophobicContact CD2-CB 3.96Å; L334-F385 HydrophobicContact CD2-CD1 4.23Å; L334-F385 HydrophobicContact CD2-CD2 4.08Å; L334-F385 HydrophobicContact CD2-CG 3.8Å; L334-F385 HydrophobicContact CG-CD1 4.3Å; L334-F385 HydrophobicContact CG-CG 4.37Å; V380-F385 HydrophobicContact CG1-CB 4.34Å; V380-F385 HydrophobicContact CG1-CD2 4.1Å; D381-F385 PolarHBondContact O-N 3Å; D381-F385 VanDerWaalsContact O-N 3.17Å; F385-P387 HydrophobicContact CE1-CB 4.08Å; F385-P387 HydrophobicContact CZ-CB 4.41Å
386	E	77.2	Confident	84.6	Confident	121 Å²	121	66.4 Å²	66.4	57%	0.565	32%	0.317	S	S	*	.			trans	-106.8	114.1	174.4	-69.1	180	-179.7	0	0	108.5	Q63	Q63-E386 PolarHBondContact NE2-O 3.26Å
387	P	82.9	Confident	85.6	Confident	49 Å²	49	57 Å²	57	32%	0.318	28%	0.276	S	S	.	.			trans	-71.9	136.1	176.7	29.5	-33.4	0	0	0	110.3	N330 F385 I391	N330-P387 WeakPolarHBondContact OD1-CB 3.33Å; F385-P387 HydrophobicContact CE1-CB 4.08Å; F385-P387 HydrophobicContact CZ-CB 4.41Å; P387-I391 HydrophobicContact CB-CD1 4.13Å
388	E	87.9	Confident	86.5	Confident	13 Å²	13	50.2 Å²	50.2	6%	0.061	24%	0.24	C	C	.	.			trans	-66.2	135.6	177.3	-161.6	-85.2	158.3	0	0	111.8	D59 R64 K390 I391	D59-E388 HydrophobicContact CB-CB 4.45Å; D59-E388 HydrophobicContact CB-CG 4.22Å; R64-E388 IonicContact CZ-OE1 3.35Å; R64-E388 IonicContact CZ-OE2 3.3Å; R64-E388 IonicContact NE-OE1 2.82Å; R64-E388 IonicContact NE-OE2 2.84Å; R64-E388 PolarHBondContact NE-OE2 3.15Å; R64-E388 VanDerWaalsContact NH2-CD 3.34Å; R64-E388 IonicContact NH2-OE1 3.31Å; R64-E388 PolarHBondContact NH2-OE1 2.86Å; R64-E388 IonicContact NH2-OE2 2.76Å; E388-K390 VanDerWaalsContact CD-N 3.3Å; E388-K390 PolarHBondContact O-N 2.76Å; E388-K390 VanDerWaalsContact O-N 3.15Å; E388-K390 PolarHBondContact OE1-N 2.93Å; E388-K390 VanDerWaalsContact OE2-CA 3.28Å; E388-K390 WeakPolarHBondContact OE2-CA 3.1Å; E388-K390 VanDerWaalsContact OE2-CB 3.27Å; E388-K390 WeakPolarHBondContact OE2-CB 3.49Å; E388-K390 PolarHBondContact OE2-N 3.37Å; E388-I391 HydrophobicContact CB-CD1 4.13Å; E388-I391 HydrophobicContact CB-CG1 4.24Å; E388-I391 WeakPolarHBondContact O-CB 3.02Å; E388-I391 VanDerWaalsContact O-CD1 3.28Å; E388-I391 WeakPolarHBondContact O-CD1 3.01Å; E388-I391 VanDerWaalsContact O-CG1 3.26Å; E388-I391 WeakPolarHBondContact O-CG1 3.47Å; E388-I391 PolarHBondContact O-N 2.83Å; E388-I391 PolarHBondContact OE2-N 2.88Å
389	S	86.9	Confident	87.2	Confident	29 Å²	29	48.2 Å²	48.2	20%	0.203	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-21.4	-169.8	56.7	0	0	0	0	114.6	E320 A323	E320-S389 VanDerWaalsContact CD-CB 3.48Å; E320-S389 WeakPolarHBondContact OE1-CB 3.39Å; E320-S389 PolarHBondContact OE1-OG 3.34Å; A323-S389 WeakPolarHBondContact CB-O 3.49Å
390	K	91.4	Very high	88	Confident	9 Å²	9	44.4 Å²	44.4	4%	0.039	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	4	-178.8	-59.6	180	165.7	69.4	0	114.3	A168 D297 L321 E388 M392 F393 V394	A168-K390 HydrophobicContact CB-CD 3.86Å; D297-K390 VanDerWaalsContact OD2-CE 3.26Å; D297-K390 WeakPolarHBondContact OD2-CE 3.44Å; D297-K390 IonicContact OD2-NZ 3.8Å; D297-K390 PolarHBondContact OD2-NZ 2.95Å; L321-K390 HydrophobicContact CD1-CD 4.45Å; L321-K390 HydrophobicContact CD1-CG 4.45Å; E388-K390 VanDerWaalsContact CD-N 3.3Å; E388-K390 PolarHBondContact O-N 2.76Å; E388-K390 VanDerWaalsContact O-N 3.15Å; E388-K390 PolarHBondContact OE1-N 2.93Å; E388-K390 VanDerWaalsContact OE2-CA 3.28Å; E388-K390 WeakPolarHBondContact OE2-CA 3.1Å; E388-K390 VanDerWaalsContact OE2-CB 3.27Å; E388-K390 WeakPolarHBondContact OE2-CB 3.49Å; E388-K390 PolarHBondContact OE2-N 3.37Å; K390-M392 PolarHBondContact O-N 3Å; K390-F393 HydrophobicContact CB-CD2 4.13Å; K390-F393 HydrophobicContact CG-CD2 4.23Å; K390-F393 PolarHBondContact O-N 3.43Å; K390-V394 PolarHBondContact O-N 2.87Å
391	I	93.9	Very high	88.8	Confident	7 Å²	7	43.8 Å²	43.8	4%	0.036	20%	0.198	C	C	.	.	H	α-helix	trans	-53.3	-42.9	174.3	-72	164.2	0	0	0	111.6	Q63 A67 I326 F329 P387 E388 F393 V394 V395	Q63-I391 HydrophobicContact CB-CD1 4.36Å; A67-I391 HydrophobicContact CB-CG2 3.95Å; I326-I391 HydrophobicContact CD1-CG2 4.39Å; F329-I391 HydrophobicContact CB-CG2 4.46Å; F329-I391 HydrophobicContact CD1-CD1 3.73Å; F329-I391 HydrophobicContact CD1-CG2 3.92Å; F329-I391 HydrophobicContact CE1-CD1 3.45Å; F329-I391 VanDerWaalsContact CE1-CD1 3.45Å; F329-I391 HydrophobicContact CE1-CG1 4.25Å; F329-I391 HydrophobicContact CE1-CG2 4.33Å; F329-I391 HydrophobicContact CG-CG2 4.01Å; F329-I391 HydrophobicContact CZ-CD1 4.35Å; P387-I391 HydrophobicContact CB-CD1 4.13Å; E388-I391 HydrophobicContact CB-CD1 4.13Å; E388-I391 HydrophobicContact CB-CG1 4.24Å; E388-I391 WeakPolarHBondContact O-CB 3.02Å; E388-I391 VanDerWaalsContact O-CD1 3.28Å; E388-I391 WeakPolarHBondContact O-CD1 3.01Å; E388-I391 VanDerWaalsContact O-CG1 3.26Å; E388-I391 WeakPolarHBondContact O-CG1 3.47Å; E388-I391 PolarHBondContact O-N 2.83Å; E388-I391 PolarHBondContact OE2-N 2.88Å; I391-F393 VanDerWaalsContact C-N 3.28Å; I391-F393 PolarHBondContact O-N 2.68Å; I391-V394 WeakPolarHBondContact O-CB 3.34Å; I391-V394 PolarHBondContact O-N 2.79Å; I391-V394 VanDerWaalsContact O-N 3.15Å; I391-V395 HydrophobicContact CG2-CG2 4.49Å; I391-V395 WeakPolarHBondContact O-CG2 3.48Å; I391-V395 PolarHBondContact O-N 2.95Å
392	M	93.6	Very high	89.8	Confident	15 Å²	15	40.4 Å²	40.4	7%	0.074	18%	0.18	C	C	.	.	H	α-helix	trans	-57.4	-40.6	177.9	-174.9	-168.5	72.6	0	0	112.2	A323 N324 I326 K390 V395 N396	A323-M392 HydrophobicContact CB-CB 4.46Å; A323-M392 HydrophobicContact CB-CE 3.88Å; A323-M392 HydrophobicContact CB-SD 4.41Å; N324-M392 HydrophobicContact CB-SD 4.19Å; N324-M392 PolarHBondContact N-SD 3.1Å; N324-M392 VanDerWaalsContact N-SD 3.42Å; I326-M392 HydrophobicContact CD1-CB 4.26Å; I326-M392 HydrophobicContact CD1-CG 4.48Å; K390-M392 PolarHBondContact O-N 3Å; M392-V395 PolarHBondContact O-N 3.01Å; M392-N396 VanDerWaalsContact O-CB 3.32Å; M392-N396 WeakPolarHBondContact O-CB 3.49Å; M392-N396 PolarHBondContact O-N 2.04Å; M392-N396 PolarHBondContact O-ND2 3.16Å
393	F	95.3	Very high	90.7	Very high	16 Å²	16	35 Å²	35	7%	0.07	16%	0.155	C	C	.	.	H	α-helix	trans	-70.2	-34.3	179.2	-62.6	-67.7	0	0	0	112.4	Y167 T186 V187 L321 A323 K390 I391 N396 A397	Y167-F393 WeakPolarHBondContact O-CB 3.42Å; T186-F393 WeakPolarHBondContact O-CD1 3.49Å; T186-F393 PolarHBondContact OG1-O 3.02Å; V187-F393 HydrophobicContact CG1-CB 4.03Å; V187-F393 HydrophobicContact CG1-CD1 3.79Å; V187-F393 HydrophobicContact CG1-CD2 3.97Å; V187-F393 HydrophobicContact CG1-CE1 4.26Å; V187-F393 HydrophobicContact CG1-CE2 4.45Å; V187-F393 HydrophobicContact CG1-CG 3.65Å; L321-F393 HydrophobicContact CB-CE2 3.53Å; L321-F393 HydrophobicContact CB-CZ 3.75Å; L321-F393 HydrophobicContact CD1-CD2 4.17Å; L321-F393 HydrophobicContact CD1-CE2 3.77Å; L321-F393 HydrophobicContact CD1-CZ 4.22Å; L321-F393 HydrophobicContact CG-CE2 4.3Å; A323-F393 HydrophobicContact CB-CE2 3.91Å; A323-F393 HydrophobicContact CB-CZ 4.36Å; K390-F393 HydrophobicContact CB-CD2 4.13Å; K390-F393 HydrophobicContact CG-CD2 4.23Å; K390-F393 PolarHBondContact O-N 3.43Å; I391-F393 VanDerWaalsContact C-N 3.28Å; I391-F393 PolarHBondContact O-N 2.68Å; F393-N396 PolarHBondContact O-N 3.05Å; F393-A397 WeakPolarHBondContact O-CB 3.48Å; F393-A397 PolarHBondContact O-N 3.18Å
394	V	96.9	Very high	91.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62.2	-50.8	173.1	179.9	0	0	0	0	110.1	F41 R64 A67 M68 Y167 K390 I391 N396 A397 V398	F41-V394 HydrophobicContact CE1-CG1 4.09Å; F41-V394 HydrophobicContact CZ-CG1 4.29Å; R64-V394 HydrophobicContact CB-CG2 4.09Å; R64-V394 HydrophobicContact CG-CG2 4.21Å; A67-V394 HydrophobicContact CB-CB 4.39Å; A67-V394 HydrophobicContact CB-CG1 4.19Å; M68-V394 HydrophobicContact CB-CG1 4.2Å; Y167-V394 HydrophobicContact CD1-CG2 4.03Å; Y167-V394 HydrophobicContact CD2-CG2 3.53Å; Y167-V394 HydrophobicContact CE1-CG2 4.44Å; Y167-V394 HydrophobicContact CE2-CG2 4.01Å; Y167-V394 HydrophobicContact CG-CB 4.4Å; Y167-V394 HydrophobicContact CG-CG2 3.55Å; K390-V394 PolarHBondContact O-N 2.87Å; I391-V394 WeakPolarHBondContact O-CB 3.34Å; I391-V394 PolarHBondContact O-N 2.79Å; I391-V394 VanDerWaalsContact O-N 3.15Å; V394-N396 VanDerWaalsContact C-N 3.34Å; V394-N396 PolarHBondContact O-N 2.99Å; V394-A397 WeakPolarHBondContact O-CB 3.19Å; V394-A397 PolarHBondContact O-N 3.37Å; V394-A397 VanDerWaalsContact O-N 3.16Å; V394-V398 WeakPolarHBondContact O-CG2 3.45Å; V394-V398 PolarHBondContact O-N 2.04Å; V394-V398 VanDerWaalsContact O-N 3.12Å
395	V	96.5	Very high	93	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-59.5	-47.3	178.3	176.6	0	0	0	0	110.1	A67 A71 I326 I391 M392 A397 V398 Y399 P444 F445	A67-V395 HydrophobicContact CB-CG2 4.46Å; A71-V395 HydrophobicContact CB-CG1 4.24Å; A71-V395 HydrophobicContact CB-CG2 4.43Å; I326-V395 HydrophobicContact CD1-CB 4.28Å; I326-V395 HydrophobicContact CD1-CG2 4.02Å; I391-V395 HydrophobicContact CG2-CG2 4.49Å; I391-V395 WeakPolarHBondContact O-CG2 3.48Å; I391-V395 PolarHBondContact O-N 2.95Å; M392-V395 PolarHBondContact O-N 3.01Å; V395-A397 VanDerWaalsContact C-N 3.28Å; V395-A397 PolarHBondContact O-N 3.23Å; V395-V398 PolarHBondContact O-N 3.01Å; V395-Y399 HydrophobicContact CG1-CD2 3.72Å; V395-Y399 HydrophobicContact CG1-CE2 3.78Å; V395-Y399 WeakPolarHBondContact O-CD2 3.38Å; V395-Y399 PolarHBondContact O-N 3.27Å; V395-P444 HydrophobicContact CG1-CG 3.98Å; V395-F445 HydrophobicContact CG1-CD2 4.39Å; V395-F445 HydrophobicContact CG1-CE2 4.33Å
396	N	95.9	Very high	93.6	Very high	7 Å²	7	16.6 Å²	16.6	4%	0.037	9%	0.085	C	C	.	.	H	α-helix	trans	-60.4	-35.8	177.6	-71.8	-13.9	0	0	0	112.7	T186 M392 F393 V394 A400 V454	T186-N396 HydrophobicContact CG2-CB 4.21Å; M392-N396 VanDerWaalsContact O-CB 3.32Å; M392-N396 WeakPolarHBondContact O-CB 3.49Å; M392-N396 PolarHBondContact O-N 2.04Å; M392-N396 PolarHBondContact O-ND2 3.16Å; F393-N396 PolarHBondContact O-N 3.05Å; V394-N396 VanDerWaalsContact C-N 3.34Å; V394-N396 PolarHBondContact O-N 2.99Å; N396-A400 WeakPolarHBondContact O-CB 3.11Å; N396-A400 PolarHBondContact O-N 2.87Å; N396-V454 HydrophobicContact CB-CG1 4.43Å; N396-V454 HydrophobicContact CB-CG2 4.11Å
397	A	97.7	Very high	94.4	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-67.2	-41.7	177.8	0	0	0	0	0	111.6	I142 I165 T186 F393 V394 V395 A400 M401	I142-A397 HydrophobicContact CD1-CB 4.36Å; I142-A397 HydrophobicContact CG2-CB 4.06Å; I165-A397 HydrophobicContact CB-CB 4.44Å; I165-A397 HydrophobicContact CG2-CB 3.75Å; T186-A397 HydrophobicContact CG2-CB 3.85Å; F393-A397 WeakPolarHBondContact O-CB 3.48Å; F393-A397 PolarHBondContact O-N 3.18Å; V394-A397 WeakPolarHBondContact O-CB 3.19Å; V394-A397 PolarHBondContact O-N 3.37Å; V394-A397 VanDerWaalsContact O-N 3.16Å; V395-A397 VanDerWaalsContact C-N 3.28Å; V395-A397 PolarHBondContact O-N 3.23Å; A397-A400 PolarHBondContact O-N 2.82Å; A397-M401 PolarHBondContact O-N 2.82Å; A397-M401 VanDerWaalsContact O-N 3.08Å
398	V	97.9	Very high	94.9	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-65.2	-46.5	175.6	-179.8	0	0	0	0	110.7	M68 A71 I72 I75 I142 V394 V395 A400 M401 A402	M68-V398 HydrophobicContact CB-CG2 4.33Å; M68-V398 HydrophobicContact CG-CG2 3.92Å; A71-V398 HydrophobicContact CB-CB 3.94Å; A71-V398 HydrophobicContact CB-CG1 3.88Å; A71-V398 HydrophobicContact CB-CG2 4.26Å; I72-V398 HydrophobicContact CD1-CG1 3.7Å; I72-V398 HydrophobicContact CG1-CG1 4.06Å; I75-V398 HydrophobicContact CD1-CG1 3.73Å; I142-V398 HydrophobicContact CG1-CG2 4.29Å; I142-V398 HydrophobicContact CG2-CG2 4.35Å; V394-V398 WeakPolarHBondContact O-CG2 3.45Å; V394-V398 PolarHBondContact O-N 2.04Å; V394-V398 VanDerWaalsContact O-N 3.12Å; V395-V398 PolarHBondContact O-N 3.01Å; V398-A400 VanDerWaalsContact C-N 3.34Å; V398-A400 PolarHBondContact O-N 2.79Å; V398-M401 PolarHBondContact O-N 3.16Å; V398-A402 WeakPolarHBondContact O-CB 3.25Å; V398-A402 PolarHBondContact O-N 3.42Å
399	Y	97.3	Very high	95.1	Very high	16 Å²	16	11.3 Å²	11.3	6%	0.063	6%	0.058	C	C	.	.	H	α-helix	trans	-64.5	-37.3	176.8	-87.9	-100.7	0	0	0	112.3	A71 I75 V395 M401 A402 H403 P444 F445	A71-Y399 HydrophobicContact CB-CD2 4.4Å; A71-Y399 HydrophobicContact CB-CE2 4.15Å; I75-Y399 HydrophobicContact CD1-CD1 4.43Å; I75-Y399 HydrophobicContact CD1-CD2 3.95Å; I75-Y399 HydrophobicContact CD1-CE1 4.46Å; I75-Y399 HydrophobicContact CD1-CE2 3.98Å; I75-Y399 HydrophobicContact CD1-CG 4.2Å; I75-Y399 HydrophobicContact CG1-CD1 4.28Å; I75-Y399 HydrophobicContact CG1-CD2 4.32Å; I75-Y399 HydrophobicContact CG1-CE1 3.89Å; I75-Y399 HydrophobicContact CG1-CE2 3.93Å; I75-Y399 HydrophobicContact CG1-CG 4.5Å; V395-Y399 HydrophobicContact CG1-CD2 3.72Å; V395-Y399 HydrophobicContact CG1-CE2 3.78Å; V395-Y399 WeakPolarHBondContact O-CD2 3.38Å; V395-Y399 PolarHBondContact O-N 3.27Å; Y399-M401 VanDerWaalsContact C-N 3.35Å; Y399-M401 PolarHBondContact O-N 2.86Å; Y399-A402 PolarHBondContact O-N 2.96Å; Y399-H403 WeakPolarHBondContact O-CB 3.27Å; Y399-H403 PolarHBondContact O-CD2 3.41Å; Y399-H403 PolarHBondContact O-N 3.48Å; Y399-P444 HydrophobicContact CD1-CB 4.34Å; Y399-P444 HydrophobicContact CD1-CG 3.93Å; Y399-P444 HydrophobicContact CD2-CG 3.75Å; Y399-P444 HydrophobicContact CE1-CB 4.02Å; Y399-P444 HydrophobicContact CE1-CG 4.02Å; Y399-P444 HydrophobicContact CE2-CB 4.37Å; Y399-P444 HydrophobicContact CE2-CG 3.85Å; Y399-P444 HydrophobicContact CG-CG 3.79Å; Y399-F445 HydrophobicContact CE2-CE2 4.34Å
400	A	97.6	Very high	95.3	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-61	-44.4	174.8	0	0	0	0	0	111.5	I165 N396 A397 V398 A404 V439 F441 F456	I165-A400 HydrophobicContact CD1-CB 4.25Å; N396-A400 WeakPolarHBondContact O-CB 3.11Å; N396-A400 PolarHBondContact O-N 2.87Å; A397-A400 PolarHBondContact O-N 2.82Å; V398-A400 VanDerWaalsContact C-N 3.34Å; V398-A400 PolarHBondContact O-N 2.79Å; A400-A404 WeakPolarHBondContact O-CB 3.2Å; A400-A404 PolarHBondContact O-N 2.85Å; A400-V439 HydrophobicContact CB-CG2 4.26Å; A400-F441 HydrophobicContact CB-CE1 3.87Å; A400-F441 HydrophobicContact CB-CZ 4.09Å; A400-F456 HydrophobicContact CB-CE2 4.13Å; A400-F456 HydrophobicContact CB-CZ 3.97Å
401	M	97.6	Very high	95.2	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-63.4	-44.4	174.2	-171.6	63	74.2	0	0	111.6	L37 I142 P163 I165 A397 V398 Y399 H403 A404 L405 L431 I436	L37-M401 HydrophobicContact CD1-CB 4.33Å; L37-M401 HydrophobicContact CD1-CG 3.98Å; L37-M401 HydrophobicContact CD2-CG 3.69Å; I142-M401 HydrophobicContact CD1-CB 4.17Å; I142-M401 HydrophobicContact CD1-CE 4.44Å; P163-M401 HydrophobicContact CG-CE 4.44Å; I165-M401 HydrophobicContact CD1-CB 4.25Å; I165-M401 HydrophobicContact CD1-CE 3.78Å; I165-M401 HydrophobicContact CG1-CE 3.9Å; A397-M401 PolarHBondContact O-N 2.82Å; A397-M401 VanDerWaalsContact O-N 3.08Å; V398-M401 PolarHBondContact O-N 3.16Å; Y399-M401 VanDerWaalsContact C-N 3.35Å; Y399-M401 PolarHBondContact O-N 2.86Å; M401-H403 PolarHBondContact O-N 3.32Å; M401-A404 PolarHBondContact O-N 2.93Å; M401-L405 HydrophobicContact CG-CD1 4.1Å; M401-L405 WeakPolarHBondContact O-CB 3.49Å; M401-L405 VanDerWaalsContact O-CG 3.32Å; M401-L405 WeakPolarHBondContact O-CG 3.47Å; M401-L405 PolarHBondContact O-N 3.15Å; M401-L431 HydrophobicContact SD-CD2 4.4Å; M401-I436 HydrophobicContact CE-CD1 3.87Å; M401-I436 HydrophobicContact SD-CD1 3.92Å; M401-I436 HydrophobicContact SD-CG1 4.49Å
402	A	96.8	Very high	95	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-63.4	-42.3	179	0	0	0	0	0	112.7	I75 V81 L82 L87 V398 Y399 L405 H406	I75-A402 HydrophobicContact CD1-CB 3.79Å; I75-A402 HydrophobicContact CG1-CB 4.48Å; I75-A402 HydrophobicContact CG2-CB 4.21Å; V81-A402 HydrophobicContact CG1-CB 4.05Å; L82-A402 HydrophobicContact CD1-CB 4.23Å; L87-A402 HydrophobicContact CD1-CB 4.05Å; V398-A402 WeakPolarHBondContact O-CB 3.25Å; V398-A402 PolarHBondContact O-N 3.42Å; Y399-A402 PolarHBondContact O-N 2.96Å; A402-L405 PolarHBondContact O-N 3.17Å; A402-H406 VanDerWaalsContact O-CB 3.3Å; A402-H406 WeakPolarHBondContact O-CB 3.24Å; A402-H406 PolarHBondContact O-N 3.27Å
403	H	96.8	Very high	94.8	Very high	42 Å²	42	19.4 Å²	19.4	19%	0.194	10%	0.095	C	C	.	.	H	α-helix	trans	-66	-38.7	174	-81.3	-70.1	0	0	0	112.1	Y399 M401 H406 N407 V439 F441	Y399-H403 WeakPolarHBondContact O-CB 3.27Å; Y399-H403 PolarHBondContact O-CD2 3.41Å; Y399-H403 PolarHBondContact O-N 3.48Å; M401-H403 PolarHBondContact O-N 3.32Å; H403-H406 PolarHBondContact O-N 2.89Å; H403-N407 WeakPolarHBondContact O-CB 3.26Å; H403-N407 PolarHBondContact O-N 3.01Å; H403-N407 PolarHBondContact O-ND2 2.66Å; H403-V439 HydrophobicContact CB-CG1 4.42Å; H403-F441 HydrophobicContact CB-CD1 4.42Å; H403-F441 AromaticContact CD2-CD1 3.69Å; H403-F441 AromaticContact CD2-CD2 3.77Å; H403-F441 AromaticContact CD2-CG 3.53Å; H403-F441 AromaticContact NE2-CD2 3.81Å; H403-F441 AromaticContact NE2-CG 3.76Å
404	A	96.7	Very high	94.2	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.4	-47.1	174.6	0	0	0	0	0	111.4	A400 M401 H406 N407 M408 L431 I436 V439	A400-A404 WeakPolarHBondContact O-CB 3.2Å; A400-A404 PolarHBondContact O-N 2.85Å; M401-A404 PolarHBondContact O-N 2.93Å; A404-H406 VanDerWaalsContact C-N 3.33Å; A404-H406 PolarHBondContact O-N 3.27Å; A404-N407 PolarHBondContact O-N 2.79Å; A404-M408 WeakPolarHBondContact O-CB 3.49Å; A404-M408 PolarHBondContact O-N 3.01Å; A404-L431 HydrophobicContact CB-CD1 4.15Å; A404-I436 HydrophobicContact CB-CB 4.42Å; A404-I436 HydrophobicContact CB-CG1 3.64Å; A404-V439 HydrophobicContact CB-CG1 3.81Å
405	L	94.9	Very high	93.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-63	-38.7	175.2	-70.6	170.8	0	0	0	111.8	L35 L37 L82 L87 M401 A402 M408 Q409 L426 L431	L35-L405 HydrophobicContact CD1-CD1 3.99Å; L35-L405 HydrophobicContact CD1-CD2 4.09Å; L35-L405 HydrophobicContact CD1-CG 4.43Å; L37-L405 HydrophobicContact CD2-CD1 4.23Å; L82-L405 HydrophobicContact CD1-CB 4.33Å; L82-L405 HydrophobicContact CD2-CB 4.2Å; L87-L405 HydrophobicContact CD2-CD1 4.23Å; M401-L405 HydrophobicContact CG-CD1 4.1Å; M401-L405 WeakPolarHBondContact O-CB 3.49Å; M401-L405 VanDerWaalsContact O-CG 3.32Å; M401-L405 WeakPolarHBondContact O-CG 3.47Å; M401-L405 PolarHBondContact O-N 3.15Å; A402-L405 PolarHBondContact O-N 3.17Å; L405-M408 PolarHBondContact O-N 3.35Å; L405-Q409 WeakPolarHBondContact O-CB 3.21Å; L405-Q409 PolarHBondContact O-N 3.09Å; L405-L426 HydrophobicContact CD2-CD2 4.36Å; L405-L431 HydrophobicContact CD2-CD1 3.94Å; L405-L431 HydrophobicContact CD2-CD2 3.95Å; L405-L431 HydrophobicContact CG-CD1 4.47Å
406	H	94.2	Very high	92.8	Very high	25 Å²	25	36.1 Å²	36.1	12%	0.116	19%	0.186	C	C	.	.	H	α-helix	trans	-62.3	-48.9	175.3	-177	74.5	0	0	0	111.6	T80 V81 L82 A402 H403 A404 M408 Q409 R410	T80-H406 PolarHBondContact O-CE1 3.46Å; V81-H406 HydrophobicContact CG1-CB 4.41Å; L82-H406 HydrophobicContact CD2-CB 4.09Å; L82-H406 HydrophobicContact CG-CB 4.14Å; L82-H406 PolarHBondContact N-ND1 2.85Å; A402-H406 VanDerWaalsContact O-CB 3.3Å; A402-H406 WeakPolarHBondContact O-CB 3.24Å; A402-H406 PolarHBondContact O-N 3.27Å; H403-H406 PolarHBondContact O-N 2.89Å; A404-H406 VanDerWaalsContact C-N 3.33Å; A404-H406 PolarHBondContact O-N 3.27Å; H406-M408 VanDerWaalsContact C-N 3.27Å; H406-M408 PolarHBondContact O-N 2.97Å; H406-Q409 WeakPolarHBondContact O-CB 3.27Å; H406-Q409 PolarHBondContact O-N 3.11Å; H406-Q409 VanDerWaalsContact O-N 3.16Å; H406-R410 PolarHBondContact CE1-NE 3.42Å; H406-R410 VanDerWaalsContact CE1-NE 3.34Å; H406-R410 PolarHBondContact NE2-NE 2.82Å; H406-R410 WeakPolarHBondContact O-CG 3.35Å; H406-R410 PolarHBondContact O-N 2.98Å
407	N	94.3	Very high	92.1	Very high	67 Å²	67	39.2 Å²	39.2	36%	0.358	21%	0.205	S	C	.	.	H	α-helix	trans	-63.1	-37.9	178.5	-69.1	-16.8	0	0	0	111.1	H403 A404 R410 S411 Y435	H403-N407 WeakPolarHBondContact O-CB 3.26Å; H403-N407 PolarHBondContact O-N 3.01Å; H403-N407 PolarHBondContact O-ND2 2.66Å; A404-N407 PolarHBondContact O-N 2.79Å; N407-R410 PolarHBondContact O-N 2.82Å; N407-S411 VanDerWaalsContact O-CB 3.27Å; N407-S411 WeakPolarHBondContact O-CB 3.43Å; N407-S411 PolarHBondContact O-N 2.9Å; N407-Y435 HydrophobicContact CB-CD1 3.86Å; N407-Y435 HydrophobicContact CB-CE1 4.47Å
408	M	93.1	Very high	91.5	Very high	2 Å²	2	46 Å²	46	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-64.1	-43.5	173	-173.8	171.9	-179.2	0	0	111.9	A404 L405 H406 S411 L412 M423 L426 L431 Y435	A404-M408 WeakPolarHBondContact O-CB 3.49Å; A404-M408 PolarHBondContact O-N 3.01Å; L405-M408 PolarHBondContact O-N 3.35Å; H406-M408 VanDerWaalsContact C-N 3.27Å; H406-M408 PolarHBondContact O-N 2.97Å; M408-S411 PolarHBondContact O-N 2.97Å; M408-L412 HydrophobicContact CE-CD1 3.54Å; M408-L412 HydrophobicContact CG-CD1 3.63Å; M408-L412 HydrophobicContact CG-CG 4.24Å; M408-L412 WeakPolarHBondContact O-CB 2.73Å; M408-L412 WeakPolarHBondContact O-CG 2.89Å; M408-L412 PolarHBondContact O-N 3Å; M408-L412 HydrophobicContact SD-CD1 4.43Å; M408-M423 HydrophobicContact CB-CE 4.41Å; M408-M423 HydrophobicContact CG-CE 4.22Å; M408-L426 HydrophobicContact CE-CD2 3.99Å; M408-L426 HydrophobicContact SD-CD2 4.11Å; M408-L431 HydrophobicContact SD-CB 4.1Å; M408-L431 HydrophobicContact SD-CD1 3.87Å; M408-L431 HydrophobicContact SD-CG 4.48Å; M408-Y435 VanDerWaalsContact CA-CE1 3.49Å; M408-Y435 HydrophobicContact CB-CD1 4.08Å; M408-Y435 HydrophobicContact CB-CD2 3.84Å; M408-Y435 HydrophobicContact CB-CE1 4.09Å; M408-Y435 HydrophobicContact CB-CE2 3.82Å; M408-Y435 HydrophobicContact CB-CG 3.95Å; M408-Y435 HydrophobicContact CG-CD2 4Å; M408-Y435 HydrophobicContact CG-CE2 3.64Å; M408-Y435 HydrophobicContact SD-CD2 4.2Å; M408-Y435 HydrophobicContact SD-CE2 4.2Å
409	Q	91.4	Very high	90.8	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.009	25%	0.245	C	C	.	.	H	α-helix	trans	-61.2	-46.3	175.4	-172	-167.7	15.2	0	0	112	L405 H406 S411 L412 C413 T417 K418 M423	L405-Q409 WeakPolarHBondContact O-CB 3.21Å; L405-Q409 PolarHBondContact O-N 3.09Å; H406-Q409 WeakPolarHBondContact O-CB 3.27Å; H406-Q409 PolarHBondContact O-N 3.11Å; H406-Q409 VanDerWaalsContact O-N 3.16Å; Q409-S411 PolarHBondContact O-N 1.99Å; Q409-L412 PolarHBondContact O-N 3.02Å; Q409-C413 HydrophobicContact CG-CB 4.22Å; Q409-C413 WeakPolarHBondContact O-CA 3.43Å; Q409-C413 WeakPolarHBondContact O-CB 3.29Å; Q409-C413 PolarHBondContact O-N 3.18Å; Q409-T417 VanDerWaalsContact NE2-C 3.32Å; Q409-T417 PolarHBondContact NE2-O 2.92Å; Q409-K418 PolarHBondContact NE2-O 3.06Å; Q409-M423 WeakPolarHBondContact CA-SD 3.09Å; Q409-M423 HydrophobicContact CB-CE 4.13Å; Q409-M423 HydrophobicContact CB-SD 3.67Å; Q409-M423 HydrophobicContact CG-SD 3.96Å
410	R	90.8	Very high	90.3	Very high	126 Å²	126	48.4 Å²	48.4	48%	0.475	25%	0.251	S	S	.	.	H	α-helix	trans	-63.4	-32.8	178	-67.9	-59.9	-171.1	-175.3	1.1	112.7	H406 N407	H406-R410 PolarHBondContact CE1-NE 3.42Å; H406-R410 VanDerWaalsContact CE1-NE 3.34Å; H406-R410 PolarHBondContact NE2-NE 2.82Å; H406-R410 WeakPolarHBondContact O-CG 3.35Å; H406-R410 PolarHBondContact O-N 2.98Å; N407-R410 PolarHBondContact O-N 2.82Å
411	S	91	Very high	89.5	Confident	59 Å²	59	54.1 Å²	54.1	41%	0.413	28%	0.281	S	S	.	.	H	α-helix	trans	-77.5	-40.4	178.9	177.8	0	0	0	0	113	N407 M408 Q409 Y435	N407-S411 VanDerWaalsContact O-CB 3.27Å; N407-S411 WeakPolarHBondContact O-CB 3.43Å; N407-S411 PolarHBondContact O-N 2.9Å; M408-S411 PolarHBondContact O-N 2.97Å; Q409-S411 PolarHBondContact O-N 1.99Å; S411-Y435 WeakPolarHBondContact CB-OH 3.47Å; S411-Y435 PolarHBondContact OG-OH 2.61Å
412	L	89.4	Confident	88.7	Confident	39 Å²	39	58 Å²	58	20%	0.204	31%	0.308	C	S	.	.	H	α-helix	trans	-95.8	-38.3	-173.3	-61	-178.5	0	0	0	113.8	M408 Q409 L414 M423	M408-L412 HydrophobicContact CE-CD1 3.54Å; M408-L412 HydrophobicContact CG-CD1 3.63Å; M408-L412 HydrophobicContact CG-CG 4.24Å; M408-L412 WeakPolarHBondContact O-CB 2.73Å; M408-L412 WeakPolarHBondContact O-CG 2.89Å; M408-L412 PolarHBondContact O-N 3Å; M408-L412 HydrophobicContact SD-CD1 4.43Å; Q409-L412 PolarHBondContact O-N 3.02Å; L412-L414 PolarHBondContact O-N 3.09Å; L412-M423 HydrophobicContact CB-CG 4.44Å; L412-M423 HydrophobicContact CD1-CG 4.07Å
413	C	88.7	Confident	88	Confident	6 Å²	6	58 Å²	58	4%	0.041	31%	0.308	C	S	.	.	S	Bend	trans	-104.2	67.5	-174.2	-52.8	0	0	0	0	110.6	Q409 N415 T416 C420 M423	Q409-C413 HydrophobicContact CG-CB 4.22Å; Q409-C413 WeakPolarHBondContact O-CA 3.43Å; Q409-C413 WeakPolarHBondContact O-CB 3.29Å; Q409-C413 PolarHBondContact O-N 3.18Å; C413-N415 PolarHBondContact O-N 3.37Å; C413-T416 HydrophobicContact CB-CG2 3.61Å; C413-C420 WeakPolarHBondContact CA-SG 3.22Å; C413-C420 HydrophobicContact CB-CB 3.72Å; C413-C420 WeakPolarHBondContact CB-SG 3.45Å; C413-C420 WeakPolarHBondContact SG-CB 3.34Å; C413-C420 PolarHBondContact SG-N 3.31Å; C413-C420 CovalentContact SG-SG 2.04Å; C413-C420 PolarHBondContact SG-SG 3.48Å; C413-M423 VanDerWaalsContact SG-SD 3.63Å
414	L	83	Confident	86.9	Confident	135 Å²	135	63.2 Å²	63.2	71%	0.707	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	133.3	177.4	-65.4	166.2	0	0	0	110.5	L412 T416	L412-L414 PolarHBondContact O-N 3.09Å; L414-T416 VanDerWaalsContact C-N 3.35Å; L414-T416 PolarHBondContact O-N 3.2Å
415	N	80.6	Confident	85.9	Confident	180 Å²	180	66.5 Å²	66.5	96%	0.963	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	17.4	176.1	-58.2	-26.1	0	0	0	117.6	C413	C413-N415 PolarHBondContact O-N 3.37Å
416	T	82.5	Confident	85.2	Confident	52 Å²	52	68.9 Å²	68.9	32%	0.319	37%	0.37	S	S	.	.			trans	-131.5	149.8	170.9	-178.3	0	0	0	0	111.7	C413 L414 K418	C413-T416 HydrophobicContact CB-CG2 3.61Å; L414-T416 VanDerWaalsContact C-N 3.35Å; L414-T416 PolarHBondContact O-N 3.2Å; T416-K418 WeakPolarHBondContact CG2-O 3.43Å; T416-K418 PolarHBondContact OG1-N 3.46Å
417	T	81.6	Confident	84.9	Confident	72 Å²	72	71.1 Å²	71.1	44%	0.442	38%	0.383	S	S	.	.	S	Bend	trans	-95	-10.4	169.4	51.5	0	0	0	0	111.9	P83 G84 V85 Q409	P83-T417 HydrophobicContact CG-CG2 4.44Å; P83-T417 CarbonylContact O-C 3.6Å; P83-T417 VanDerWaalsContact O-CB 3.27Å; P83-T417 WeakPolarHBondContact O-CB 3.33Å; G84-T417 CarbonylContact C-O 3.58Å; V85-T417 WeakPolarHBondContact CG2-O 3.03Å; Q409-T417 VanDerWaalsContact NE2-C 3.32Å; Q409-T417 PolarHBondContact NE2-O 2.92Å
418	K	84.8	Confident	84.6	Confident	144 Å²	144	68.2 Å²	68.2	63%	0.626	37%	0.369	S	S	*	.	S	Bend	trans	-92	167.7	175.8	-62.4	-171.8	176.8	-171.9	0	111.5	Q409 T416 C420	Q409-K418 PolarHBondContact NE2-O 3.06Å; T416-K418 WeakPolarHBondContact CG2-O 3.43Å; T416-K418 PolarHBondContact OG1-N 3.46Å; K418-C420 PolarHBondContact O-N 3.5Å
419	L	84.8	Confident	84.5	Confident	39 Å²	39	74.7 Å²	74.7	20%	0.204	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-65.4	131.3	170.3	-71.8	174.7	0	0	0	111.1	D34 L35 V85 M423	D34-L419 HydrophobicContact CB-CD1 3.65Å; D34-L419 HydrophobicContact CB-CG 4.49Å; D34-L419 WeakPolarHBondContact O-CD1 3.25Å; L35-L419 HydrophobicContact CD1-CD2 4.1Å; L35-L419 HydrophobicContact CD2-CD1 3.84Å; L35-L419 HydrophobicContact CD2-CD2 4.14Å; L35-L419 HydrophobicContact CG-CD1 3.95Å; L35-L419 HydrophobicContact CG-CD2 4.14Å; V85-L419 HydrophobicContact CG1-CD1 4.23Å; V85-L419 HydrophobicContact CG1-CD2 4.15Å; V85-L419 HydrophobicContact CG1-CG 3.96Å; V85-L419 HydrophobicContact CG2-CD2 4.28Å; V85-L419 HydrophobicContact CG2-CG 3.99Å; L419-M423 HydrophobicContact CD2-CB 3.94Å; L419-M423 HydrophobicContact CD2-CE 4.07Å; L419-M423 HydrophobicContact CD2-SD 4.04Å
420	C	85.1	Confident	84.6	Confident	27 Å²	27	79.2 Å²	79.2	18%	0.182	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-93.6	165.3	170.3	65.7	0	0	0	0	111.2	C413 K418 S422 M423 K424	C413-C420 WeakPolarHBondContact CA-SG 3.22Å; C413-C420 HydrophobicContact CB-CB 3.72Å; C413-C420 WeakPolarHBondContact CB-SG 3.45Å; C413-C420 WeakPolarHBondContact SG-CB 3.34Å; C413-C420 PolarHBondContact SG-N 3.31Å; C413-C420 CovalentContact SG-SG 2.04Å; C413-C420 PolarHBondContact SG-SG 3.48Å; K418-C420 PolarHBondContact O-N 3.5Å; C420-S422 PolarHBondContact O-N 3.2Å; C420-S422 VanDerWaalsContact O-N 3.16Å; C420-M423 PolarHBondContact O-N 3.34Å; C420-K424 PolarHBondContact O-N 2.97Å
421	D	81.6	Confident	84.8	Confident	119 Å²	119	73.2 Å²	73.2	64%	0.636	39%	0.387	S	S	*	.	H	α-helix	trans	-59.1	-30.4	-178.1	-64	-38.4	0	0	0	113	M423 K424	D421-M423 PolarHBondContact O-N 2.63Å; D421-M423 VanDerWaalsContact O-N 3.16Å; D421-K424 PolarHBondContact O-N 3.27Å; D421-K424 VanDerWaalsContact O-N 3.14Å; D421-K424 WeakPolarHBondContact OD1-CD 3.42Å; D421-K424 VanDerWaalsContact OD1-CE 3.24Å; D421-K424 WeakPolarHBondContact OD1-CE 3.45Å; D421-K424 IonicContact OD1-NZ 3.39Å; D421-K424 PolarHBondContact OD1-NZ 2.91Å
422	S	80.3	Confident	85	Confident	81 Å²	81	70.9 Å²	70.9	57%	0.566	37%	0.369	S	S	*	.	H	α-helix	trans	-65.3	-13.5	174.9	-52.8	0	0	0	0	114.6	C420	C420-S422 PolarHBondContact O-N 3.2Å; C420-S422 VanDerWaalsContact O-N 3.16Å
423	M	82.5	Confident	85.3	Confident	1 Å²	1	77 Å²	77	1%	0.005	39%	0.39	C	S	.	.	H	α-helix	trans	-108.5	-6.9	174	-72.1	-170.9	75.9	0	0	113.7	M408 Q409 L412 C413 L419 C420 D421 A425 L426	M408-M423 HydrophobicContact CB-CE 4.41Å; M408-M423 HydrophobicContact CG-CE 4.22Å; Q409-M423 WeakPolarHBondContact CA-SD 3.09Å; Q409-M423 HydrophobicContact CB-CE 4.13Å; Q409-M423 HydrophobicContact CB-SD 3.67Å; Q409-M423 HydrophobicContact CG-SD 3.96Å; L412-M423 HydrophobicContact CB-CG 4.44Å; L412-M423 HydrophobicContact CD1-CG 4.07Å; C413-M423 VanDerWaalsContact SG-SD 3.63Å; L419-M423 HydrophobicContact CD2-CB 3.94Å; L419-M423 HydrophobicContact CD2-CE 4.07Å; L419-M423 HydrophobicContact CD2-SD 4.04Å; C420-M423 PolarHBondContact O-N 3.34Å; D421-M423 PolarHBondContact O-N 2.63Å; D421-M423 VanDerWaalsContact O-N 3.16Å; M423-A425 VanDerWaalsContact C-N 3.3Å; M423-A425 PolarHBondContact O-N 2.93Å; M423-L426 HydrophobicContact CE-CD2 4.32Å
424	K	74.1	Confident	85.6	Confident	151 Å²	151	79.5 Å²	79.5	66%	0.657	40%	0.403	S	S	*	.	H	α-helix	trans	-67.9	-31.6	175.8	-72.2	-178.1	179.8	165.2	0	112.3	C420 D421	C420-K424 PolarHBondContact O-N 2.97Å; D421-K424 PolarHBondContact O-N 3.27Å; D421-K424 VanDerWaalsContact O-N 3.14Å; D421-K424 WeakPolarHBondContact OD1-CD 3.42Å; D421-K424 VanDerWaalsContact OD1-CE 3.24Å; D421-K424 WeakPolarHBondContact OD1-CE 3.45Å; D421-K424 IonicContact OD1-NZ 3.39Å; D421-K424 PolarHBondContact OD1-NZ 2.91Å
425	A	75.4	Confident	86.2	Confident	69 Å²	69	74.1 Å²	74.1	57%	0.57	37%	0.373	S	S	*	.	S	Bend	trans	-111	92.4	169	0	0	0	0	0	108.8	M423 D427	M423-A425 VanDerWaalsContact C-N 3.3Å; M423-A425 PolarHBondContact O-N 2.93Å; A425-D427 PolarHBondContact O-N 2.85Å
426	L	81.1	Confident	86.9	Confident	50 Å²	50	65.6 Å²	65.6	26%	0.262	33%	0.328	S	S	.	.			trans	-66.4	121.6	-177.5	-75.7	166.2	0	0	0	111.5	L35 A139 L405 M408 M423 G428	L35-L426 HydrophobicContact CD2-CD1 4.1Å; A139-L426 HydrophobicContact CB-CD1 3.27Å; L405-L426 HydrophobicContact CD2-CD2 4.36Å; M408-L426 HydrophobicContact CE-CD2 3.99Å; M408-L426 HydrophobicContact SD-CD2 4.11Å; M423-L426 HydrophobicContact CE-CD2 4.32Å; L426-G428 PolarHBondContact O-N 3.19Å
427	D	86.1	Confident	87.6	Confident	73 Å²	73	64.7 Å²	64.7	39%	0.39	32%	0.321	S	S	.	.			trans	-78.9	94.5	165	-179.4	-13.2	0	0	0	108.6	A425 R429 R430 L431	A425-D427 PolarHBondContact O-N 2.85Å; D427-R429 PolarHBondContact O-N 3.27Å; D427-R429 WeakPolarHBondContact OD1-CB 3.12Å; D427-R429 PolarHBondContact OD1-N 2.91Å; D427-R429 VanDerWaalsContact OD1-N 3.08Å; D427-R430 HydrophobicContact CB-CB 4Å; D427-R430 PolarHBondContact O-N 3.19Å; D427-R430 PolarHBondContact OD1-N 2.8Å; D427-L431 PolarHBondContact O-N 3.38Å
428	G	88.7	Confident	88.2	Confident	6 Å²	6	66.8 Å²	66.8	6%	0.062	33%	0.329	C	S	.	.	H	α-helix	trans	-67.1	-22.5	-176.9	0	0	0	0	0	113.9	Q161 L426 Y432	Q161-G428 CarbonylContact O-C 3.26Å; Q161-G428 WeakPolarHBondContact O-CA 3.07Å; L426-G428 PolarHBondContact O-N 3.19Å; G428-Y432 WeakPolarHBondContact O-CB 3.37Å; G428-Y432 PolarHBondContact O-N 3.28Å
429	R	91.8	Very high	88.7	Confident	138 Å²	138	60.1 Å²	60.1	52%	0.521	30%	0.301	S	S	.	.	H	α-helix	trans	-66.7	-46.5	171.1	177.5	-170.5	-62.3	-167.1	4.4	111.2	Y182 D427 Y432 R433	Y182-R429 HydrophobicContact CE1-CB 3.76Å; Y182-R429 HydrophobicContact CE1-CG 3.98Å; Y182-R429 PolarHBondContact OH-NE 2.89Å; D427-R429 PolarHBondContact O-N 3.27Å; D427-R429 WeakPolarHBondContact OD1-CB 3.12Å; D427-R429 PolarHBondContact OD1-N 2.91Å; D427-R429 VanDerWaalsContact OD1-N 3.08Å; R429-Y432 PolarHBondContact O-N 3.23Å; R429-R433 WeakPolarHBondContact O-CB 3.35Å; R429-R433 PolarHBondContact O-N 3.37Å
430	R	93.1	Very high	89.2	Confident	96 Å²	96	62.4 Å²	62.4	36%	0.362	32%	0.32	S	S	.	.	H	α-helix	trans	-66.2	-43.2	176.6	-164.9	179.9	-179.9	179.6	-5.3	111.3	D427 Y432 D434 Y435	D427-R430 HydrophobicContact CB-CB 4Å; D427-R430 PolarHBondContact O-N 3.19Å; D427-R430 PolarHBondContact OD1-N 2.8Å; R430-Y432 VanDerWaalsContact C-N 3.32Å; R430-Y432 PolarHBondContact O-N 2.98Å; R430-D434 HydrophobicContact CG-CB 4.41Å; R430-D434 WeakPolarHBondContact CG-OD2 3.42Å; R430-D434 IonicContact NE-OD2 3.71Å; R430-D434 WeakPolarHBondContact O-CB 3.41Å; R430-D434 PolarHBondContact O-N 2.99Å; R430-Y435 HydrophobicContact CG-CE2 4.13Å; R430-Y435 WeakPolarHBondContact O-CD2 3.5Å
431	L	95	Very high	89.6	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.315	C	S	.	.	I	π-helix	trans	-53.9	-48.9	175.2	178.6	55.5	0	0	0	111	P163 M401 A404 L405 M408 D427 Y435 I436	P163-L431 HydrophobicContact CG-CD2 3.81Å; P163-L431 HydrophobicContact CG-CG 4.18Å; M401-L431 HydrophobicContact SD-CD2 4.4Å; A404-L431 HydrophobicContact CB-CD1 4.15Å; L405-L431 HydrophobicContact CD2-CD1 3.94Å; L405-L431 HydrophobicContact CD2-CD2 3.95Å; L405-L431 HydrophobicContact CG-CD1 4.47Å; M408-L431 HydrophobicContact SD-CB 4.1Å; M408-L431 HydrophobicContact SD-CD1 3.87Å; M408-L431 HydrophobicContact SD-CG 4.48Å; D427-L431 PolarHBondContact O-N 3.38Å; L431-Y435 WeakPolarHBondContact O-CB 3.32Å; L431-Y435 PolarHBondContact O-N 3.3Å; L431-I436 HydrophobicContact CD1-CG1 4.37Å; L431-I436 HydrophobicContact CG-CD1 4.09Å; L431-I436 HydrophobicContact CG-CG1 4.32Å; L431-I436 PolarHBondContact O-N 3.42Å
432	Y	95.7	Very high	90.1	Very high	10 Å²	10	60 Å²	60	4%	0.039	31%	0.307	C	S	.	.	I	π-helix	trans	-65.7	-58	179.8	-177.5	-96.6	0	0	0	113	P163 K177 D181 Y182 F183 A184 G428 R429 R430 I436 L437	P163-Y432 HydrophobicContact CB-CD2 4.13Å; K177-Y432 WeakPolarHBondContact CE-OH 3.28Å; K177-Y432 PolarHBondContact NZ-OH 3.28Å; D181-Y432 VanDerWaalsContact O-CD1 3.27Å; D181-Y432 WeakPolarHBondContact O-CD1 3.42Å; D181-Y432 WeakPolarHBondContact O-CE1 3.5Å; Y182-Y432 HydrophobicContact CD1-CD1 4.24Å; Y182-Y432 HydrophobicContact CD1-CG 4.08Å; F183-Y432 PolarHBondContact O-OH 3.26Å; A184-Y432 HydrophobicContact CB-CE2 3.97Å; G428-Y432 WeakPolarHBondContact O-CB 3.37Å; G428-Y432 PolarHBondContact O-N 3.28Å; R429-Y432 PolarHBondContact O-N 3.23Å; R430-Y432 VanDerWaalsContact C-N 3.32Å; R430-Y432 PolarHBondContact O-N 2.98Å; Y432-I436 HydrophobicContact CD2-CD1 4.41Å; Y432-I436 HydrophobicContact CD2-CG2 4.44Å; Y432-I436 PolarHBondContact O-N 3.38Å; Y432-L437 HydrophobicContact CD1-CD1 4.31Å; Y432-L437 HydrophobicContact CD1-CG 4.44Å; Y432-L437 HydrophobicContact CE1-CD1 3.74Å; Y432-L437 HydrophobicContact CE1-CD2 4.27Å; Y432-L437 HydrophobicContact CE1-CG 3.98Å; Y432-L437 HydrophobicContact CE2-CD2 4.47Å; Y432-L437 PolarHBondContact O-N 2.89Å; Y432-L437 VanDerWaalsContact O-N 3.09Å
433	R	94.3	Very high	90.5	Very high	169 Å²	169	56.3 Å²	56.3	64%	0.638	28%	0.282	S	S	*	.	I	π-helix	trans	-72.1	-42.5	-167.7	-161.4	-170.6	87.6	138.6	4.4	113	R429	R429-R433 WeakPolarHBondContact O-CB 3.35Å; R429-R433 PolarHBondContact O-N 3.37Å
434	D	94.7	Very high	90.6	Very high	58 Å²	58	57.4 Å²	57.4	31%	0.31	29%	0.289	S	S	.	.	I	π-helix	trans	-94.3	-25.5	-170.1	-60.6	-15	0	0	0	111.8	R430 N438	R430-D434 HydrophobicContact CG-CB 4.41Å; R430-D434 WeakPolarHBondContact CG-OD2 3.42Å; R430-D434 IonicContact NE-OD2 3.71Å; R430-D434 WeakPolarHBondContact O-CB 3.41Å; R430-D434 PolarHBondContact O-N 2.99Å; D434-N438 PolarHBondContact O-ND2 3.28Å
435	Y	95.9	Very high	91.2	Very high	22 Å²	22	53.2 Å²	53.2	9%	0.086	27%	0.271	C	S	.	.	I	π-helix	trans	-116.5	-53.2	-175	-55.3	-78.3	0	0	0	114	N407 M408 S411 R430 L431 N438 V439	N407-Y435 HydrophobicContact CB-CD1 3.86Å; N407-Y435 HydrophobicContact CB-CE1 4.47Å; M408-Y435 VanDerWaalsContact CA-CE1 3.49Å; M408-Y435 HydrophobicContact CB-CD1 4.08Å; M408-Y435 HydrophobicContact CB-CD2 3.84Å; M408-Y435 HydrophobicContact CB-CE1 4.09Å; M408-Y435 HydrophobicContact CB-CE2 3.82Å; M408-Y435 HydrophobicContact CB-CG 3.95Å; M408-Y435 HydrophobicContact CG-CD2 4Å; M408-Y435 HydrophobicContact CG-CE2 3.64Å; M408-Y435 HydrophobicContact SD-CD2 4.2Å; M408-Y435 HydrophobicContact SD-CE2 4.2Å; S411-Y435 WeakPolarHBondContact CB-OH 3.47Å; S411-Y435 PolarHBondContact OG-OH 2.61Å; R430-Y435 HydrophobicContact CG-CE2 4.13Å; R430-Y435 WeakPolarHBondContact O-CD2 3.5Å; L431-Y435 WeakPolarHBondContact O-CB 3.32Å; L431-Y435 PolarHBondContact O-N 3.3Å; Y435-N438 CarbonylContact O-C 3.59Å; Y435-N438 PolarHBondContact O-N 3.35Å; Y435-V439 WeakPolarHBondContact O-CG1 3.43Å; Y435-V439 PolarHBondContact O-N 3.27Å
436	I	96.6	Very high	91.4	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.254	C	S	.	.	I	π-helix	trans	-62	-51.6	-178.3	-67.7	175.3	0	0	0	110.9	P163 I165 A184 M401 A404 L431 Y432 N438 V439 F456	P163-I436 HydrophobicContact CB-CD1 3.54Å; P163-I436 HydrophobicContact CG-CD1 3.83Å; I165-I436 HydrophobicContact CD1-CD1 4.37Å; I165-I436 HydrophobicContact CD1-CG2 3.97Å; I165-I436 HydrophobicContact CG1-CG2 4.4Å; A184-I436 HydrophobicContact CB-CG2 4.18Å; M401-I436 HydrophobicContact CE-CD1 3.87Å; M401-I436 HydrophobicContact SD-CD1 3.92Å; M401-I436 HydrophobicContact SD-CG1 4.49Å; A404-I436 HydrophobicContact CB-CB 4.42Å; A404-I436 HydrophobicContact CB-CG1 3.64Å; L431-I436 HydrophobicContact CD1-CG1 4.37Å; L431-I436 HydrophobicContact CG-CD1 4.09Å; L431-I436 HydrophobicContact CG-CG1 4.32Å; L431-I436 PolarHBondContact O-N 3.42Å; Y432-I436 HydrophobicContact CD2-CD1 4.41Å; Y432-I436 HydrophobicContact CD2-CG2 4.44Å; Y432-I436 PolarHBondContact O-N 3.38Å; I436-N438 PolarHBondContact O-N 3.22Å; I436-N438 VanDerWaalsContact O-N 3.15Å; I436-V439 VanDerWaalsContact O-CG2 3.32Å; I436-V439 WeakPolarHBondContact O-CG2 3.26Å; I436-V439 PolarHBondContact O-N 3.46Å; I436-F456 HydrophobicContact CG2-CD2 4.34Å; I436-F456 HydrophobicContact CG2-CE2 3.99Å; I436-F456 VanDerWaalsContact O-CD2 3.24Å; I436-F456 WeakPolarHBondContact O-CD2 3.4Å
437	L	95.8	Very high	91.4	Very high	33 Å²	33	51.2 Å²	51.2	17%	0.173	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-20.9	-179.2	-69.8	-178.7	0	0	0	113.8	Y432 F456 G460	Y432-L437 HydrophobicContact CD1-CD1 4.31Å; Y432-L437 HydrophobicContact CD1-CG 4.44Å; Y432-L437 HydrophobicContact CE1-CD1 3.74Å; Y432-L437 HydrophobicContact CE1-CD2 4.27Å; Y432-L437 HydrophobicContact CE1-CG 3.98Å; Y432-L437 HydrophobicContact CE2-CD2 4.47Å; Y432-L437 PolarHBondContact O-N 2.89Å; Y432-L437 VanDerWaalsContact O-N 3.09Å; L437-F456 HydrophobicContact CD2-CB 4.47Å; L437-G460 VanDerWaalsContact CD2-CA 3.44Å
438	N	95.5	Very high	90.8	Very high	117 Å²	117	54.4 Å²	54.4	63%	0.626	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	11.9	-176.5	-63.8	-34.7	0	0	0	113.3	D434 Y435 I436	D434-N438 PolarHBondContact O-ND2 3.28Å; Y435-N438 CarbonylContact O-C 3.59Å; Y435-N438 PolarHBondContact O-N 3.35Å; I436-N438 PolarHBondContact O-N 3.22Å; I436-N438 VanDerWaalsContact O-N 3.15Å
439	V	95.1	Very high	89.9	Confident	4 Å²	4	58 Å²	58	2%	0.024	32%	0.318	C	S	.	.			trans	-70	138.9	173.8	-59	0	0	0	0	110.9	A400 H403 A404 Y435 I436 F441 F456	A400-V439 HydrophobicContact CB-CG2 4.26Å; H403-V439 HydrophobicContact CB-CG1 4.42Å; A404-V439 HydrophobicContact CB-CG1 3.81Å; Y435-V439 WeakPolarHBondContact O-CG1 3.43Å; Y435-V439 PolarHBondContact O-N 3.27Å; I436-V439 VanDerWaalsContact O-CG2 3.32Å; I436-V439 WeakPolarHBondContact O-CG2 3.26Å; I436-V439 PolarHBondContact O-N 3.46Å; V439-F441 HydrophobicContact CB-CD1 4.47Å; V439-F441 HydrophobicContact CG2-CE1 4.31Å; V439-F456 HydrophobicContact CG2-CD2 3.79Å; V439-F456 HydrophobicContact CG2-CE2 3.51Å
440	S	95	Very high	89	Confident	87 Å²	87	53.3 Å²	53.3	61%	0.608	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.3	118.1	168.9	-172.8	0	0	0	0	108.7	V454	S440-V454 WeakPolarHBondContact CA-O 3.39Å
441	F	93.4	Very high	88.2	Confident	18 Å²	18	56 Å²	56	8%	0.079	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	156.2	179.1	63.6	-81.5	0	0	0	110.4	A400 H403 V439 V454	A400-F441 HydrophobicContact CB-CE1 3.87Å; A400-F441 HydrophobicContact CB-CZ 4.09Å; H403-F441 HydrophobicContact CB-CD1 4.42Å; H403-F441 AromaticContact CD2-CD1 3.69Å; H403-F441 AromaticContact CD2-CD2 3.77Å; H403-F441 AromaticContact CD2-CG 3.53Å; H403-F441 AromaticContact NE2-CD2 3.81Å; H403-F441 AromaticContact NE2-CG 3.76Å; V439-F441 HydrophobicContact CB-CD1 4.47Å; V439-F441 HydrophobicContact CG2-CE1 4.31Å; F441-V454 HydrophobicContact CD1-CB 4.24Å; F441-V454 HydrophobicContact CD2-CB 4.44Å; F441-V454 HydrophobicContact CE1-CB 3.74Å; F441-V454 HydrophobicContact CE1-CG1 3.79Å; F441-V454 HydrophobicContact CE2-CB 3.97Å; F441-V454 HydrophobicContact CE2-CG1 4.5Å; F441-V454 HydrophobicContact CE2-CG2 3.9Å; F441-V454 HydrophobicContact CZ-CB 3.6Å; F441-V454 HydrophobicContact CZ-CG1 3.69Å; F441-V454 HydrophobicContact CZ-CG2 3.91Å; F441-V454 PolarHBondContact N-O 2.94Å; F441-V454 PolarHBondContact O-N 3.46Å
442	T	91.8	Very high	87.6	Confident	77 Å²	77	57.6 Å²	57.6	47%	0.472	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	127.9	172.8	-53.3	0	0	0	0	108.9	E451	T442-E451 HydrophobicContact CG2-CB 4.17Å; T442-E451 HydrophobicContact CG2-CG 4.34Å
443	A	88.9	Confident	87.4	Confident	4 Å²	4	60.3 Å²	60.3	3%	0.033	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-55.5	125.4	-178.7	0	0	0	0	0	110	S446 T452 V454	A443-S446 PolarHBondContact O-N 2.88Å; A443-S446 PolarHBondContact O-OG 3.43Å; A443-T452 WeakPolarHBondContact CB-O 3.5Å; A443-T452 WeakPolarHBondContact CB-OG1 3.48Å; A443-T452 PolarHBondContact N-O 3.5Å; A443-V454 HydrophobicContact CB-CG2 3.76Å
444	P	83.8	Confident	87.3	Confident	24 Å²	24	52.9 Å²	52.9	16%	0.156	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	149.5	-178.1	30.9	-38	0	0	0	109.7	V395 Y399 S446	V395-P444 HydrophobicContact CG1-CG 3.98Å; Y399-P444 HydrophobicContact CD1-CB 4.34Å; Y399-P444 HydrophobicContact CD1-CG 3.93Å; Y399-P444 HydrophobicContact CD2-CG 3.75Å; Y399-P444 HydrophobicContact CE1-CB 4.02Å; Y399-P444 HydrophobicContact CE1-CG 4.02Å; Y399-P444 HydrophobicContact CE2-CB 4.37Å; Y399-P444 HydrophobicContact CE2-CG 3.85Å; Y399-P444 HydrophobicContact CG-CG 3.79Å; P444-S446 PolarHBondContact O-N 3.25Å
445	F	87.1	Confident	87.3	Confident	62 Å²	62	55.1 Å²	55.1	27%	0.272	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	63	19.2	179.4	-40.7	-76.3	0	0	0	115.2	F70 R74 I326 D328 V395 Y399	F70-F445 HydrophobicContact CE1-CE2 4Å; F70-F445 HydrophobicContact CE1-CZ 4.16Å; F70-F445 HydrophobicContact CZ-CE1 4.48Å; F70-F445 HydrophobicContact CZ-CE2 4.45Å; F70-F445 HydrophobicContact CZ-CZ 4.19Å; R74-F445 HydrophobicContact CB-CZ 4.41Å; R74-F445 HydrophobicContact CG-CZ 4.08Å; I326-F445 HydrophobicContact CG2-CB 3.82Å; I326-F445 HydrophobicContact CG2-CD2 4.3Å; I326-F445 HydrophobicContact CG2-CG 4.07Å; D328-F445 HydrophobicContact CB-CD1 4.25Å; V395-F445 HydrophobicContact CG1-CD2 4.39Å; V395-F445 HydrophobicContact CG1-CE2 4.33Å; Y399-F445 HydrophobicContact CE2-CE2 4.34Å
446	S	80.8	Confident	87.3	Confident	32 Å²	32	54.9 Å²	54.9	22%	0.224	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-62.1	139.4	171.9	-66.8	0	0	0	0	111.4	A443 P444 T452	A443-S446 PolarHBondContact O-N 2.88Å; A443-S446 PolarHBondContact O-OG 3.43Å; P444-S446 PolarHBondContact O-N 3.25Å; S446-T452 PolarHBondContact OG-OG1 3.08Å
447	P	79.8	Confident	87.1	Confident	46 Å²	46	58 Å²	58	30%	0.299	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-56.3	148.9	172	-20.8	26.9	0	0	0	112.7	N324 G449 S450	N324-P447 HydrophobicContact CB-CG 4.13Å; P447-G449 PolarHBondContact O-N 3.49Å; P447-S450 VanDerWaalsContact CD-OG 3.27Å; P447-S450 WeakPolarHBondContact CD-OG 3.48Å; P447-S450 WeakPolarHBondContact CG-OG 3.41Å; P447-S450 PolarHBondContact O-N 3.2Å; P447-S450 VanDerWaalsContact O-N 3.09Å; P447-S450 PolarHBondContact O-OG 3.3Å
448	P	73.9	Confident	86.9	Confident	139 Å²	139	61 Å²	61	90%	0.903	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	124.2	173.5	-20	30.7	0	0	0	110.8
449	G	69.6	Low	86.8	Confident	83 Å²	83	58.9 Å²	58.9	86%	0.856	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.9	-3.1	-179.4	0	0	0	0	0	115.7	P447	P447-G449 PolarHBondContact O-N 3.49Å
450	S	72.9	Confident	86.8	Confident	38 Å²	38	58.7 Å²	58.7	27%	0.266	36%	0.356	S	S	.	.			trans	-121.2	52.1	173.3	78.7	0	0	0	0	111.5	N324 P447 T452	N324-S450 PolarHBondContact ND2-OG 3Å; P447-S450 VanDerWaalsContact CD-OG 3.27Å; P447-S450 WeakPolarHBondContact CD-OG 3.48Å; P447-S450 WeakPolarHBondContact CG-OG 3.41Å; P447-S450 PolarHBondContact O-N 3.2Å; P447-S450 VanDerWaalsContact O-N 3.09Å; P447-S450 PolarHBondContact O-OG 3.3Å; S450-T452 PolarHBondContact O-N 3.4Å
451	E	76.3	Confident	86.9	Confident	152 Å²	152	54.9 Å²	54.9	71%	0.71	33%	0.328	S	S	*	.			trans	-63.9	107.6	178.1	-68	-176.7	-171.9	0	0	110	T442	T442-E451 HydrophobicContact CG2-CB 4.17Å; T442-E451 HydrophobicContact CG2-CG 4.34Å
452	T	83.6	Confident	86.8	Confident	35 Å²	35	54.3 Å²	54.3	22%	0.215	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-97.5	129	176.1	56	0	0	0	0	109.1	A443 S446 S450	A443-T452 WeakPolarHBondContact CB-O 3.5Å; A443-T452 WeakPolarHBondContact CB-OG1 3.48Å; A443-T452 PolarHBondContact N-O 3.5Å; S446-T452 PolarHBondContact OG-OG1 3.08Å; S450-T452 PolarHBondContact O-N 3.4Å
453	V	90.3	Very high	86.7	Confident	66 Å²	66	54.4 Å²	54.4	40%	0.4	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	125.2	176.7	178.6	0	0	0	0	108.8	M463	V453-M463 WeakPolarHBondContact O-CE 3.47Å
454	V	92.9	Very high	86.7	Confident	14 Å²	14	55 Å²	55	9%	0.085	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	122.2	172.2	-174.2	0	0	0	0	108.3	N396 S440 F441 A443	N396-V454 HydrophobicContact CB-CG1 4.43Å; N396-V454 HydrophobicContact CB-CG2 4.11Å; S440-V454 WeakPolarHBondContact CA-O 3.39Å; F441-V454 HydrophobicContact CD1-CB 4.24Å; F441-V454 HydrophobicContact CD2-CB 4.44Å; F441-V454 HydrophobicContact CE1-CB 3.74Å; F441-V454 HydrophobicContact CE1-CG1 3.79Å; F441-V454 HydrophobicContact CE2-CB 3.97Å; F441-V454 HydrophobicContact CE2-CG1 4.5Å; F441-V454 HydrophobicContact CE2-CG2 3.9Å; F441-V454 HydrophobicContact CZ-CB 3.6Å; F441-V454 HydrophobicContact CZ-CG1 3.69Å; F441-V454 HydrophobicContact CZ-CG2 3.91Å; F441-V454 PolarHBondContact N-O 2.94Å; F441-V454 PolarHBondContact O-N 3.46Å; A443-V454 HydrophobicContact CB-CG2 3.76Å
455	K	94.4	Very high	87.1	Confident	105 Å²	105	60 Å²	60	46%	0.457	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	159.4	174.8	62.8	176.9	-178.5	176.5	0	109.4	M463	K455-M463 HydrophobicContact CD-SD 4.47Å; K455-M463 WeakPolarHBondContact CE-SD 3.34Å; K455-M463 HydrophobicContact CG-CE 4.29Å; K455-M463 HydrophobicContact CG-SD 4.35Å
456	F	95.4	Very high	87.5	Confident	17 Å²	17	57 Å²	57	8%	0.075	33%	0.333	C	S	.	.			trans	-107.5	153.5	172.8	-54.5	-67.5	0	0	0	111	I165 A184 R185 T186 A400 I436 L437 V439 D461	I165-F456 HydrophobicContact CG2-CZ 4.3Å; A184-F456 HydrophobicContact CB-CE1 4.48Å; R185-F456 WeakPolarHBondContact O-CD1 3.34Å; R185-F456 WeakPolarHBondContact O-CE1 3.38Å; T186-F456 HydrophobicContact CG2-CE1 4.12Å; T186-F456 HydrophobicContact CG2-CZ 4.26Å; A400-F456 HydrophobicContact CB-CE2 4.13Å; A400-F456 HydrophobicContact CB-CZ 3.97Å; I436-F456 HydrophobicContact CG2-CD2 4.34Å; I436-F456 HydrophobicContact CG2-CE2 3.99Å; I436-F456 VanDerWaalsContact O-CD2 3.24Å; I436-F456 WeakPolarHBondContact O-CD2 3.4Å; L437-F456 HydrophobicContact CD2-CB 4.47Å; V439-F456 HydrophobicContact CG2-CD2 3.79Å; V439-F456 HydrophobicContact CG2-CE2 3.51Å; F456-D461 WeakPolarHBondContact CA-O 3.34Å
457	D	93.1	Very high	88.1	Confident	64 Å²	64	57.8 Å²	57.8	34%	0.342	33%	0.334	S	S	.	.			trans	-81.2	-176.6	168	75.7	2.7	0	0	0	111.8	Q459 G460 D461	D457-Q459 PolarHBondContact O-N 3.06Å; D457-Q459 VanDerWaalsContact O-N 3.11Å; D457-Q459 VanDerWaalsContact OD1-CA 3.24Å; D457-Q459 WeakPolarHBondContact OD1-CA 3.19Å; D457-Q459 WeakPolarHBondContact OD1-CB 3.42Å; D457-Q459 PolarHBondContact OD1-N 2.92Å; D457-G460 PolarHBondContact O-N 2.98Å; D457-G460 PolarHBondContact OD1-N 3.02Å; D457-D461 PolarHBondContact N-O 3.42Å; D457-D461 WeakPolarHBondContact OD1-CB 3.24Å; D457-D461 PolarHBondContact OD1-N 2.76Å
458	S	91.7	Very high	88.9	Confident	96 Å²	96	55.6 Å²	55.6	67%	0.671	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-20.7	177.2	64.3	0	0	0	0	114.5
459	Q	94.1	Very high	89.9	Confident	74 Å²	74	50.4 Å²	50.4	35%	0.346	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	15.3	177.8	-52.1	-55.5	-44.6	0	0	111.4	S175 K177 D457 D461	S175-Q459 PolarHBondContact O-OE1 2.81Å; K177-Q459 WeakPolarHBondContact CE-O 3.39Å; K177-Q459 PolarHBondContact NZ-O 3.48Å; D457-Q459 PolarHBondContact O-N 3.06Å; D457-Q459 VanDerWaalsContact O-N 3.11Å; D457-Q459 VanDerWaalsContact OD1-CA 3.24Å; D457-Q459 WeakPolarHBondContact OD1-CA 3.19Å; D457-Q459 WeakPolarHBondContact OD1-CB 3.42Å; D457-Q459 PolarHBondContact OD1-N 2.92Å; Q459-D461 PolarHBondContact O-N 2.89Å
460	G	94.3	Very high	91.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.242	C	C	.	.	S	Bend	trans	67.7	19.1	178.1	0	0	0	0	0	114.1	A184 R185 L437 D457	A184-G460 CarbonylContact C-O 3.59Å; A184-G460 VanDerWaalsContact CA-O 3.26Å; A184-G460 WeakPolarHBondContact CA-O 3.49Å; A184-G460 WeakPolarHBondContact CB-O 3.26Å; R185-G460 PolarHBondContact N-O 3.44Å; L437-G460 VanDerWaalsContact CD2-CA 3.44Å; D457-G460 PolarHBondContact O-N 2.98Å; D457-G460 PolarHBondContact OD1-N 3.02Å
461	D	96.1	Very high	92.2	Very high	6 Å²	6	44.7 Å²	44.7	3%	0.032	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-96.7	147	-177.9	-69.5	-35.5	0	0	0	112.2	S175 R185 F456 D457 Q459	S175-D461 WeakPolarHBondContact CB-OD2 3.29Å; S175-D461 PolarHBondContact OG-OD1 3.35Å; S175-D461 PolarHBondContact OG-OD2 3.48Å; R185-D461 IonicContact CZ-OD1 3.75Å; R185-D461 IonicContact NE-OD1 3.81Å; R185-D461 PolarHBondContact NE-OD1 3.27Å; R185-D461 VanDerWaalsContact NH2-CG 3.3Å; R185-D461 IonicContact NH2-OD1 2.92Å; R185-D461 PolarHBondContact NH2-OD1 3.04Å; R185-D461 IonicContact NH2-OD2 3.59Å; R185-D461 PolarHBondContact NH2-OD2 3.38Å; F456-D461 WeakPolarHBondContact CA-O 3.34Å; D457-D461 PolarHBondContact N-O 3.42Å; D457-D461 WeakPolarHBondContact OD1-CB 3.24Å; D457-D461 PolarHBondContact OD1-N 2.76Å; Q459-D461 PolarHBondContact O-N 2.89Å
462	G	92.7	Very high	92.9	Very high	7 Å²	7	38.1 Å²	38.1	7%	0.072	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-75.6	162.4	172.8	0	0	0	0	0	112.7	R185 V187 P188	R185-G462 PolarHBondContact O-N 2.92Å; V187-G462 PolarHBondContact O-N 3.32Å; P188-G462 WeakPolarHBondContact CA-O 3.36Å
463	M	90	Very high	93.2	Very high	79 Å²	79	42 Å²	42	39%	0.389	21%	0.21	S	C	.	.	P	Polyproline II helix	trans	-69.3	137.3	179.7	-66.1	-173.2	-72.4	0	0	112.6	V453 K455 R465	V453-M463 WeakPolarHBondContact O-CE 3.47Å; K455-M463 HydrophobicContact CD-SD 4.47Å; K455-M463 WeakPolarHBondContact CE-SD 3.34Å; K455-M463 HydrophobicContact CG-CE 4.29Å; K455-M463 HydrophobicContact CG-SD 4.35Å; M463-R465 PolarHBondContact O-N 2.87Å
464	G	88.3	Confident	92.9	Very high	15 Å²	15	43 Å²	43	16%	0.155	22%	0.22	C	C	.	.			trans	-78.1	99.8	-179.9	0	0	0	0	0	113.5
465	R	91.9	Very high	92.4	Very high	129 Å²	129	45 Å²	45	49%	0.487	24%	0.244	S	C	.	.			trans	-138.3	132.8	172	-63.3	-176	-177.5	-176.3	-1.4	110.5	A322 M463 W486 A487	A322-R465 HydrophobicContact CB-CB 3.69Å; A322-R465 WeakPolarHBondContact CB-O 3.24Å; A322-R465 PolarHBondContact N-O 3.34Å; M463-R465 PolarHBondContact O-N 2.87Å; R465-W486 WeakPolarHBondContact CA-O 3.37Å; R465-A487 HydrophobicContact CG-CB 4.16Å
466	Y	94.6	Very high	91.7	Very high	1 Å²	1	48.5 Å²	48.5	0%	0.004	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	142.3	-179	-59.4	-91.2	0	0	0	111.4	P188 P189 Q193 E320 L321 E485 W486	P188-Y466 HydrophobicContact CG-CE1 4.48Å; P188-Y466 HydrophobicContact CG-CE2 4.36Å; P188-Y466 WeakPolarHBondContact CG-OH 3.48Å; P189-Y466 PolarHBondContact O-OH 3.09Å; Q193-Y466 HydrophobicContact CB-CE1 4.06Å; Q193-Y466 HydrophobicContact CB-CE2 4.42Å; Q193-Y466 HydrophobicContact CG-CE1 4.2Å; E320-Y466 CarbonylContact O-C 3.52Å; E320-Y466 WeakPolarHBondContact O-CA 2.94Å; E320-Y466 WeakPolarHBondContact O-CB 3.48Å; L321-Y466 HydrophobicContact CD2-CD1 3.97Å; L321-Y466 HydrophobicContact CD2-CE1 3.46Å; L321-Y466 VanDerWaalsContact CD2-CE1 3.46Å; L321-Y466 HydrophobicContact CG-CE1 4.4Å; Y466-E485 CarbonylContact O-C 3.51Å; Y466-E485 WeakPolarHBondContact O-CA 3.28Å; Y466-W486 AromaticContact CD2-CE3 3.77Å; Y466-W486 HydrophobicContact CD2-CE3 3.77Å; Y466-W486 HydrophobicContact CD2-CZ3 4.33Å; Y466-W486 HydrophobicContact CE2-CE3 4.24Å; Y466-W486 HydrophobicContact CE2-CZ3 4.36Å; Y466-W486 PolarHBondContact N-O 2.64Å; Y466-W486 PolarHBondContact O-N 3.33Å
467	N	94	Very high	91.3	Very high	47 Å²	47	57.5 Å²	57.5	25%	0.251	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	141.9	165.2	-66.8	-21.9	0	0	0	108.5	E320 F469	E320-N467 PolarHBondContact N-O 2.86Å; E320-N467 PolarHBondContact O-N 3.28Å; N467-F469 HydrophobicContact CB-CD2 4.41Å; N467-F469 HydrophobicContact CB-CE2 3.62Å; N467-F469 HydrophobicContact CB-CZ 4.11Å
468	I	96.1	Very high	91.1	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	128	-178.6	-53.4	170	0	0	0	108.5	I200 I317 V483 G484 W486 L490 L492	I200-I468 HydrophobicContact CD1-CD1 3.97Å; I200-I468 HydrophobicContact CD1-CG1 4.44Å; I200-I468 HydrophobicContact CD1-CG2 4.27Å; I200-I468 HydrophobicContact CG1-CD1 4.29Å; I317-I468 HydrophobicContact CG2-CG2 3.64Å; I468-V483 HydrophobicContact CB-CG2 4.41Å; I468-V483 HydrophobicContact CG2-CG2 3.97Å; I468-V483 WeakPolarHBondContact O-CG2 3.27Å; I468-V483 PolarHBondContact O-N 3.4Å; I468-G484 PolarHBondContact N-O 2.7Å; I468-G484 PolarHBondContact O-N 2.97Å; I468-W486 HydrophobicContact CD1-CB 4.43Å; I468-L490 HydrophobicContact CD1-CD1 3.31Å; I468-L492 HydrophobicContact CB-CD2 4.17Å; I468-L492 HydrophobicContact CD1-CD2 3.65Å; I468-L492 HydrophobicContact CD1-CG 4.34Å; I468-L492 HydrophobicContact CG2-CD2 3.96Å
469	F	95.3	Very high	91.1	Very high	30 Å²	30	53.5 Å²	53.5	13%	0.132	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	147	-178.9	-65.5	-89.2	0	0	0	111.2	A301 I317 T318 E320 N467 Y480 V481 P482	A301-F469 HydrophobicContact CB-CD1 4.41Å; A301-F469 HydrophobicContact CB-CD2 4.09Å; A301-F469 HydrophobicContact CB-CE2 4.26Å; A301-F469 HydrophobicContact CB-CG 4.16Å; I317-F469 CarbonylContact C-O 3.52Å; I317-F469 WeakPolarHBondContact CA-O 3.41Å; T318-F469 PolarHBondContact N-O 3.06Å; T318-F469 PolarHBondContact O-N 3.38Å; E320-F469 HydrophobicContact CB-CD2 4.22Å; E320-F469 HydrophobicContact CB-CE2 3.96Å; N467-F469 HydrophobicContact CB-CD2 4.41Å; N467-F469 HydrophobicContact CB-CE2 3.62Å; N467-F469 HydrophobicContact CB-CZ 4.11Å; F469-Y480 HydrophobicContact CB-CD1 4.21Å; F469-V481 CarbonylContact C-O 3.24Å; F469-V481 VanDerWaalsContact CA-O 3.31Å; F469-V481 WeakPolarHBondContact CA-O 3.37Å; F469-P482 HydrophobicContact CD1-CB 4.11Å; F469-P482 HydrophobicContact CE1-CB 3.82Å; F469-P482 HydrophobicContact CE1-CG 4.47Å
470	S	95.6	Very high	91	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	127	168.2	176	0	0	0	0	108.7	A316 Q472 V481	A316-S470 CarbonylContact O-C 3.48Å; A316-S470 WeakPolarHBondContact O-CA 2.94Å; S470-Q472 PolarHBondContact OG-OE1 3.14Å; S470-V481 PolarHBondContact N-O 3.03Å; S470-V481 PolarHBondContact O-N 2.89Å
471	Y	94.6	Very high	91	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.008	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	108.5	173.1	-170.5	-102	0	0	0	109.5	V306 E310 A313 G315 A316 Y478 Y480	V306-Y471 HydrophobicContact CG2-CE2 3.79Å; E310-Y471 HydrophobicContact CB-CE1 4.31Å; E310-Y471 WeakPolarHBondContact CB-OH 3.37Å; E310-Y471 VanDerWaalsContact CG-OH 3.23Å; E310-Y471 WeakPolarHBondContact CG-OH 3.38Å; E310-Y471 WeakPolarHBondContact O-CE1 2.74Å; A313-Y471 HydrophobicContact CB-CD1 3.76Å; A313-Y471 HydrophobicContact CB-CE1 3.84Å; A313-Y471 WeakPolarHBondContact O-CD1 3.12Å; G315-Y471 PolarHBondContact N-O 3.08Å; A316-Y471 PolarHBondContact O-N 3.05Å; Y471-Y478 HydrophobicContact CE1-CD1 4.08Å; Y471-Y478 HydrophobicContact CE1-CG 4.31Å; Y471-Y478 WeakPolarHBondContact OH-CB 3.43Å; Y471-Y480 AromaticContact CD2-CD1 3.79Å; Y471-Y480 HydrophobicContact CD2-CD1 3.79Å; Y471-Y480 AromaticContact CD2-CD2 3.95Å; Y471-Y480 HydrophobicContact CD2-CD2 3.95Å; Y471-Y480 AromaticContact CD2-CE1 3.61Å; Y471-Y480 HydrophobicContact CD2-CE1 3.61Å; Y471-Y480 AromaticContact CD2-CE2 3.77Å; Y471-Y480 HydrophobicContact CD2-CE2 3.77Å; Y471-Y480 AromaticContact CD2-CG 3.96Å; Y471-Y480 HydrophobicContact CD2-CG 3.96Å; Y471-Y480 AromaticContact CD2-CZ 3.59Å; Y471-Y480 HydrophobicContact CE2-CD2 4.29Å; Y471-Y480 AromaticContact CE2-CE2 3.96Å; Y471-Y480 HydrophobicContact CE2-CE2 3.96Å; Y471-Y480 HydrophobicContact CG-CD1 4.41Å; Y471-Y480 HydrophobicContact CG-CE1 4.13Å
472	Q	92.9	Very high	90.8	Very high	14 Å²	14	57.4 Å²	57.4	7%	0.065	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	158.9	-169.3	61	-170.3	40.1	0	0	112.7	S470 G479 V481 L496 R498	S470-Q472 PolarHBondContact OG-OE1 3.14Å; Q472-G479 PolarHBondContact N-O 3.32Å; Q472-G479 VanDerWaalsContact N-O 3.13Å; Q472-G479 PolarHBondContact O-N 3.3Å; Q472-V481 HydrophobicContact CG-CB 4.32Å; Q472-V481 HydrophobicContact CG-CG2 3.78Å; Q472-L496 PolarHBondContact NE2-O 3.03Å; Q472-L496 PolarHBondContact OE1-O 3.02Å; Q472-R498 HydrophobicContact CB-CB 4.35Å; Q472-R498 VanDerWaalsContact OE1-N 3.09Å
473	R	89.6	Confident	91	Very high	115 Å²	115	57.2 Å²	57.2	43%	0.434	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	124.5	177.4	-170	175.9	173.2	166.5	-2	111.2	E314 G475 Y478	E314-R473 WeakPolarHBondContact OE1-CB 3.46Å; R473-G475 WeakPolarHBondContact CG-O 3.42Å; R473-G475 PolarHBondContact NE-O 2.84Å; R473-Y478 HydrophobicContact CB-CD1 3.92Å; R473-Y478 HydrophobicContact CB-CE1 3.72Å; R473-Y478 HydrophobicContact CG-CD1 4.32Å; R473-Y478 HydrophobicContact CG-CE1 3.99Å
474	S	83.8	Confident	91.2	Very high	87 Å²	87	54.5 Å²	54.5	61%	0.608	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115	93.1	170.3	-174.2	0	0	0	0	109.6	E476 R477	S474-E476 PolarHBondContact O-N 3.49Å; S474-R477 CarbonylContact C-O 3.49Å; S474-R477 PolarHBondContact N-O 3.04Å; S474-R477 PolarHBondContact O-N 3.2Å
475	G	81.6	Confident	91.5	Very high	57 Å²	57	59.1 Å²	59.1	59%	0.588	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.6	-116.5	-175.1	0	0	0	0	0	111.7	R473	R473-G475 WeakPolarHBondContact CG-O 3.42Å; R473-G475 PolarHBondContact NE-O 2.84Å
476	E	79.8	Confident	91.7	Very high	179 Å²	179	53.1 Å²	53.1	84%	0.836	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-4.5	175.1	-67.9	-169.4	159.7	0	0	113.8	S474	S474-E476 PolarHBondContact O-N 3.49Å
477	R	86.8	Confident	91.5	Very high	206 Å²	206	55.1 Å²	55.1	78%	0.777	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.8	143.8	-177.1	-64.2	-175.7	-177.1	-178.1	0.4	111.2	S474	S474-R477 CarbonylContact C-O 3.49Å; S474-R477 PolarHBondContact N-O 3.04Å; S474-R477 PolarHBondContact O-N 3.2Å
478	Y	90.4	Very high	91.2	Very high	57 Å²	57	60.8 Å²	60.8	22%	0.224	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	155.3	168.3	-62.5	-94.4	0	0	0	109.4	E310 E314 Y471 R473	E310-Y478 HydrophobicContact CB-CD1 4.29Å; E310-Y478 HydrophobicContact CB-CD2 3.71Å; E310-Y478 HydrophobicContact CB-CE2 4.11Å; E310-Y478 HydrophobicContact CB-CG 3.82Å; E310-Y478 HydrophobicContact CG-CD2 4.32Å; E314-Y478 HydrophobicContact CB-CE1 4.34Å; E314-Y478 HydrophobicContact CG-CE1 4.21Å; Y471-Y478 HydrophobicContact CE1-CD1 4.08Å; Y471-Y478 HydrophobicContact CE1-CG 4.31Å; Y471-Y478 WeakPolarHBondContact OH-CB 3.43Å; R473-Y478 HydrophobicContact CB-CD1 3.92Å; R473-Y478 HydrophobicContact CB-CE1 3.72Å; R473-Y478 HydrophobicContact CG-CD1 4.32Å; R473-Y478 HydrophobicContact CG-CE1 3.99Å
479	G	91.3	Very high	91.1	Very high	18 Å²	18	64.8 Å²	64.8	19%	0.186	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.7	167.7	172.3	0	0	0	0	0	112.2	Q472	Q472-G479 PolarHBondContact N-O 3.32Å; Q472-G479 VanDerWaalsContact N-O 3.13Å; Q472-G479 PolarHBondContact O-N 3.3Å
480	Y	92.3	Very high	91.1	Very high	35 Å²	35	65.2 Å²	65.2	14%	0.137	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	130.6	175.7	-61.6	-84	0	0	0	111.4	W299 A301 Q302 E303 V306 T318 F469 Y471	W299-Y480 AromaticContact NE1-CE1 4Å; W299-Y480 AromaticContact NE1-CZ 3.79Å; W299-Y480 PolarHBondContact NE1-OH 3.01Å; A301-Y480 VanDerWaalsContact C-CE2 3.46Å; A301-Y480 HydrophobicContact CB-CD1 4.18Å; A301-Y480 HydrophobicContact CB-CD2 4.12Å; A301-Y480 HydrophobicContact CB-CG 3.86Å; A301-Y480 WeakPolarHBondContact O-CD2 3.29Å; Q302-Y480 PolarHBondContact O-OH 2.86Å; E303-Y480 HydrophobicContact CG-CE2 4.33Å; E303-Y480 VanDerWaalsContact OE1-CD2 3.29Å; E303-Y480 WeakPolarHBondContact OE1-CD2 3.22Å; V306-Y480 WeakPolarHBondContact CG1-OH 3.28Å; T318-Y480 HydrophobicContact CG2-CE1 4.41Å; F469-Y480 HydrophobicContact CB-CD1 4.21Å; Y471-Y480 AromaticContact CD2-CD1 3.79Å; Y471-Y480 HydrophobicContact CD2-CD1 3.79Å; Y471-Y480 AromaticContact CD2-CD2 3.95Å; Y471-Y480 HydrophobicContact CD2-CD2 3.95Å; Y471-Y480 AromaticContact CD2-CE1 3.61Å; Y471-Y480 HydrophobicContact CD2-CE1 3.61Å; Y471-Y480 AromaticContact CD2-CE2 3.77Å; Y471-Y480 HydrophobicContact CD2-CE2 3.77Å; Y471-Y480 AromaticContact CD2-CG 3.96Å; Y471-Y480 HydrophobicContact CD2-CG 3.96Å; Y471-Y480 AromaticContact CD2-CZ 3.59Å; Y471-Y480 HydrophobicContact CE2-CD2 4.29Å; Y471-Y480 AromaticContact CE2-CE2 3.96Å; Y471-Y480 HydrophobicContact CE2-CE2 3.96Å; Y471-Y480 HydrophobicContact CG-CD1 4.41Å; Y471-Y480 HydrophobicContact CG-CE1 4.13Å
481	V	93.2	Very high	91.1	Very high	45 Å²	45	68.4 Å²	68.4	27%	0.273	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128.9	174.8	-179.8	0	0	0	0	108.5	F469 S470 Q472 V483	F469-V481 CarbonylContact C-O 3.24Å; F469-V481 VanDerWaalsContact CA-O 3.31Å; F469-V481 WeakPolarHBondContact CA-O 3.37Å; S470-V481 PolarHBondContact N-O 3.03Å; S470-V481 PolarHBondContact O-N 2.89Å; Q472-V481 HydrophobicContact CG-CB 4.32Å; Q472-V481 HydrophobicContact CG-CG2 3.78Å; V481-V483 HydrophobicContact CG1-CG1 4.47Å; V481-V483 PolarHBondContact O-N 3.48Å
482	P	93.4	Very high	91	Very high	82 Å²	82	69.6 Å²	69.6	53%	0.532	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	124	173.8	28	-32.9	0	0	0	109.4	F469	F469-P482 HydrophobicContact CD1-CB 4.11Å; F469-P482 HydrophobicContact CE1-CB 3.82Å; F469-P482 HydrophobicContact CE1-CG 4.47Å
483	V	95.1	Very high	91	Very high	3 Å²	3	72.4 Å²	72.4	2%	0.018	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	-8.9	-175.4	-64.4	0	0	0	0	113.2	I468 V481 L492 N493 L496 I497	I468-V483 HydrophobicContact CB-CG2 4.41Å; I468-V483 HydrophobicContact CG2-CG2 3.97Å; I468-V483 WeakPolarHBondContact O-CG2 3.27Å; I468-V483 PolarHBondContact O-N 3.4Å; V481-V483 HydrophobicContact CG1-CG1 4.47Å; V481-V483 PolarHBondContact O-N 3.48Å; V483-L492 HydrophobicContact CG2-CD2 4.33Å; V483-N493 PolarHBondContact O-N 3.5Å; V483-L496 HydrophobicContact CG1-CB 3.98Å; V483-I497 HydrophobicContact CB-CD1 4.26Å; V483-I497 HydrophobicContact CB-CG1 3.78Å; V483-I497 HydrophobicContact CG1-CG1 3.72Å; V483-I497 HydrophobicContact CG2-CD1 4.25Å; V483-I497 HydrophobicContact CG2-CG1 4.11Å
484	G	94.7	Very high	90.9	Very high	23 Å²	23	70.6 Å²	70.6	24%	0.237	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.8	-171.3	175.8	0	0	0	0	0	113.7	I468 S491	I468-G484 PolarHBondContact N-O 2.7Å; I468-G484 PolarHBondContact O-N 2.97Å; G484-S491 CarbonylContact C-O 3.55Å; G484-S491 WeakPolarHBondContact CA-O 3.16Å
485	E	94.8	Very high	91.1	Very high	111 Å²	111	73.4 Å²	73.4	52%	0.519	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	157.3	179.7	64.5	179.2	-178	0	0	110.7	Y466 S491	Y466-E485 CarbonylContact O-C 3.51Å; Y466-E485 WeakPolarHBondContact O-CA 3.28Å; E485-S491 PolarHBondContact N-O 2.78Å; E485-S491 PolarHBondContact O-N 2.86Å
486	W	95.4	Very high	91.5	Very high	4 Å²	4	74.4 Å²	74.4	2%	0.015	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	119.2	171.7	-171.4	93.2	0	0	0	109.3	Y192 K195 A196 E199 R465 Y466 I468	Y192-W486 AromaticContact CD1-CH2 3.77Å; Y192-W486 HydrophobicContact CD1-CH2 3.77Å; Y192-W486 HydrophobicContact CD1-CZ3 4.25Å; Y192-W486 HydrophobicContact CG-CH2 4.28Å; Y192-W486 HydrophobicContact CG-CZ3 4.37Å; K195-W486 HydrophobicContact CB-CZ2 4.47Å; K195-W486 HydrophobicContact CD-CZ2 3.94Å; K195-W486 HydrophobicContact CG-CZ2 4.15Å; A196-W486 HydrophobicContact CB-CB 4.11Å; A196-W486 HydrophobicContact CB-CD2 3.7Å; A196-W486 HydrophobicContact CB-CE3 4.41Å; A196-W486 HydrophobicContact CB-CG 3.52Å; E199-W486 PolarHBondContact OE2-NE1 3.44Å; R465-W486 WeakPolarHBondContact CA-O 3.37Å; Y466-W486 AromaticContact CD2-CE3 3.77Å; Y466-W486 HydrophobicContact CD2-CE3 3.77Å; Y466-W486 HydrophobicContact CD2-CZ3 4.33Å; Y466-W486 HydrophobicContact CE2-CE3 4.24Å; Y466-W486 HydrophobicContact CE2-CZ3 4.36Å; Y466-W486 PolarHBondContact N-O 2.64Å; Y466-W486 PolarHBondContact O-N 3.33Å; I468-W486 HydrophobicContact CD1-CB 4.43Å
487	A	91.7	Very high	92.1	Very high	42 Å²	42	66.4 Å²	66.4	35%	0.347	36%	0.357	S	S	.	.	S	Bend	trans	-144.7	91.8	174.9	0	0	0	0	0	107.9	R465 S489	R465-A487 HydrophobicContact CG-CB 4.16Å; A487-S489 PolarHBondContact N-O 2.58Å; A487-S489 PolarHBondContact O-N 3.3Å
488	E	88.1	Confident	92.2	Very high	167 Å²	167	64.1 Å²	64.1	78%	0.78	35%	0.348	S	S	*	.	S	Bend	trans	64.5	-34.5	-169	-56.2	-178.1	-177.6	0	0	115.3
489	S	92.6	Very high	92.1	Very high	83 Å²	83	62.6 Å²	62.6	58%	0.58	34%	0.342	S	S	*	.	S	Bend	trans	-129.3	150.8	173.3	60.4	0	0	0	0	111.6	A487	A487-S489 PolarHBondContact N-O 2.58Å; A487-S489 PolarHBondContact O-N 3.3Å
490	L	95.1	Very high	91.8	Very high	40 Å²	40	64.5 Å²	64.5	21%	0.209	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	128.4	176.3	-176.5	66.8	0	0	0	112.6	E199 I200 F203 I468 L492	E199-L490 HydrophobicContact CB-CB 4.22Å; E199-L490 HydrophobicContact CB-CD2 3.98Å; I200-L490 HydrophobicContact CG1-CD1 3.8Å; I200-L490 HydrophobicContact CG1-CD2 4.08Å; F203-L490 HydrophobicContact CB-CD2 4.07Å; I468-L490 HydrophobicContact CD1-CD1 3.31Å; L490-L492 HydrophobicContact CD1-CD1 4.1Å; L490-L492 HydrophobicContact CD1-CD2 4.35Å; L490-L492 HydrophobicContact CD1-CG 3.8Å; L490-L492 HydrophobicContact CD2-CD1 3.8Å; L490-L492 HydrophobicContact CD2-CG 4.19Å; L490-L492 HydrophobicContact CG-CD1 4.12Å; L490-L492 HydrophobicContact CG-CG 3.94Å
491	S	95.2	Very high	91.2	Very high	67 Å²	67	71.5 Å²	71.5	47%	0.469	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	111.9	168.2	-178.1	0	0	0	0	109.1	G484 E485	G484-S491 CarbonylContact C-O 3.55Å; G484-S491 WeakPolarHBondContact CA-O 3.16Å; E485-S491 PolarHBondContact N-O 2.78Å; E485-S491 PolarHBondContact O-N 2.86Å
492	L	94.1	Very high	90.5	Very high	26 Å²	26	78.2 Å²	78.2	14%	0.136	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.8	178.6	-75.7	177.3	0	0	0	110.8	I200 F203 F204 I468 V483 L490	I200-L492 HydrophobicContact CG1-CD1 4.27Å; F203-L492 HydrophobicContact CB-CD1 4.48Å; F203-L492 HydrophobicContact CD1-CD1 3.91Å; F203-L492 HydrophobicContact CE1-CB 4.31Å; F203-L492 HydrophobicContact CE1-CD1 4.32Å; F203-L492 HydrophobicContact CG-CD1 4.14Å; F203-L492 HydrophobicContact CZ-CB 4.26Å; F204-L492 HydrophobicContact CE2-CD1 4.21Å; F204-L492 HydrophobicContact CZ-CD1 4.4Å; I468-L492 HydrophobicContact CB-CD2 4.17Å; I468-L492 HydrophobicContact CD1-CD2 3.65Å; I468-L492 HydrophobicContact CD1-CG 4.34Å; I468-L492 HydrophobicContact CG2-CD2 3.96Å; V483-L492 HydrophobicContact CG2-CD2 4.33Å; L490-L492 HydrophobicContact CD1-CD1 4.1Å; L490-L492 HydrophobicContact CD1-CD2 4.35Å; L490-L492 HydrophobicContact CD1-CG 3.8Å; L490-L492 HydrophobicContact CD2-CD1 3.8Å; L490-L492 HydrophobicContact CD2-CG 4.19Å; L490-L492 HydrophobicContact CG-CD1 4.12Å; L490-L492 HydrophobicContact CG-CG 3.94Å
493	N	92.6	Very high	90	Very high	73 Å²	73	79.2 Å²	79.2	39%	0.39	42%	0.415	S	S	.	.			trans	-101.6	102.6	170.5	-170.9	-14.5	0	0	0	110.2	V483 D495 L496	V483-N493 PolarHBondContact O-N 3.5Å; N493-D495 PolarHBondContact O-N 3.34Å; N493-D495 PolarHBondContact OD1-N 3.49Å; N493-D495 VanDerWaalsContact OD1-N 3.17Å; N493-L496 HydrophobicContact CB-CD1 3.93Å; N493-L496 HydrophobicContact CB-CG 4.13Å; N493-L496 PolarHBondContact O-N 2.69Å
494	N	87.6	Confident	89.6	Confident	77 Å²	77	82.3 Å²	82.3	41%	0.412	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-63.4	-28.5	-177.5	-168.3	48.5	0	0	0	113.1	F203 L496 I497	F203-N494 HydrophobicContact CE1-CB 4.45Å; N494-L496 PolarHBondContact O-N 2.89Å; N494-I497 PolarHBondContact O-N 3.5Å
495	D	88	Confident	89.2	Confident	147 Å²	147	82.6 Å²	82.6	79%	0.786	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-71.1	-19.7	-177.6	-61.6	-29.1	0	0	0	112.8	N493	N493-D495 PolarHBondContact O-N 3.34Å; N493-D495 PolarHBondContact OD1-N 3.49Å; N493-D495 VanDerWaalsContact OD1-N 3.17Å
496	L	90.5	Very high	88.9	Confident	77 Å²	77	81.9 Å²	81.9	40%	0.403	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-85	-17.4	177.8	-62.3	179.8	0	0	0	112.9	Q472 V483 N493 N494	Q472-L496 PolarHBondContact NE2-O 3.03Å; Q472-L496 PolarHBondContact OE1-O 3.02Å; V483-L496 HydrophobicContact CG1-CB 3.98Å; N493-L496 HydrophobicContact CB-CD1 3.93Å; N493-L496 HydrophobicContact CB-CG 4.13Å; N493-L496 PolarHBondContact O-N 2.69Å; N494-L496 PolarHBondContact O-N 2.89Å
497	I	90.8	Very high	88.8	Confident	12 Å²	12	81.8 Å²	81.8	6%	0.062	43%	0.432	C	S	.	.			trans	-88.8	124.7	-174.9	-59.7	171.4	0	0	0	109.5	F204 V483 N494 W499	F204-I497 HydrophobicContact CE1-CD1 4.44Å; F204-I497 HydrophobicContact CZ-CD1 3.67Å; V483-I497 HydrophobicContact CB-CD1 4.26Å; V483-I497 HydrophobicContact CB-CG1 3.78Å; V483-I497 HydrophobicContact CG1-CG1 3.72Å; V483-I497 HydrophobicContact CG2-CD1 4.25Å; V483-I497 HydrophobicContact CG2-CG1 4.11Å; N494-I497 PolarHBondContact O-N 3.5Å; I497-W499 HydrophobicContact CG2-CD2 4.31Å; I497-W499 HydrophobicContact CG2-CH2 4.01Å; I497-W499 HydrophobicContact CG2-CZ2 3.6Å; I497-W499 HydrophobicContact CG2-CZ3 4.5Å
498	R	88.8	Confident	88.8	Confident	157 Å²	157	82.3 Å²	82.3	59%	0.592	43%	0.427	S	S	*	.			trans	-113.4	127.6	176.2	-63.2	-174	-179.8	-168.9	-1.2	111.2	Q472	Q472-R498 HydrophobicContact CB-CB 4.35Å; Q472-R498 VanDerWaalsContact OE1-N 3.09Å
499	W	89.7	Confident	88.8	Confident	25 Å²	25	75 Å²	75	10%	0.095	40%	0.395	C	S	.	.			trans	-93	146.8	178.6	-56.6	107.7	0	0	0	111.6	F204 W206 I292 I317 I497 K501 E502 V503 L504 P505	F204-W499 HydrophobicContact CD1-CZ2 4.15Å; F204-W499 HydrophobicContact CE1-CH2 4.45Å; F204-W499 AromaticContact CE1-CZ2 3.75Å; F204-W499 HydrophobicContact CE1-CZ2 3.75Å; F204-W499 HydrophobicContact CZ-CH2 4.34Å; F204-W499 AromaticContact CZ-CZ2 3.98Å; F204-W499 HydrophobicContact CZ-CZ2 3.98Å; W206-W499 AromaticContact CH2-CH2 3.6Å; W206-W499 HydrophobicContact CH2-CH2 3.6Å; W206-W499 HydrophobicContact CH2-CZ3 4.07Å; W206-W499 AromaticContact CZ2-CH2 3.81Å; W206-W499 HydrophobicContact CZ2-CH2 3.81Å; W206-W499 HydrophobicContact CZ2-CZ2 4.42Å; W206-W499 HydrophobicContact CZ2-CZ3 4.23Å; I292-W499 HydrophobicContact CD1-CE3 4.12Å; I292-W499 HydrophobicContact CD1-CZ3 4.27Å; I292-W499 HydrophobicContact CG1-CZ3 4.48Å; I292-W499 HydrophobicContact CG2-CZ3 3.97Å; I317-W499 HydrophobicContact CD1-CH2 3.84Å; I497-W499 HydrophobicContact CG2-CD2 4.31Å; I497-W499 HydrophobicContact CG2-CH2 4.01Å; I497-W499 HydrophobicContact CG2-CZ2 3.6Å; I497-W499 HydrophobicContact CG2-CZ3 4.5Å; W499-K501 PolarHBondContact O-N 3.37Å; W499-K501 VanDerWaalsContact O-N 3.07Å; W499-E502 PolarHBondContact O-N 3.03Å; W499-V503 WeakPolarHBondContact CB-O 3.34Å; W499-L504 HydrophobicContact CD2-CD1 4.35Å; W499-L504 VanDerWaalsContact CE2-CD1 3.48Å; W499-L504 HydrophobicContact CH2-CD1 4.08Å; W499-L504 HydrophobicContact CZ2-CD1 3.32Å; W499-P505 HydrophobicContact CE3-CG 4.49Å
500	P	83.4	Confident	88.6	Confident	59 Å²	59	72 Å²	72	38%	0.383	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-28.8	-177.8	-25.9	31.8	0	0	0	115	I292 E314	I292-P500 HydrophobicContact CD1-CG 4.45Å; E314-P500 HydrophobicContact CB-CG 4.26Å; E314-P500 HydrophobicContact CG-CB 4.39Å; E314-P500 HydrophobicContact CG-CG 4.03Å; E314-P500 WeakPolarHBondContact O-CG 3.34Å
501	K	80.6	Confident	88.2	Confident	182 Å²	182	75.6 Å²	75.6	79%	0.791	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	14.3	178.3	-66.1	-177.5	179.4	176.3	0	113.1	W499 V503	W499-K501 PolarHBondContact O-N 3.37Å; W499-K501 VanDerWaalsContact O-N 3.07Å; K501-V503 PolarHBondContact O-N 3.43Å
502	E	78.6	Confident	87.9	Confident	186 Å²	186	77.1 Å²	77.1	87%	0.869	40%	0.401	S	S	*	.	S	Bend	trans	56.5	8	-172.6	-57.2	-172	165.2	0	0	115.2	W499	W499-E502 PolarHBondContact O-N 3.03Å
503	V	83.1	Confident	87.6	Confident	103 Å²	103	77.1 Å²	77.1	62%	0.624	40%	0.403	S	S	*	.	S	Bend	trans	-123.2	133.9	178	-179.4	0	0	0	0	108.3	W499 K501 P505	W499-V503 WeakPolarHBondContact CB-O 3.34Å; K501-V503 PolarHBondContact O-N 3.43Å; V503-P505 WeakPolarHBondContact O-CD 3.44Å
504	L	85.5	Confident	87.2	Confident	67 Å²	67	80.6 Å²	80.6	35%	0.351	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-60	118.4	171.9	176.9	70.4	0	0	0	108.8	F204 W206 W499	F204-L504 HydrophobicContact CB-CD1 4.31Å; F204-L504 HydrophobicContact CD1-CD1 3.53Å; F204-L504 HydrophobicContact CD1-CD2 4.22Å; F204-L504 HydrophobicContact CE1-CD1 4.17Å; F204-L504 HydrophobicContact CG-CD1 4.13Å; W206-L504 HydrophobicContact CZ2-CD1 3.91Å; W499-L504 HydrophobicContact CD2-CD1 4.35Å; W499-L504 VanDerWaalsContact CE2-CD1 3.48Å; W499-L504 HydrophobicContact CH2-CD1 4.08Å; W499-L504 HydrophobicContact CZ2-CD1 3.32Å
505	P	87.4	Confident	86.7	Confident	30 Å²	30	86.7 Å²	86.7	20%	0.195	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-67.9	137.3	178	22	-26.1	0	0	0	110.2	W206 I292 W499 V503	W206-P505 HydrophobicContact CZ2-CG 4.35Å; W206-P505 PolarHBondContact NE1-O 3.31Å; I292-P505 HydrophobicContact CD1-CG 4.12Å; I292-P505 HydrophobicContact CG1-CB 4.44Å; I292-P505 HydrophobicContact CG1-CG 3.47Å; I292-P505 VanDerWaalsContact CG1-CG 3.47Å; W499-P505 HydrophobicContact CE3-CG 4.49Å; V503-P505 WeakPolarHBondContact O-CD 3.44Å
506	T	89	Confident	86.4	Confident	96 Å²	96	83.3 Å²	83.3	59%	0.589	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-88	129.1	172.7	49.7	0	0	0	0	109.1	H266	H266-T506 PolarHBondContact CD2-O 2.8Å
507	S	92.5	Very high	86.3	Confident	1 Å²	1	82.3 Å²	82.3	1%	0.007	41%	0.41	C	S	.	.			trans	-125	87.2	176.8	-155.2	0	0	0	0	108.9	T207 Y208 H266 V267	T207-S507 PolarHBondContact N-O 2.97Å; Y208-S507 PolarHBondContact N-O 2.01Å; Y208-S507 WeakPolarHBondContact O-CB 3.27Å; Y208-S507 PolarHBondContact O-OG 3.07Å; H266-S507 PolarHBondContact N-OG 3.08Å; V267-S507 PolarHBondContact N-OG 3.18Å
508	Q	91.2	Very high	86.1	Confident	54 Å²	54	83.9 Å²	83.9	25%	0.252	42%	0.417	S	S	.	.			trans	-138.1	144.1	-175.5	67.9	-170.6	34	0	0	110.1	T207 N264 D511	T207-Q508 WeakPolarHBondContact OG1-CB 3.49Å; N264-Q508 WeakPolarHBondContact CB-O 3.46Å; Q508-D511 PolarHBondContact NE2-OD1 3.31Å
509	C	89.3	Confident	86.2	Confident	14 Å²	14	78.5 Å²	78.5	10%	0.095	40%	0.398	C	S	.	.	S	Bend	trans	-71.4	-46.7	-173.6	-170.5	0	0	0	0	112.6	Y208 N264 C528	Y208-C509 HydrophobicContact CD1-CB 4.11Å; Y208-C509 HydrophobicContact CD2-CB 3.65Å; Y208-C509 HydrophobicContact CE1-CB 4.45Å; Y208-C509 HydrophobicContact CE2-CB 4.05Å; Y208-C509 HydrophobicContact CG-CB 3.68Å; N264-C509 PolarHBondContact ND2-O 3.34Å; C509-C528 HydrophobicContact CB-CB 3.97Å; C509-C528 WeakPolarHBondContact CB-SG 3.19Å; C509-C528 WeakPolarHBondContact SG-CB 3.45Å; C509-C528 CovalentContact SG-SG 2.01Å; C509-C528 PolarHBondContact SG-SG 3.38Å
510	S	88.2	Confident	86.1	Confident	20 Å²	20	83.5 Å²	83.5	14%	0.14	42%	0.42	C	S	.	.	S	Bend	trans	-130.1	140.5	-177.9	-60.7	0	0	0	0	109.7	W529	S510-W529 WeakPolarHBondContact CB-O 3.39Å; S510-W529 WeakPolarHBondContact O-CZ2 3.37Å; S510-W529 PolarHBondContact OG-N 3.17Å; S510-W529 PolarHBondContact OG-O 3.3Å
511	D	87	Confident	86.3	Confident	114 Å²	114	85 Å²	85	61%	0.61	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-70.8	154.7	173.8	-67.1	-38.1	0	0	0	111.3	Q508 C513 W529	Q508-D511 PolarHBondContact NE2-OD1 3.31Å; D511-C513 PolarHBondContact O-N 3.09Å; D511-W529 PolarHBondContact O-NE1 3.44Å
512	P	87.1	Confident	86.3	Confident	100 Å²	100	79.8 Å²	79.8	65%	0.649	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-55.6	129.7	171	-23.2	33.3	0	0	0	110.7
513	C	88.3	Confident	86.1	Confident	26 Å²	26	76.2 Å²	76.2	18%	0.176	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-65.6	151.2	179.7	-60.3	0	0	0	0	112.2	D511 E517 K519 W529 C531	D511-C513 PolarHBondContact O-N 3.09Å; C513-E517 HydrophobicContact CB-CB 4.04Å; C513-K519 HydrophobicContact CB-CG 4.49Å; C513-W529 VanDerWaalsContact SG-CD1 3.51Å; C513-C531 WeakPolarHBondContact CA-SG 3.41Å; C513-C531 HydrophobicContact CB-CB 3.67Å; C513-C531 WeakPolarHBondContact CB-SG 3.34Å; C513-C531 WeakPolarHBondContact SG-CA 3.46Å; C513-C531 WeakPolarHBondContact SG-CB 3.44Å; C513-C531 CovalentContact SG-SG 2.04Å; C513-C531 PolarHBondContact SG-SG 2.84Å
514	E	84.4	Confident	85.5	Confident	146 Å²	146	75.4 Å²	75.4	68%	0.682	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-66.9	161.9	172.7	-64.8	-165.4	169.5	0	0	111	N516 E517	E514-N516 PolarHBondContact O-N 3.28Å; E514-E517 HydrophobicContact CB-CG 4.33Å; E514-E517 PolarHBondContact N-OE2 3.2Å; E514-E517 PolarHBondContact O-N 3.28Å
515	R	76.8	Confident	84.9	Confident	205 Å²	205	75.5 Å²	75.5	77%	0.774	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-21.3	-175.2	-65.8	-177.1	-178.6	-177.7	0.5	114.4
516	N	82.3	Confident	84.4	Confident	75 Å²	75	79 Å²	79	40%	0.401	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	6.5	179.8	-164.8	-0.6	0	0	0	113	E514 A533 C534 L559	E514-N516 PolarHBondContact O-N 3.28Å; N516-A533 WeakPolarHBondContact O-CA 3.19Å; N516-C534 PolarHBondContact O-N 3.28Å; N516-L559 HydrophobicContact CB-CD1 3.53Å; N516-L559 WeakPolarHBondContact OD1-CD1 3.32Å
517	E	88	Confident	84.1	Confident	57 Å²	57	74.9 Å²	74.9	27%	0.266	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	134.4	-173.9	-59.9	-175.7	138.4	0	0	110.7	C513 E514 C531 T532 A533	C513-E517 HydrophobicContact CB-CB 4.04Å; E514-E517 HydrophobicContact CB-CG 4.33Å; E514-E517 PolarHBondContact N-OE2 3.2Å; E514-E517 PolarHBondContact O-N 3.28Å; E517-C531 HydrophobicContact CB-CB 3.95Å; E517-C531 HydrophobicContact CG-CB 4.46Å; E517-C531 WeakPolarHBondContact OE2-CB 3.47Å; E517-T532 CarbonylContact C-O 3.5Å; E517-T532 VanDerWaalsContact CA-O 3.32Å; E517-T532 WeakPolarHBondContact CA-O 3.3Å; E517-A533 HydrophobicContact CG-CB 4.37Å
518	M	87.6	Confident	83.9	Confident	45 Å²	45	74.8 Å²	74.8	22%	0.222	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	150.2	170	65	170.1	176.5	0	0	110.9	C531 T532 L540 C546	M518-C531 WeakPolarHBondContact O-CA 3.45Å; M518-T532 HydrophobicContact CE-CG2 4.44Å; M518-T532 PolarHBondContact N-O 3.22Å; M518-T532 PolarHBondContact O-N 3.29Å; M518-L540 HydrophobicContact CB-CD1 3.72Å; M518-C546 HydrophobicContact SD-CB 4.31Å
519	K	89.8	Confident	83.9	Confident	43 Å²	43	74.6 Å²	74.6	19%	0.187	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	123	172.5	-65.3	175.7	-175	170.1	0	109.8	C513 W529 E543 F544	C513-K519 HydrophobicContact CB-CG 4.49Å; K519-W529 HydrophobicContact CB-CB 4.12Å; K519-W529 HydrophobicContact CB-CG 4.16Å; K519-W529 HydrophobicContact CD-CD2 4.29Å; K519-W529 HydrophobicContact CD-CG 4.36Å; K519-W529 HydrophobicContact CG-CD2 4.46Å; K519-W529 HydrophobicContact CG-CG 4.04Å; K519-E543 WeakPolarHBondContact CB-O 3.17Å; K519-E543 HydrophobicContact CD-CB 4.39Å; K519-E543 PolarHBondContact N-O 3.07Å; K519-E543 IonicContact NZ-OE1 3.04Å; K519-E543 IonicContact NZ-OE2 3.84Å; K519-E543 PolarHBondContact NZ-OE2 3.16Å; K519-F544 HydrophobicContact CB-CD1 3.78Å; K519-F544 HydrophobicContact CB-CE1 3.81Å; K519-F544 HydrophobicContact CD-CE1 4.16Å; K519-F544 HydrophobicContact CD-CZ 4.39Å; K519-F544 WeakPolarHBondContact O-CD1 3.31Å
520	K	88.2	Confident	83.9	Confident	130 Å²	130	78 Å²	78	57%	0.565	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.3	106.8	169.7	-171	176	-177.5	176.6	0	109.9	W529 I530	K520-W529 CarbonylContact O-C 3.58Å; K520-W529 VanDerWaalsContact O-CA 3.29Å; K520-W529 WeakPolarHBondContact O-CA 3.1Å; K520-I530 WeakPolarHBondContact CB-O 3.47Å; K520-I530 PolarHBondContact N-O 3.43Å; K520-I530 PolarHBondContact O-N 3.02Å
521	M	86.4	Confident	84	Confident	90 Å²	90	78.9 Å²	78.9	44%	0.443	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	137.3	179.6	-64.7	-57.9	-151	0	0	111.4	Y526 W529 F544	M521-Y526 WeakPolarHBondContact CE-O 3.3Å; M521-W529 HydrophobicContact SD-CB 4.05Å; M521-W529 HydrophobicContact SD-CE3 4.39Å; M521-F544 HydrophobicContact CE-CE1 3.7Å; M521-F544 HydrophobicContact CE-CZ 4.07Å; M521-F544 HydrophobicContact CG-CE1 4.21Å; M521-F544 HydrophobicContact SD-CE1 4.18Å
522	Q	82.2	Confident	84.2	Confident	74 Å²	74	76 Å²	76	35%	0.346	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-75.3	142.8	174.3	-71.2	-175	-20.2	0	0	110.8	G524 E525 C528 I530	Q522-G524 PolarHBondContact O-N 3.03Å; Q522-E525 PolarHBondContact O-N 2.73Å; Q522-E525 VanDerWaalsContact O-O 3.04Å; Q522-C528 HydrophobicContact CB-CB 4.44Å; Q522-C528 PolarHBondContact N-O 3.5Å; Q522-I530 HydrophobicContact CG-CD1 4.01Å; Q522-I530 HydrophobicContact CG-CG1 4.03Å
523	A	73.9	Confident	84.3	Confident	110 Å²	110	74 Å²	74	91%	0.909	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	118.9	-177.8	0	0	0	0	0	110.7
524	G	71.1	Confident	84.2	Confident	87 Å²	87	73.4 Å²	73.4	90%	0.897	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	95	-8.2	178.7	0	0	0	0	0	115.2	Q522	Q522-G524 PolarHBondContact O-N 3.03Å
525	E	72.4	Confident	84.3	Confident	69 Å²	69	71.8 Å²	71.8	32%	0.322	39%	0.386	S	S	.	.			trans	-124.6	128.7	179.3	-64.3	-177.3	-177.7	0	0	109.9	Q522 C528	Q522-E525 PolarHBondContact O-N 2.73Å; Q522-E525 VanDerWaalsContact O-O 3.04Å; E525-C528 HydrophobicContact CB-CB 3.97Å; E525-C528 WeakPolarHBondContact OE2-CB 3.41Å; E525-C528 PolarHBondContact OE2-SG 2.89Å
526	Y	76.3	Confident	84.6	Confident	102 Å²	102	66.6 Å²	66.6	40%	0.4	38%	0.379	S	S	.	.	S	Bend	trans	-95.5	-11.2	-171.8	52.7	-91.3	0	0	0	114.7	R231 I235 C236 M521	R231-Y526 WeakPolarHBondContact CG-OH 3.2Å; I235-Y526 PolarHBondContact O-OH 3.41Å; C236-Y526 WeakPolarHBondContact SG-CE2 3.41Å; C236-Y526 VanDerWaalsContact SG-CZ 3.58Å; M521-Y526 WeakPolarHBondContact CE-O 3.3Å
527	C	83.8	Confident	84.6	Confident	10 Å²	10	64.5 Å²	64.5	7%	0.068	37%	0.367	C	S	.	.	S	Bend	trans	-112.2	-4.1	178.8	59	0	0	0	0	113.4	C236 W529	C236-C527 HydrophobicContact CB-CB 3.88Å; C236-C527 WeakPolarHBondContact CB-SG 3.39Å; C236-C527 WeakPolarHBondContact SG-CB 3.41Å; C236-C527 PolarHBondContact SG-N 3.22Å; C236-C527 CovalentContact SG-SG 1.99Å; C236-C527 PolarHBondContact SG-SG 3.09Å; C527-W529 WeakPolarHBondContact O-CZ3 3.32Å
528	C	88.3	Confident	84.5	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	36%	0.363	C	S	.	.			trans	-107.2	120.9	-175.8	-60.8	0	0	0	0	108.3	C509 Q522 E525	C509-C528 HydrophobicContact CB-CB 3.97Å; C509-C528 WeakPolarHBondContact CB-SG 3.19Å; C509-C528 WeakPolarHBondContact SG-CB 3.45Å; C509-C528 CovalentContact SG-SG 2.01Å; C509-C528 PolarHBondContact SG-SG 3.38Å; Q522-C528 HydrophobicContact CB-CB 4.44Å; Q522-C528 PolarHBondContact N-O 3.5Å; E525-C528 HydrophobicContact CB-CB 3.97Å; E525-C528 WeakPolarHBondContact OE2-CB 3.41Å; E525-C528 PolarHBondContact OE2-SG 2.89Å
529	W	89.6	Confident	84.5	Confident	50 Å²	50	64.7 Å²	64.7	19%	0.189	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	154.6	177.8	57.3	80.2	0	0	0	111.3	S510 D511 C513 K519 K520 M521 C527	S510-W529 WeakPolarHBondContact CB-O 3.39Å; S510-W529 WeakPolarHBondContact O-CZ2 3.37Å; S510-W529 PolarHBondContact OG-N 3.17Å; S510-W529 PolarHBondContact OG-O 3.3Å; D511-W529 PolarHBondContact O-NE1 3.44Å; C513-W529 VanDerWaalsContact SG-CD1 3.51Å; K519-W529 HydrophobicContact CB-CB 4.12Å; K519-W529 HydrophobicContact CB-CG 4.16Å; K519-W529 HydrophobicContact CD-CD2 4.29Å; K519-W529 HydrophobicContact CD-CG 4.36Å; K519-W529 HydrophobicContact CG-CD2 4.46Å; K519-W529 HydrophobicContact CG-CG 4.04Å; K520-W529 CarbonylContact O-C 3.58Å; K520-W529 VanDerWaalsContact O-CA 3.29Å; K520-W529 WeakPolarHBondContact O-CA 3.1Å; M521-W529 HydrophobicContact SD-CB 4.05Å; M521-W529 HydrophobicContact SD-CE3 4.39Å; C527-W529 WeakPolarHBondContact O-CZ3 3.32Å
530	I	90.2	Very high	84.5	Confident	86 Å²	86	64.8 Å²	64.8	44%	0.441	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	129.4	170	-60.7	165.4	0	0	0	107	K520 Q522	K520-I530 WeakPolarHBondContact CB-O 3.47Å; K520-I530 PolarHBondContact N-O 3.43Å; K520-I530 PolarHBondContact O-N 3.02Å; Q522-I530 HydrophobicContact CG-CD1 4.01Å; Q522-I530 HydrophobicContact CG-CG1 4.03Å
531	C	91.1	Very high	84.3	Confident	38 Å²	38	61.1 Å²	61.1	26%	0.257	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	125.9	174.6	-54.2	0	0	0	0	109.1	C513 E517 M518	C513-C531 WeakPolarHBondContact CA-SG 3.41Å; C513-C531 HydrophobicContact CB-CB 3.67Å; C513-C531 WeakPolarHBondContact CB-SG 3.34Å; C513-C531 WeakPolarHBondContact SG-CA 3.46Å; C513-C531 WeakPolarHBondContact SG-CB 3.44Å; C513-C531 CovalentContact SG-SG 2.04Å; C513-C531 PolarHBondContact SG-SG 2.84Å; E517-C531 HydrophobicContact CB-CB 3.95Å; E517-C531 HydrophobicContact CG-CB 4.46Å; E517-C531 WeakPolarHBondContact OE2-CB 3.47Å; M518-C531 WeakPolarHBondContact O-CA 3.45Å
532	T	89.9	Confident	84.1	Confident	52 Å²	52	61.6 Å²	61.6	32%	0.319	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	123.1	-179.8	-52.7	0	0	0	0	108.8	E517 M518	E517-T532 CarbonylContact C-O 3.5Å; E517-T532 VanDerWaalsContact CA-O 3.32Å; E517-T532 WeakPolarHBondContact CA-O 3.3Å; M518-T532 HydrophobicContact CE-CG2 4.44Å; M518-T532 PolarHBondContact N-O 3.22Å; M518-T532 PolarHBondContact O-N 3.29Å
533	A	88.8	Confident	84.2	Confident	60 Å²	60	63 Å²	63	50%	0.496	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	137.5	177.8	0	0	0	0	0	111.9	N516 E517	N516-A533 WeakPolarHBondContact O-CA 3.19Å; E517-A533 HydrophobicContact CG-CB 4.37Å
534	C	87.3	Confident	84.8	Confident	12 Å²	12	62 Å²	62	8%	0.081	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-68.5	155.3	171.2	-64.3	0	0	0	0	111	N516 E538 C546	N516-C534 PolarHBondContact O-N 3.28Å; C534-E538 HydrophobicContact CB-CB 4.34Å; C534-C546 WeakPolarHBondContact CA-SG 3.46Å; C534-C546 HydrophobicContact CB-CB 3.78Å; C534-C546 WeakPolarHBondContact CB-SG 3.07Å; C534-C546 WeakPolarHBondContact SG-CB 3.33Å; C534-C546 CovalentContact SG-SG 2.04Å; C534-C546 PolarHBondContact SG-SG 2.88Å
535	E	86.2	Confident	85.6	Confident	112 Å²	112	61.1 Å²	61.1	52%	0.523	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-69.2	155.2	172.2	-71.6	-156.6	-171.8	0	0	111.6	H537 E538	E535-H537 PolarHBondContact O-N 3.25Å; E535-H537 IonicContact OE2-CE1 3.47Å; E535-H537 PolarHBondContact OE2-CE1 2.78Å; E535-H537 IonicContact OE2-ND1 3.2Å; E535-H537 PolarHBondContact OE2-ND1 3.45Å; E535-E538 HydrophobicContact CB-CG 3.99Å; E535-E538 PolarHBondContact N-OE2 3.45Å; E535-E538 VanDerWaalsContact N-OE2 3.15Å; E535-E538 WeakPolarHBondContact O-CB 3.2Å; E535-E538 PolarHBondContact O-N 3.39Å
536	P	82.8	Confident	86.5	Confident	97 Å²	97	58.7 Å²	58.7	63%	0.63	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-13	-174.3	-25.4	34.1	0	0	0	116.2	W554 P555	P536-W554 HydrophobicContact CB-CZ2 4.35Å; P536-W554 WeakPolarHBondContact O-CZ2 3.36Å; P536-P555 VanDerWaalsContact O-CG 3.27Å; P536-P555 WeakPolarHBondContact O-CG 3.28Å
537	H	82.9	Confident	87.1	Confident	31 Å²	31	55.4 Å²	55.4	14%	0.144	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	5.2	-178.2	72.6	-84.6	0	0	0	112.5	E535 C549 W554 R725	E535-H537 PolarHBondContact O-N 3.25Å; E535-H537 IonicContact OE2-CE1 3.47Å; E535-H537 PolarHBondContact OE2-CE1 2.78Å; E535-H537 IonicContact OE2-ND1 3.2Å; E535-H537 PolarHBondContact OE2-ND1 3.45Å; H537-C549 PolarHBondContact O-N 3.4Å; H537-W554 HydrophobicContact CB-CH2 4.48Å; H537-W554 HydrophobicContact CB-CZ3 4.46Å; H537-R725 PolarHBondContact CD2-NH1 3.3Å; H537-R725 PolarHBondContact CE1-NH1 3Å; H537-R725 PolarHBondContact NE2-NH1 2.88Å
538	E	86.6	Confident	87.3	Confident	39 Å²	39	58.7 Å²	58.7	18%	0.182	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	156.4	179	-60.6	-178.4	148.3	0	0	109.8	C534 E535 C546 S547 P548 P555 L559	C534-E538 HydrophobicContact CB-CB 4.34Å; E535-E538 HydrophobicContact CB-CG 3.99Å; E535-E538 PolarHBondContact N-OE2 3.45Å; E535-E538 VanDerWaalsContact N-OE2 3.15Å; E535-E538 WeakPolarHBondContact O-CB 3.2Å; E535-E538 PolarHBondContact O-N 3.39Å; E538-C546 HydrophobicContact CB-CB 4.15Å; E538-C546 WeakPolarHBondContact OE2-CB 3.27Å; E538-S547 CarbonylContact C-O 3.55Å; E538-S547 WeakPolarHBondContact CA-O 3.29Å; E538-S547 WeakPolarHBondContact CB-O 3.26Å; E538-P548 HydrophobicContact CG-CB 4.28Å; E538-P555 WeakPolarHBondContact O-CB 3.3Å; E538-P555 WeakPolarHBondContact O-CG 3.47Å; E538-L559 VanDerWaalsContact O-CD2 3.3Å; E538-L559 WeakPolarHBondContact O-CD2 3.13Å
539	Y	87.1	Confident	87.1	Confident	67 Å²	67	59.5 Å²	59.5	26%	0.263	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	156.1	173.3	76	-82.3	0	0	0	108.5	A541 C546 S547 L559 C562	Y539-A541 HydrophobicContact CE2-CB 4.02Å; Y539-A541 PolarHBondContact O-N 2.79Å; Y539-C546 CarbonylContact O-C 3.55Å; Y539-C546 WeakPolarHBondContact O-CA 3.22Å; Y539-S547 WeakPolarHBondContact CD1-O 3.24Å; Y539-S547 PolarHBondContact N-O 2.97Å; Y539-S547 PolarHBondContact O-N 3.41Å; Y539-L559 CarbonylContact C-O 3.59Å; Y539-L559 WeakPolarHBondContact CA-O 3.18Å; Y539-L559 VanDerWaalsContact CB-O 3.31Å; Y539-L559 WeakPolarHBondContact CB-O 3.19Å; Y539-C562 VanDerWaalsContact CD1-SG 3.53Å
540	L	88.5	Confident	86.9	Confident	44 Å²	44	59.5 Å²	59.5	23%	0.23	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	103.5	179	-169.5	69.7	0	0	0	109.1	M518 D542 L559	M518-L540 HydrophobicContact CB-CD1 3.72Å; L540-D542 WeakPolarHBondContact CD1-O 3.38Å; L540-D542 WeakPolarHBondContact CG-O 2.95Å; L540-L559 PolarHBondContact N-O 3.25Å
541	A	84.6	Confident	86.2	Confident	54 Å²	54	61.4 Å²	61.4	45%	0.446	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	-36	-179.6	0	0	0	0	0	112	Y539 T545	Y539-A541 HydrophobicContact CE2-CB 4.02Å; Y539-A541 PolarHBondContact O-N 2.79Å; A541-T545 PolarHBondContact N-O 2.72Å
542	D	82.6	Confident	85.4	Confident	99 Å²	99	60.2 Å²	60.2	53%	0.529	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	165.5	173.6	-165.2	10.7	0	0	0	108.5	L540 F544 T545	L540-D542 WeakPolarHBondContact CD1-O 3.38Å; L540-D542 WeakPolarHBondContact CG-O 2.95Å; D542-F544 PolarHBondContact O-N 3.43Å; D542-T545 PolarHBondContact N-O 3.37Å; D542-T545 PolarHBondContact O-N 3.34Å
543	E	84.4	Confident	85.1	Confident	103 Å²	103	60.7 Å²	60.7	48%	0.481	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-17.9	-178.5	-68.2	-167.8	163.4	0	0	113.4	K519	K519-E543 WeakPolarHBondContact CB-O 3.17Å; K519-E543 HydrophobicContact CD-CB 4.39Å; K519-E543 PolarHBondContact N-O 3.07Å; K519-E543 IonicContact NZ-OE1 3.04Å; K519-E543 IonicContact NZ-OE2 3.84Å; K519-E543 PolarHBondContact NZ-OE2 3.16Å
544	F	87.1	Confident	84.9	Confident	89 Å²	89	60.1 Å²	60.1	39%	0.39	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-0.1	-177.2	-56.9	-79.9	0	0	0	114.3	K519 M521 D542	K519-F544 HydrophobicContact CB-CD1 3.78Å; K519-F544 HydrophobicContact CB-CE1 3.81Å; K519-F544 HydrophobicContact CD-CE1 4.16Å; K519-F544 HydrophobicContact CD-CZ 4.39Å; K519-F544 WeakPolarHBondContact O-CD1 3.31Å; M521-F544 HydrophobicContact CE-CE1 3.7Å; M521-F544 HydrophobicContact CE-CZ 4.07Å; M521-F544 HydrophobicContact CG-CE1 4.21Å; M521-F544 HydrophobicContact SD-CE1 4.18Å; D542-F544 PolarHBondContact O-N 3.43Å
545	T	87.9	Confident	85	Confident	70 Å²	70	59.8 Å²	59.8	43%	0.429	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	120.5	-170.6	-57	0	0	0	0	113.6	A541 D542	A541-T545 PolarHBondContact N-O 2.72Å; D542-T545 PolarHBondContact N-O 3.37Å; D542-T545 PolarHBondContact O-N 3.34Å
546	C	90.1	Very high	84.9	Confident	18 Å²	18	56 Å²	56	12%	0.122	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	137.3	164.6	-51	0	0	0	0	110.1	M518 C534 E538 Y539	M518-C546 HydrophobicContact SD-CB 4.31Å; C534-C546 WeakPolarHBondContact CA-SG 3.46Å; C534-C546 HydrophobicContact CB-CB 3.78Å; C534-C546 WeakPolarHBondContact CB-SG 3.07Å; C534-C546 WeakPolarHBondContact SG-CB 3.33Å; C534-C546 CovalentContact SG-SG 2.04Å; C534-C546 PolarHBondContact SG-SG 2.88Å; E538-C546 HydrophobicContact CB-CB 4.15Å; E538-C546 WeakPolarHBondContact OE2-CB 3.27Å; Y539-C546 CarbonylContact O-C 3.55Å; Y539-C546 WeakPolarHBondContact O-CA 3.22Å
547	S	88.4	Confident	84.8	Confident	32 Å²	32	59.1 Å²	59.1	22%	0.224	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	140.5	178.1	-70.5	0	0	0	0	111.4	E538 Y539	E538-S547 CarbonylContact C-O 3.55Å; E538-S547 WeakPolarHBondContact CA-O 3.29Å; E538-S547 WeakPolarHBondContact CB-O 3.26Å; Y539-S547 WeakPolarHBondContact CD1-O 3.24Å; Y539-S547 PolarHBondContact N-O 2.97Å; Y539-S547 PolarHBondContact O-N 3.41Å
548	P	88.3	Confident	84.7	Confident	80 Å²	80	62.6 Å²	62.6	52%	0.519	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	142	-179.1	29.5	-34.7	0	0	0	112.7	E538	E538-P548 HydrophobicContact CG-CB 4.28Å
549	C	85.7	Confident	84.4	Confident	17 Å²	17	61.6 Å²	61.6	12%	0.115	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-68.9	153.3	169.9	-69.8	0	0	0	0	111.9	H537 Q553 P555 C562	H537-C549 PolarHBondContact O-N 3.4Å; C549-Q553 HydrophobicContact CB-CB 4.21Å; C549-P555 VanDerWaalsContact SG-N 3.45Å; C549-C562 VanDerWaalsContact CA-SG 3.53Å; C549-C562 HydrophobicContact CB-CB 3.87Å; C549-C562 WeakPolarHBondContact CB-SG 3.28Å; C549-C562 WeakPolarHBondContact SG-CB 3.11Å; C549-C562 CovalentContact SG-SG 2.04Å; C549-C562 PolarHBondContact SG-SG 3.36Å
550	A	83.7	Confident	84.2	Confident	50 Å²	50	63 Å²	63	41%	0.413	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-65.1	155.1	177.9	0	0	0	0	0	111.8	G552 Q553	A550-G552 PolarHBondContact O-N 3.34Å; A550-Q553 HydrophobicContact CB-CG 4.45Å; A550-Q553 WeakPolarHBondContact O-CB 3.12Å; A550-Q553 PolarHBondContact O-N 2.82Å
551	P	75.3	Confident	84	Confident	125 Å²	125	63.6 Å²	63.6	81%	0.812	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	122.9	178.8	-24.7	33.9	0	0	0	112.5
552	G	75.7	Confident	84.2	Confident	13 Å²	13	62.7 Å²	62.7	13%	0.134	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.1	7.2	-176.1	0	0	0	0	0	114.8	A550 L565	A550-G552 PolarHBondContact O-N 3.34Å; G552-L565 WeakPolarHBondContact O-CB 3.45Å; G552-L565 PolarHBondContact O-N 3.02Å
553	Q	83.5	Confident	84.4	Confident	63 Å²	63	63 Å²	63	29%	0.294	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	157.3	172	-58.6	-170.6	-37	0	0	111	C549 A550 C562 Y563 D564	C549-Q553 HydrophobicContact CB-CB 4.21Å; A550-Q553 HydrophobicContact CB-CG 4.45Å; A550-Q553 WeakPolarHBondContact O-CB 3.12Å; A550-Q553 PolarHBondContact O-N 2.82Å; Q553-C562 HydrophobicContact CB-CB 4.02Å; Q553-Y563 CarbonylContact C-O 3.55Å; Q553-Y563 WeakPolarHBondContact CA-O 3.22Å; Q553-Y563 WeakPolarHBondContact CB-O 3.33Å; Q553-D564 WeakPolarHBondContact CG-OD1 3.44Å; Q553-D564 PolarHBondContact NE2-OD1 3.09Å
554	W	84.9	Confident	84.4	Confident	47 Å²	47	62.8 Å²	62.8	18%	0.178	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	144.4	178.6	-157.1	-94.6	0	0	0	110.4	P536 H537 C562 Y563 L565 R725 Q726	P536-W554 HydrophobicContact CB-CZ2 4.35Å; P536-W554 WeakPolarHBondContact O-CZ2 3.36Å; H537-W554 HydrophobicContact CB-CH2 4.48Å; H537-W554 HydrophobicContact CB-CZ3 4.46Å; W554-C562 CarbonylContact O-C 3.53Å; W554-C562 VanDerWaalsContact O-CA 3.26Å; W554-C562 WeakPolarHBondContact O-CA 3.41Å; W554-Y563 HydrophobicContact CB-CE1 4.05Å; W554-Y563 HydrophobicContact CB-CE2 4.17Å; W554-Y563 PolarHBondContact N-O 2.61Å; W554-Y563 WeakPolarHBondContact O-CD1 3.47Å; W554-Y563 PolarHBondContact O-N 3.04Å; W554-L565 HydrophobicContact CB-CD1 4.47Å; W554-L565 HydrophobicContact CB-CD2 3.82Å; W554-L565 HydrophobicContact CB-CG 4.04Å; W554-L565 HydrophobicContact CE3-CD1 4.28Å; W554-L565 HydrophobicContact CG-CD2 4.36Å; W554-R725 HydrophobicContact CZ3-CB 4.08Å; W554-Q726 HydrophobicContact CE3-CG 4.38Å; W554-Q726 HydrophobicContact CH2-CG 3.87Å; W554-Q726 HydrophobicContact CZ2-CG 4.23Å; W554-Q726 HydrophobicContact CZ3-CG 3.96Å
555	P	88.7	Confident	84.1	Confident	5 Å²	5	59.4 Å²	59.4	3%	0.032	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	145.7	178.1	27.5	-35.5	0	0	0	111.7	P536 E538 C549 L559 S561 Y563	P536-P555 VanDerWaalsContact O-CG 3.27Å; P536-P555 WeakPolarHBondContact O-CG 3.28Å; E538-P555 WeakPolarHBondContact O-CB 3.3Å; E538-P555 WeakPolarHBondContact O-CG 3.47Å; C549-P555 VanDerWaalsContact SG-N 3.45Å; P555-L559 HydrophobicContact CB-CD2 4.06Å; P555-L559 HydrophobicContact CG-CD2 4.33Å; P555-S561 CarbonylContact C-O 3.13Å; P555-S561 WeakPolarHBondContact CA-O 3.17Å; P555-Y563 VanDerWaalsContact O-CE1 3.26Å; P555-Y563 WeakPolarHBondContact O-CE1 3.35Å
556	T	85.1	Confident	83.8	Confident	32 Å²	32	60.6 Å²	60.6	20%	0.196	35%	0.354	C	S	.	.			trans	-63.7	159.3	170.1	51.7	0	0	0	0	111.4	D558 L559 T560 S561 Y563	T556-D558 PolarHBondContact O-N 3.44Å; T556-L559 WeakPolarHBondContact O-CA 3.45Å; T556-L559 PolarHBondContact O-N 3.15Å; T556-L559 PolarHBondContact OG1-N 2.81Å; T556-T560 PolarHBondContact OG1-N 3.48Å; T556-S561 VanDerWaalsContact CG2-OG 3.28Å; T556-S561 WeakPolarHBondContact CG2-OG 3.47Å; T556-S561 PolarHBondContact N-O 3.46Å; T556-S561 PolarHBondContact OG1-N 3.44Å; T556-S561 PolarHBondContact OG1-O 3.49Å; T556-S561 VanDerWaalsContact OG1-O 3.12Å; T556-Y563 HydrophobicContact CG2-CD1 4.11Å
557	D	80.5	Confident	83.4	Confident	163 Å²	163	62.6 Å²	62.6	87%	0.872	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-31.2	176.2	-63.5	-27.9	0	0	0	112.8	L559	D557-L559 PolarHBondContact O-N 3.5Å
558	D	79.8	Confident	83.2	Confident	104 Å²	104	63.4 Å²	63.4	56%	0.556	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-2.5	174.3	-67.1	-43.8	0	0	0	113.7	T556 T560	T556-D558 PolarHBondContact O-N 3.44Å; D558-T560 HydrophobicContact CB-CG2 4.47Å; D558-T560 WeakPolarHBondContact O-CG2 3.38Å; D558-T560 PolarHBondContact O-N 2.82Å
559	L	80.6	Confident	83	Confident	19 Å²	19	62.2 Å²	62.2	10%	0.099	35%	0.349	C	S	.	.	S	Bend	trans	51.1	26.1	179.7	-61.8	148.6	0	0	0	114.8	N516 E538 Y539 L540 P555 T556 D557	N516-L559 HydrophobicContact CB-CD1 3.53Å; N516-L559 WeakPolarHBondContact OD1-CD1 3.32Å; E538-L559 VanDerWaalsContact O-CD2 3.3Å; E538-L559 WeakPolarHBondContact O-CD2 3.13Å; Y539-L559 CarbonylContact C-O 3.59Å; Y539-L559 WeakPolarHBondContact CA-O 3.18Å; Y539-L559 VanDerWaalsContact CB-O 3.31Å; Y539-L559 WeakPolarHBondContact CB-O 3.19Å; L540-L559 PolarHBondContact N-O 3.25Å; P555-L559 HydrophobicContact CB-CD2 4.06Å; P555-L559 HydrophobicContact CG-CD2 4.33Å; T556-L559 WeakPolarHBondContact O-CA 3.45Å; T556-L559 PolarHBondContact O-N 3.15Å; T556-L559 PolarHBondContact OG1-N 2.81Å; D557-L559 PolarHBondContact O-N 3.5Å
560	T	82.4	Confident	83	Confident	96 Å²	96	62.1 Å²	62.1	59%	0.589	35%	0.347	S	S	*	.	S	Bend	trans	-95.5	-23.6	178.2	50.4	0	0	0	0	112.7	T556 D558	T556-T560 PolarHBondContact OG1-N 3.48Å; D558-T560 HydrophobicContact CB-CG2 4.47Å; D558-T560 WeakPolarHBondContact O-CG2 3.38Å; D558-T560 PolarHBondContact O-N 2.82Å
561	S	84.8	Confident	83.1	Confident	56 Å²	56	63.5 Å²	63.5	39%	0.392	35%	0.346	S	S	.	.	S	Bend	trans	-149.9	171.6	-175.2	64.7	0	0	0	0	111.8	P555 T556	P555-S561 CarbonylContact C-O 3.13Å; P555-S561 WeakPolarHBondContact CA-O 3.17Å; T556-S561 VanDerWaalsContact CG2-OG 3.28Å; T556-S561 WeakPolarHBondContact CG2-OG 3.47Å; T556-S561 PolarHBondContact N-O 3.46Å; T556-S561 PolarHBondContact OG1-N 3.44Å; T556-S561 PolarHBondContact OG1-O 3.49Å; T556-S561 VanDerWaalsContact OG1-O 3.12Å
562	C	88.6	Confident	83.7	Confident	36 Å²	36	63.6 Å²	63.6	24%	0.243	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	142.8	176.7	-52	0	0	0	0	110.5	Y539 C549 Q553 W554	Y539-C562 VanDerWaalsContact CD1-SG 3.53Å; C549-C562 VanDerWaalsContact CA-SG 3.53Å; C549-C562 HydrophobicContact CB-CB 3.87Å; C549-C562 WeakPolarHBondContact CB-SG 3.28Å; C549-C562 WeakPolarHBondContact SG-CB 3.11Å; C549-C562 CovalentContact SG-SG 2.04Å; C549-C562 PolarHBondContact SG-SG 3.36Å; Q553-C562 HydrophobicContact CB-CB 4.02Å; W554-C562 CarbonylContact O-C 3.53Å; W554-C562 VanDerWaalsContact O-CA 3.26Å; W554-C562 WeakPolarHBondContact O-CA 3.41Å
563	Y	87.1	Confident	84.2	Confident	106 Å²	106	71 Å²	71	42%	0.416	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	153.8	172.7	67.4	-92.1	0	0	0	111.4	Q553 W554 P555 T556 L565	Q553-Y563 CarbonylContact C-O 3.55Å; Q553-Y563 WeakPolarHBondContact CA-O 3.22Å; Q553-Y563 WeakPolarHBondContact CB-O 3.33Å; W554-Y563 HydrophobicContact CB-CE1 4.05Å; W554-Y563 HydrophobicContact CB-CE2 4.17Å; W554-Y563 PolarHBondContact N-O 2.61Å; W554-Y563 WeakPolarHBondContact O-CD1 3.47Å; W554-Y563 PolarHBondContact O-N 3.04Å; P555-Y563 VanDerWaalsContact O-CE1 3.26Å; P555-Y563 WeakPolarHBondContact O-CE1 3.35Å; T556-Y563 HydrophobicContact CG2-CD1 4.11Å; Y563-L565 HydrophobicContact CE2-CD2 4.49Å
564	D	83.8	Confident	84.4	Confident	97 Å²	97	70 Å²	70	52%	0.519	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	130.9	178.9	-72.3	-37.5	0	0	0	111.4	Q553	Q553-D564 WeakPolarHBondContact CG-OD1 3.44Å; Q553-D564 PolarHBondContact NE2-OD1 3.09Å
565	L	82.3	Confident	84.5	Confident	18 Å²	18	71.7 Å²	71.7	9%	0.094	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-71.5	149.3	176.1	-74.6	165.2	0	0	0	111.5	G552 W554 Y563 R725 Q726 V728	G552-L565 WeakPolarHBondContact O-CB 3.45Å; G552-L565 PolarHBondContact O-N 3.02Å; W554-L565 HydrophobicContact CB-CD1 4.47Å; W554-L565 HydrophobicContact CB-CD2 3.82Å; W554-L565 HydrophobicContact CB-CG 4.04Å; W554-L565 HydrophobicContact CE3-CD1 4.28Å; W554-L565 HydrophobicContact CG-CD2 4.36Å; Y563-L565 HydrophobicContact CE2-CD2 4.49Å; L565-R725 VanDerWaalsContact CD1-O 3.24Å; L565-R725 WeakPolarHBondContact CD1-O 3.5Å; L565-Q726 WeakPolarHBondContact CD2-O 3.46Å; L565-V728 HydrophobicContact CB-CG2 3.73Å; L565-V728 HydrophobicContact CD1-CG2 4.18Å
566	P	80.8	Confident	84.5	Confident	96 Å²	96	77 Å²	77	62%	0.623	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-64.1	139.9	177.7	26.2	-33.4	0	0	0	112
567	E	82.4	Confident	84.8	Confident	60 Å²	60	75.4 Å²	75.4	28%	0.28	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	121.2	179.3	-62.8	178.6	161.5	0	0	111	K635 R718 V728	E567-K635 IonicContact OE2-NZ 2.68Å; E567-K635 PolarHBondContact OE2-NZ 2.99Å; E567-R718 IonicContact OE1-CZ 3.62Å; E567-R718 IonicContact OE1-NE 2.78Å; E567-R718 PolarHBondContact OE1-NE 3.43Å; E567-R718 IonicContact OE1-NH2 3.66Å; E567-R718 PolarHBondContact OE1-NH2 2.84Å; E567-V728 CarbonylContact C-O 3.45Å; E567-V728 WeakPolarHBondContact CA-O 3.32Å
568	D	82.4	Confident	85.4	Confident	48 Å²	48	71.8 Å²	71.8	26%	0.257	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	124.8	173	-175.3	44.7	0	0	0	110.7	V728 L730 Y798 R799	D568-V728 PolarHBondContact N-O 3.5Å; D568-L730 PolarHBondContact O-N 3.38Å; D568-L730 VanDerWaalsContact O-N 3.11Å; D568-Y798 PolarHBondContact OD2-OH 2.87Å; D568-R799 VanDerWaalsContact CG-NH2 3.3Å; D568-R799 IonicContact OD1-NH2 2.73Å; D568-R799 PolarHBondContact OD1-NH2 3.02Å; D568-R799 IonicContact OD2-CZ 2.89Å; D568-R799 IonicContact OD2-NH2 3.27Å; D568-R799 PolarHBondContact OD2-NH2 2.88Å
569	Y	85.3	Confident	85.9	Confident	55 Å²	55	68.3 Å²	68.3	22%	0.216	36%	0.36	C	S	.	.			trans	-150.4	163.6	176.1	64.5	-86.7	0	0	0	110.2	M571 K635	Y569-M571 HydrophobicContact CD2-SD 4.08Å; Y569-M571 HydrophobicContact CE1-SD 4.21Å; Y569-M571 HydrophobicContact CE2-CG 4.35Å; Y569-M571 HydrophobicContact CE2-SD 3.23Å; Y569-M571 WeakPolarHBondContact CE2-SD 3.36Å; Y569-M571 PolarHBondContact O-N 3.47Å; Y569-M571 VanDerWaalsContact O-N 3.16Å; Y569-M571 PolarHBondContact OH-SD 2.82Å; Y569-K635 HydrophobicContact CD2-CB 4.37Å; Y569-K635 HydrophobicContact CD2-CG 4.21Å; Y569-K635 HydrophobicContact CE1-CD 4.07Å; Y569-K635 HydrophobicContact CE2-CB 4.17Å; Y569-K635 HydrophobicContact CE2-CD 4.24Å; Y569-K635 HydrophobicContact CE2-CG 4.12Å; Y569-K635 HydrophobicContact CG-CG 4.46Å
570	I	85.2	Confident	86.5	Confident	15 Å²	15	67.4 Å²	67.4	8%	0.077	36%	0.356	C	S	.	.			trans	-66.5	116.3	178.4	-55.7	174.2	0	0	0	109.1	D574 A577 L633 Y798 R799 T802	I570-D574 WeakPolarHBondContact CA-OD2 3.22Å; I570-D574 HydrophobicContact CG2-CB 4.31Å; I570-A577 HydrophobicContact CG2-CB 3.91Å; I570-L633 HydrophobicContact CD1-CD2 4.4Å; I570-L633 HydrophobicContact CG2-CD2 4.13Å; I570-Y798 HydrophobicContact CD1-CE2 4.48Å; I570-Y798 HydrophobicContact CG1-CD2 4.36Å; I570-Y798 HydrophobicContact CG1-CE2 3.83Å; I570-R799 HydrophobicContact CG1-CG 4.15Å; I570-T802 HydrophobicContact CD1-CG2 4.14Å
571	M	86.3	Confident	87.1	Confident	80 Å²	80	64.3 Å²	64.3	39%	0.394	34%	0.335	S	S	.	.			trans	-84.7	152.4	174.5	-67.7	-68.9	-82.8	0	0	109.9	Y569 E573 D574 A577	Y569-M571 HydrophobicContact CD2-SD 4.08Å; Y569-M571 HydrophobicContact CE1-SD 4.21Å; Y569-M571 HydrophobicContact CE2-CG 4.35Å; Y569-M571 HydrophobicContact CE2-SD 3.23Å; Y569-M571 WeakPolarHBondContact CE2-SD 3.36Å; Y569-M571 PolarHBondContact O-N 3.47Å; Y569-M571 VanDerWaalsContact O-N 3.16Å; Y569-M571 PolarHBondContact OH-SD 2.82Å; M571-E573 PolarHBondContact O-N 2.96Å; M571-E573 VanDerWaalsContact O-N 3.14Å; M571-D574 PolarHBondContact N-OD2 2.9Å; M571-D574 WeakPolarHBondContact O-CB 3.44Å; M571-D574 PolarHBondContact O-N 3.26Å; M571-A577 WeakPolarHBondContact O-CB 3.42Å
572	W	87.3	Confident	87.5	Confident	126 Å²	126	65.2 Å²	65.2	48%	0.477	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-23.2	177.5	-62.8	98.5	0	0	0	113.2	I581 F630 L633 A634	W572-I581 HydrophobicContact CE3-CD1 3.57Å; W572-I581 HydrophobicContact CZ3-CD1 3.88Å; W572-I581 HydrophobicContact CZ3-CG1 4.46Å; W572-F630 HydrophobicContact CH2-CD1 4.23Å; W572-F630 AromaticContact CZ3-CD1 3.97Å; W572-F630 HydrophobicContact CZ3-CD1 3.97Å; W572-L633 HydrophobicContact CH2-CB 4.33Å; W572-L633 HydrophobicContact CZ3-CB 4.14Å; W572-A634 HydrophobicContact CZ2-CB 4.18Å
573	E	86.6	Confident	87.8	Confident	168 Å²	168	66.4 Å²	66.4	79%	0.785	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-12.3	178.7	-61.1	177.8	-173	0	0	112.8	M571	M571-E573 PolarHBondContact O-N 2.96Å; M571-E573 VanDerWaalsContact O-N 3.14Å
574	D	87.3	Confident	88.2	Confident	43 Å²	43	61.4 Å²	61.4	23%	0.23	32%	0.322	C	S	.	.	S	Bend	trans	-67.2	140.9	-179.6	-70.7	-22.9	0	0	0	110.8	I570 M571 W576 A577 I578	I570-D574 WeakPolarHBondContact CA-OD2 3.22Å; I570-D574 HydrophobicContact CG2-CB 4.31Å; M571-D574 PolarHBondContact N-OD2 2.9Å; M571-D574 WeakPolarHBondContact O-CB 3.44Å; M571-D574 PolarHBondContact O-N 3.26Å; D574-W576 PolarHBondContact O-N 3.28Å; D574-W576 VanDerWaalsContact O-N 3.07Å; D574-A577 PolarHBondContact O-N 3.08Å; D574-I578 WeakPolarHBondContact O-CG1 3.48Å; D574-I578 PolarHBondContact O-N 2.81Å; D574-I578 VanDerWaalsContact O-N 3.1Å
575	A	87.5	Confident	88.8	Confident	83 Å²	83	59.5 Å²	59.5	69%	0.686	32%	0.316	S	S	*	.	H	α-helix	trans	-54.2	-32.1	174.1	0	0	0	0	0	112.5	A577	A575-A577 VanDerWaalsContact C-N 3.31Å; A575-A577 PolarHBondContact O-N 3.47Å
576	W	89.2	Confident	89.4	Confident	115 Å²	115	62.6 Å²	62.6	44%	0.436	34%	0.335	S	S	.	.	H	α-helix	trans	-65.9	-28.2	175.9	-57.2	108.8	0	0	0	113.4	D574 P580 R799 V800 T803	D574-W576 PolarHBondContact O-N 3.28Å; D574-W576 VanDerWaalsContact O-N 3.07Å; W576-P580 VanDerWaalsContact O-CD 3.25Å; W576-P580 WeakPolarHBondContact O-CD 3.44Å; W576-R799 HydrophobicContact CG-CB 4.23Å; W576-V800 HydrophobicContact CH2-CG2 3.98Å; W576-V800 HydrophobicContact CZ3-CG2 3.99Å; W576-T803 WeakPolarHBondContact O-CG2 3.31Å; W576-T803 PolarHBondContact O-OG1 3.08Å
577	A	91.4	Very high	90.1	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-87.9	-39.3	176.5	0	0	0	0	0	112.6	I570 M571 D574 A575 G579 P580 I581 L633	I570-A577 HydrophobicContact CG2-CB 3.91Å; M571-A577 WeakPolarHBondContact O-CB 3.42Å; D574-A577 PolarHBondContact O-N 3.08Å; A575-A577 VanDerWaalsContact C-N 3.31Å; A575-A577 PolarHBondContact O-N 3.47Å; A577-G579 PolarHBondContact O-N 3.41Å; A577-P580 WeakPolarHBondContact O-CD 3.36Å; A577-I581 HydrophobicContact CB-CD1 4.1Å; A577-I581 WeakPolarHBondContact O-CB 3.34Å; A577-I581 VanDerWaalsContact O-CD1 3.28Å; A577-I581 WeakPolarHBondContact O-CD1 3.11Å; A577-I581 WeakPolarHBondContact O-CG1 3.4Å; A577-I581 PolarHBondContact O-N 2.82Å; A577-L633 HydrophobicContact CB-CD1 4.18Å; A577-L633 HydrophobicContact CB-CD2 4.12Å
578	I	91.8	Very high	90.7	Very high	87 Å²	87	57.3 Å²	57.3	45%	0.446	30%	0.302	S	S	.	.	H	α-helix	trans	-58.9	-43.9	-174.3	-66.4	168.2	0	0	0	111.9	D574 I581 T582	D574-I578 WeakPolarHBondContact O-CG1 3.48Å; D574-I578 PolarHBondContact O-N 2.81Å; D574-I578 VanDerWaalsContact O-N 3.1Å; I578-I581 PolarHBondContact O-N 3.46Å; I578-T582 HydrophobicContact CG2-CG2 4.32Å; I578-T582 WeakPolarHBondContact O-CG2 3.32Å; I578-T582 PolarHBondContact O-N 2.79Å; I578-T582 PolarHBondContact O-OG1 3.01Å
579	G	91.2	Very high	91.3	Very high	30 Å²	30	59.6 Å²	59.6	31%	0.309	32%	0.317	S	S	.	.	H	α-helix	trans	-57	-60.4	-179.5	0	0	0	0	0	113.3	A577 I581 T582 I583	A577-G579 PolarHBondContact O-N 3.41Å; G579-I581 VanDerWaalsContact C-N 3.33Å; G579-I581 PolarHBondContact O-N 2.61Å; G579-T582 PolarHBondContact O-N 3.49Å; G579-T582 PolarHBondContact O-OG1 3.14Å; G579-I583 PolarHBondContact O-N 2.04Å
580	P	93.6	Very high	91.7	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.006	32%	0.322	C	S	.	.	H	α-helix	trans	-59.6	-37.5	177.4	-23.6	31	0	0	0	114.4	W576 A577 I583 A584 T629 L633 T803 C806 I807	W576-P580 VanDerWaalsContact O-CD 3.25Å; W576-P580 WeakPolarHBondContact O-CD 3.44Å; A577-P580 WeakPolarHBondContact O-CD 3.36Å; P580-I583 PolarHBondContact O-N 3.16Å; P580-A584 WeakPolarHBondContact O-CB 3.43Å; P580-A584 PolarHBondContact O-N 2.93Å; P580-T629 HydrophobicContact CB-CG2 3.75Å; P580-L633 HydrophobicContact CB-CD1 4.36Å; P580-T803 HydrophobicContact CG-CG2 3.69Å; P580-C806 HydrophobicContact CB-CB 3.67Å; P580-C806 HydrophobicContact CG-CB 4.15Å; P580-I807 HydrophobicContact CB-CG1 4.48Å; P580-I807 HydrophobicContact CG-CD1 4.48Å; P580-I807 HydrophobicContact CG-CG1 4.11Å
581	I	94.4	Very high	92.1	Very high	30 Å²	30	58.6 Å²	58.6	15%	0.154	32%	0.319	C	S	.	.	H	α-helix	trans	-61.8	-47.6	179.3	-70	165.3	0	0	0	110.6	W572 A577 I578 G579 I583 A584 C585 F630 L633	W572-I581 HydrophobicContact CE3-CD1 3.57Å; W572-I581 HydrophobicContact CZ3-CD1 3.88Å; W572-I581 HydrophobicContact CZ3-CG1 4.46Å; A577-I581 HydrophobicContact CB-CD1 4.1Å; A577-I581 WeakPolarHBondContact O-CB 3.34Å; A577-I581 VanDerWaalsContact O-CD1 3.28Å; A577-I581 WeakPolarHBondContact O-CD1 3.11Å; A577-I581 WeakPolarHBondContact O-CG1 3.4Å; A577-I581 PolarHBondContact O-N 2.82Å; I578-I581 PolarHBondContact O-N 3.46Å; G579-I581 VanDerWaalsContact C-N 3.33Å; G579-I581 PolarHBondContact O-N 2.61Å; I581-I583 VanDerWaalsContact C-N 3.35Å; I581-I583 PolarHBondContact O-N 3.4Å; I581-A584 PolarHBondContact O-N 2.96Å; I581-C585 WeakPolarHBondContact O-CB 3.47Å; I581-C585 PolarHBondContact O-N 3.16Å; I581-C585 PolarHBondContact O-SG 2.81Å; I581-F630 HydrophobicContact CG1-CE1 4.49Å; I581-F630 HydrophobicContact CG2-CE1 4.12Å; I581-F630 HydrophobicContact CG2-CZ 4.21Å; I581-L633 HydrophobicContact CD1-CD1 3.9Å; I581-L633 HydrophobicContact CG1-CD1 3.54Å
582	T	94.1	Very high	92.5	Very high	75 Å²	75	56.8 Å²	56.8	46%	0.46	32%	0.321	S	S	.	.	H	α-helix	trans	-61.5	-43.6	-179.8	56.2	0	0	0	0	111.6	I578 G579 A584 C585 V586	I578-T582 HydrophobicContact CG2-CG2 4.32Å; I578-T582 WeakPolarHBondContact O-CG2 3.32Å; I578-T582 PolarHBondContact O-N 2.79Å; I578-T582 PolarHBondContact O-OG1 3.01Å; G579-T582 PolarHBondContact O-N 3.49Å; G579-T582 PolarHBondContact O-OG1 3.14Å; T582-A584 PolarHBondContact O-N 3.46Å; T582-C585 PolarHBondContact O-N 2.91Å; T582-V586 WeakPolarHBondContact O-CG2 3.34Å; T582-V586 PolarHBondContact O-N 2.96Å
583	I	94.6	Very high	92.7	Very high	62 Å²	62	55.8 Å²	55.8	32%	0.318	32%	0.324	S	S	.	.	H	α-helix	trans	-60.3	-45.6	175.8	-67.6	164.1	0	0	0	111.1	G579 P580 I581 V586 G587 I807 F814	G579-I583 PolarHBondContact O-N 2.04Å; P580-I583 PolarHBondContact O-N 3.16Å; I581-I583 VanDerWaalsContact C-N 3.35Å; I581-I583 PolarHBondContact O-N 3.4Å; I583-V586 PolarHBondContact O-N 2.88Å; I583-G587 PolarHBondContact O-N 3.34Å; I583-I807 HydrophobicContact CD1-CG1 4.32Å; I583-F814 HydrophobicContact CG2-CD2 4.37Å; I583-F814 HydrophobicContact CG2-CE2 3.67Å; I583-F814 WeakPolarHBondContact O-CE2 3.32Å; I583-F814 WeakPolarHBondContact O-CZ 3.36Å
584	A	95.7	Very high	93	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-66.3	-40.4	179.3	0	0	0	0	0	112.5	P580 I581 T582 G587 F588 T629 F630	P580-A584 WeakPolarHBondContact O-CB 3.43Å; P580-A584 PolarHBondContact O-N 2.93Å; I581-A584 PolarHBondContact O-N 2.96Å; T582-A584 PolarHBondContact O-N 3.46Å; A584-G587 WeakPolarHBondContact O-CA 3.27Å; A584-G587 PolarHBondContact O-N 3.3Å; A584-G587 VanDerWaalsContact O-N 3.14Å; A584-F588 WeakPolarHBondContact O-CD2 3.35Å; A584-F588 PolarHBondContact O-N 3.27Å; A584-T629 HydrophobicContact CB-CG2 3.97Å; A584-F630 HydrophobicContact CB-CE2 3.99Å
585	C	95.4	Very high	93.3	Very high	58 Å²	58	49 Å²	49	39%	0.392	30%	0.296	S	S	.	.	H	α-helix	trans	-60.4	-45.6	175.4	-74.7	0	0	0	0	112	I581 T582 G587 F588 V589	I581-C585 WeakPolarHBondContact O-CB 3.47Å; I581-C585 PolarHBondContact O-N 3.16Å; I581-C585 PolarHBondContact O-SG 2.81Å; T582-C585 PolarHBondContact O-N 2.91Å; C585-G587 VanDerWaalsContact C-N 3.26Å; C585-G587 PolarHBondContact O-N 3.24Å; C585-F588 PolarHBondContact O-N 3.27Å; C585-V589 WeakPolarHBondContact O-CG2 3.29Å; C585-V589 PolarHBondContact O-N 2.98Å; C585-V589 VanDerWaalsContact O-N 3.08Å
586	V	95.8	Very high	93.5	Very high	82 Å²	82	52.6 Å²	52.6	50%	0.497	29%	0.292	S	S	.	.	H	α-helix	trans	-59.7	-41.1	174	173.7	0	0	0	0	110.5	T582 I583 F588 V589 C590 F814	T582-V586 WeakPolarHBondContact O-CG2 3.34Å; T582-V586 PolarHBondContact O-N 2.96Å; I583-V586 PolarHBondContact O-N 2.88Å; V586-F588 PolarHBondContact O-N 3.25Å; V586-V589 PolarHBondContact O-N 3.46Å; V586-C590 WeakPolarHBondContact O-CB 3.46Å; V586-C590 PolarHBondContact O-N 2.94Å; V586-C590 PolarHBondContact O-SG 3.08Å; V586-C590 VanDerWaalsContact O-SG 3.33Å; V586-F814 HydrophobicContact CB-CZ 4.29Å; V586-F814 HydrophobicContact CG1-CE1 4.28Å; V586-F814 HydrophobicContact CG1-CZ 4.05Å
587	G	94.6	Very high	93.5	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60	-43.8	175.9	0	0	0	0	0	113.6	I583 A584 C585 C590 T591 Y626 F814	I583-G587 PolarHBondContact O-N 3.34Å; A584-G587 WeakPolarHBondContact O-CA 3.27Å; A584-G587 PolarHBondContact O-N 3.3Å; A584-G587 VanDerWaalsContact O-N 3.14Å; C585-G587 VanDerWaalsContact C-N 3.26Å; C585-G587 PolarHBondContact O-N 3.24Å; G587-C590 PolarHBondContact O-N 2.9Å; G587-T591 WeakPolarHBondContact O-CB 3.24Å; G587-T591 PolarHBondContact O-N 2.79Å; G587-T591 PolarHBondContact O-OG1 3.18Å; G587-Y626 VanDerWaalsContact C-CE2 3.48Å; G587-Y626 WeakPolarHBondContact O-CE2 3.32Å; G587-F814 VanDerWaalsContact CA-CZ 3.46Å
588	F	95.4	Very high	93.4	Very high	46 Å²	46	47.7 Å²	47.7	20%	0.202	27%	0.274	C	S	.	.	H	α-helix	trans	-61.8	-46.2	175.2	-83.3	-56.7	0	0	0	112.5	A584 C585 V586 T591 G592 F623 A627 F630	A584-F588 WeakPolarHBondContact O-CD2 3.35Å; A584-F588 PolarHBondContact O-N 3.27Å; C585-F588 PolarHBondContact O-N 3.27Å; V586-F588 PolarHBondContact O-N 3.25Å; F588-T591 PolarHBondContact O-N 3.14Å; F588-G592 PolarHBondContact O-N 3.2Å; F588-F623 AromaticContact CD1-CD2 3.49Å; F588-F623 HydrophobicContact CD1-CD2 3.49Å; F588-F623 VanDerWaalsContact CD1-CD2 3.49Å; F588-F623 AromaticContact CD1-CE2 3.35Å; F588-F623 HydrophobicContact CD1-CE2 3.35Å; F588-F623 HydrophobicContact CD1-CG 4.27Å; F588-F623 HydrophobicContact CD1-CZ 4.02Å; F588-F623 HydrophobicContact CE1-CD1 4.01Å; F588-F623 AromaticContact CE1-CD2 3.43Å; F588-F623 HydrophobicContact CE1-CD2 3.43Å; F588-F623 VanDerWaalsContact CE1-CD2 3.43Å; F588-F623 AromaticContact CE1-CE1 3.85Å; F588-F623 HydrophobicContact CE1-CE1 3.85Å; F588-F623 AromaticContact CE1-CE2 3.26Å; F588-F623 HydrophobicContact CE1-CE2 3.26Å; F588-F623 AromaticContact CE1-CG 3.8Å; F588-F623 HydrophobicContact CE1-CG 3.8Å; F588-F623 AromaticContact CE1-CZ 3.48Å; F588-F623 HydrophobicContact CE1-CZ 3.48Å; F588-F623 VanDerWaalsContact CE1-CZ 3.48Å; F588-F623 WeakPolarHBondContact CE1-O 3.47Å; F588-F623 HydrophobicContact CZ-CE2 4.45Å; F588-F623 HydrophobicContact CZ-CZ 4.34Å; F588-A627 HydrophobicContact CZ-CB 3.93Å; F588-A627 VanDerWaalsContact CZ-N 3.33Å; F588-F630 HydrophobicContact CD2-CE2 4.27Å; F588-F630 HydrophobicContact CE2-CD2 4.13Å; F588-F630 AromaticContact CE2-CE2 3.67Å; F588-F630 HydrophobicContact CE2-CE2 3.67Å
589	V	95.3	Very high	93.3	Very high	95 Å²	95	47.5 Å²	47.5	58%	0.576	28%	0.277	S	S	*	.	H	α-helix	trans	-60.4	-49.4	177.7	174.3	0	0	0	0	110.3	C585 V586 T591 G592 L593	C585-V589 WeakPolarHBondContact O-CG2 3.29Å; C585-V589 PolarHBondContact O-N 2.98Å; C585-V589 VanDerWaalsContact O-N 3.08Å; V586-V589 PolarHBondContact O-N 3.46Å; V589-T591 PolarHBondContact O-N 2.99Å; V589-G592 PolarHBondContact O-N 3.32Å; V589-L593 HydrophobicContact CG1-CD1 4.26Å; V589-L593 WeakPolarHBondContact O-CG 3.1Å; V589-L593 PolarHBondContact O-N 3.34Å
590	C	93.6	Very high	93.2	Very high	48 Å²	48	55.3 Å²	55.3	32%	0.324	30%	0.297	S	S	.	.	H	α-helix	trans	-59.1	-44.4	177.1	-72.6	0	0	0	0	112.3	V586 G587 L593 V594 L817	V586-C590 WeakPolarHBondContact O-CB 3.46Å; V586-C590 PolarHBondContact O-N 2.94Å; V586-C590 PolarHBondContact O-SG 3.08Å; V586-C590 VanDerWaalsContact O-SG 3.33Å; G587-C590 PolarHBondContact O-N 2.9Å; C590-L593 PolarHBondContact O-N 2.56Å; C590-V594 WeakPolarHBondContact O-CG2 3.11Å; C590-V594 PolarHBondContact O-N 3.17Å; C590-L817 HydrophobicContact CB-CD1 4.1Å
591	T	94.3	Very high	92.8	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.012	31%	0.311	C	S	.	.	H	α-helix	trans	-63.4	-44.2	178.1	-54.1	0	0	0	0	111.3	G587 F588 V589 L593 V594 V595 L619 V622 F623 Y626	G587-T591 WeakPolarHBondContact O-CB 3.24Å; G587-T591 PolarHBondContact O-N 2.79Å; G587-T591 PolarHBondContact O-OG1 3.18Å; F588-T591 PolarHBondContact O-N 3.14Å; V589-T591 PolarHBondContact O-N 2.99Å; T591-L593 VanDerWaalsContact C-N 3.34Å; T591-L593 PolarHBondContact O-N 3.47Å; T591-V594 PolarHBondContact O-N 3.31Å; T591-V595 HydrophobicContact CG2-CG2 4.41Å; T591-V595 WeakPolarHBondContact O-CG2 3.49Å; T591-V595 PolarHBondContact O-N 3.48Å; T591-L619 HydrophobicContact CG2-CD2 4.3Å; T591-V622 HydrophobicContact CG2-CG1 4.4Å; T591-F623 HydrophobicContact CG2-CB 4.45Å; T591-Y626 WeakPolarHBondContact OG1-CE2 3.41Å
592	G	93.6	Very high	92.4	Very high	42 Å²	42	59 Å²	59	43%	0.433	32%	0.315	S	S	.	.	H	α-helix	trans	-59.7	-42.7	176.8	0	0	0	0	0	112.5	F588 V589 V595 W596	F588-G592 PolarHBondContact O-N 3.2Å; V589-G592 PolarHBondContact O-N 3.32Å; G592-V595 PolarHBondContact O-N 2.94Å; G592-W596 WeakPolarHBondContact O-CB 3.5Å; G592-W596 PolarHBondContact O-N 3.09Å
593	L	92.4	Very high	91.7	Very high	104 Å²	104	61.2 Å²	61.2	55%	0.545	32%	0.324	S	S	.	.	H	α-helix	trans	-61.5	-45.3	174.7	-70.2	173	0	0	0	111.9	V589 C590 T591 W596 V597	V589-L593 HydrophobicContact CG1-CD1 4.26Å; V589-L593 WeakPolarHBondContact O-CG 3.1Å; V589-L593 PolarHBondContact O-N 3.34Å; C590-L593 PolarHBondContact O-N 2.56Å; T591-L593 VanDerWaalsContact C-N 3.34Å; T591-L593 PolarHBondContact O-N 3.47Å; L593-W596 PolarHBondContact O-N 3.26Å; L593-V597 WeakPolarHBondContact O-CG2 3.36Å; L593-V597 PolarHBondContact O-N 3.03Å
594	V	92.8	Very high	91.2	Very high	18 Å²	18	59.3 Å²	59.3	11%	0.109	32%	0.315	C	S	.	.	H	α-helix	trans	-62.8	-46	177.3	176.5	0	0	0	0	111.1	C590 T591 W596 V597 F598 L619 L817 F821 V825	C590-V594 WeakPolarHBondContact O-CG2 3.11Å; C590-V594 PolarHBondContact O-N 3.17Å; T591-V594 PolarHBondContact O-N 3.31Å; V594-W596 VanDerWaalsContact C-N 3.35Å; V594-W596 PolarHBondContact O-N 3.06Å; V594-V597 PolarHBondContact O-N 3.43Å; V594-F598 HydrophobicContact CG1-CD2 3.92Å; V594-F598 HydrophobicContact CG1-CE2 3.97Å; V594-F598 WeakPolarHBondContact O-CB 3.25Å; V594-F598 VanDerWaalsContact O-CD2 3.26Å; V594-F598 WeakPolarHBondContact O-CD2 3.39Å; V594-F598 PolarHBondContact O-N 3.04Å; V594-L619 HydrophobicContact CB-CD2 4.39Å; V594-L619 HydrophobicContact CG1-CD1 4.22Å; V594-L619 HydrophobicContact CG1-CD2 3.88Å; V594-L817 HydrophobicContact CG2-CD2 4.31Å; V594-F821 HydrophobicContact CG1-CB 3.93Å; V594-F821 HydrophobicContact CG1-CD1 3.85Å; V594-F821 HydrophobicContact CG1-CG 4.01Å; V594-V825 HydrophobicContact CG1-CG2 4.16Å; V594-V825 HydrophobicContact CG2-CG2 4.19Å
595	V	92.3	Very high	90.3	Very high	50 Å²	50	61.1 Å²	61.1	30%	0.303	33%	0.327	S	S	.	.	H	α-helix	trans	-59.3	-46.4	176.9	171	0	0	0	0	110.5	T591 G592 V597 F598 V599 L619	T591-V595 HydrophobicContact CG2-CG2 4.41Å; T591-V595 WeakPolarHBondContact O-CG2 3.49Å; T591-V595 PolarHBondContact O-N 3.48Å; G592-V595 PolarHBondContact O-N 2.94Å; V595-V597 PolarHBondContact O-N 3.23Å; V595-F598 PolarHBondContact O-N 2.97Å; V595-V599 HydrophobicContact CG1-CG2 4.14Å; V595-V599 WeakPolarHBondContact O-CB 3.41Å; V595-V599 VanDerWaalsContact O-CG2 3.3Å; V595-V599 WeakPolarHBondContact O-CG2 3.28Å; V595-V599 PolarHBondContact O-N 3.25Å; V595-L619 HydrophobicContact CG2-CB 4.14Å; V595-L619 HydrophobicContact CG2-CD1 3.91Å; V595-L619 HydrophobicContact CG2-CG 4.41Å
596	W	91.8	Very high	89.6	Confident	160 Å²	160	60.3 Å²	60.3	61%	0.606	32%	0.318	S	S	*	.	H	α-helix	trans	-58.7	-47	178.5	177.7	84.5	0	0	0	112.2	G592 L593 V594 F598 V599 R600	G592-W596 WeakPolarHBondContact O-CB 3.5Å; G592-W596 PolarHBondContact O-N 3.09Å; L593-W596 PolarHBondContact O-N 3.26Å; V594-W596 VanDerWaalsContact C-N 3.35Å; V594-W596 PolarHBondContact O-N 3.06Å; W596-F598 PolarHBondContact O-N 3.33Å; W596-V599 PolarHBondContact O-N 3.11Å; W596-R600 WeakPolarHBondContact O-CB 3.26Å; W596-R600 PolarHBondContact O-N 3.26Å
597	V	90.4	Very high	89	Confident	10 Å²	10	56.5 Å²	56.5	6%	0.061	30%	0.296	C	S	.	.	H	α-helix	trans	-60.6	-45.1	176.6	173.3	0	0	0	0	111.1	L593 V594 V595 R600 H601 V825 I828 M829	L593-V597 WeakPolarHBondContact O-CG2 3.36Å; L593-V597 PolarHBondContact O-N 3.03Å; V594-V597 PolarHBondContact O-N 3.43Å; V595-V597 PolarHBondContact O-N 3.23Å; V597-R600 PolarHBondContact O-N 3.39Å; V597-H601 WeakPolarHBondContact O-CB 3.41Å; V597-H601 PolarHBondContact O-N 3.46Å; V597-H601 PolarHBondContact O-ND1 2.66Å; V597-V825 HydrophobicContact CG1-CG1 4.45Å; V597-V825 HydrophobicContact CG2-CG1 4.45Å; V597-I828 HydrophobicContact CG1-CB 4.47Å; V597-I828 HydrophobicContact CG1-CG2 3.92Å; V597-M829 HydrophobicContact CG1-CG 4.49Å; V597-M829 HydrophobicContact CG1-SD 4.39Å; V597-M829 HydrophobicContact CG2-SD 4.36Å
598	F	88.7	Confident	88.3	Confident	1 Å²	1	61.4 Å²	61.4	0%	0.004	32%	0.317	C	S	.	.	H	α-helix	trans	-67.3	-39.4	-178.1	-89.9	-118.8	0	0	0	112.7	V594 V595 W596 H601 N602 V607 C615 Y616 F821 K824 V825 I828	V594-F598 HydrophobicContact CG1-CD2 3.92Å; V594-F598 HydrophobicContact CG1-CE2 3.97Å; V594-F598 WeakPolarHBondContact O-CB 3.25Å; V594-F598 VanDerWaalsContact O-CD2 3.26Å; V594-F598 WeakPolarHBondContact O-CD2 3.39Å; V594-F598 PolarHBondContact O-N 3.04Å; V595-F598 PolarHBondContact O-N 2.97Å; W596-F598 PolarHBondContact O-N 3.33Å; F598-H601 CarbonylContact O-C 3.5Å; F598-N602 VanDerWaalsContact O-CA 3.22Å; F598-N602 WeakPolarHBondContact O-CA 3.32Å; F598-N602 WeakPolarHBondContact O-CB 3.22Å; F598-N602 PolarHBondContact O-N 2.76Å; F598-V607 HydrophobicContact CD1-CG1 4.11Å; F598-V607 HydrophobicContact CD1-CG2 4.25Å; F598-V607 HydrophobicContact CE1-CG2 4.3Å; F598-C615 HydrophobicContact CE1-CB 4.35Å; F598-Y616 HydrophobicContact CB-CE1 4.33Å; F598-Y616 PolarHBondContact O-OH 3.49Å; F598-F821 HydrophobicContact CE1-CD1 4.08Å; F598-F821 AromaticContact CE1-CE1 3.93Å; F598-F821 HydrophobicContact CE1-CE1 3.93Å; F598-F821 HydrophobicContact CE2-CD1 4Å; F598-F821 AromaticContact CZ-CD1 3.57Å; F598-F821 HydrophobicContact CZ-CD1 3.57Å; F598-F821 AromaticContact CZ-CE1 3.92Å; F598-F821 HydrophobicContact CZ-CE1 3.92Å; F598-K824 HydrophobicContact CZ-CB 4.11Å; F598-K824 HydrophobicContact CZ-CD 4.24Å; F598-V825 HydrophobicContact CD2-CG2 4.41Å; F598-V825 HydrophobicContact CE2-CG2 3.85Å; F598-I828 HydrophobicContact CE2-CD1 4.32Å
599	V	89.1	Confident	87.4	Confident	83 Å²	83	62 Å²	62	50%	0.503	33%	0.33	S	S	.	.	H	α-helix	trans	-68.4	-43.6	176.1	172	0	0	0	0	110.7	V595 W596 H601 N602 Y616	V595-V599 HydrophobicContact CG1-CG2 4.14Å; V595-V599 WeakPolarHBondContact O-CB 3.41Å; V595-V599 VanDerWaalsContact O-CG2 3.3Å; V595-V599 WeakPolarHBondContact O-CG2 3.28Å; V595-V599 PolarHBondContact O-N 3.25Å; W596-V599 PolarHBondContact O-N 3.11Å; V599-H601 VanDerWaalsContact C-N 3.33Å; V599-H601 PolarHBondContact O-N 3.31Å; V599-N602 VanDerWaalsContact O-CB 3.31Å; V599-N602 WeakPolarHBondContact O-CB 3.33Å; V599-N602 PolarHBondContact O-N 3.33Å; V599-Y616 HydrophobicContact CG2-CE1 3.91Å
600	R	89.3	Confident	86.6	Confident	195 Å²	195	57.7 Å²	57.7	74%	0.736	30%	0.304	S	S	*	.	H	α-helix	trans	-63.3	-39.9	178.3	-174.4	63.1	175.5	163.3	0.4	112.1	W596 V597	W596-R600 WeakPolarHBondContact O-CB 3.26Å; W596-R600 PolarHBondContact O-N 3.26Å; V597-R600 PolarHBondContact O-N 3.39Å
601	H	86.3	Confident	86.1	Confident	65 Å²	65	56 Å²	56	30%	0.301	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	26.9	-177.6	-63.5	90.4	0	0	0	113.3	V597 F598 V599 N603 T604 I828	V597-H601 WeakPolarHBondContact O-CB 3.41Å; V597-H601 PolarHBondContact O-N 3.46Å; V597-H601 PolarHBondContact O-ND1 2.66Å; F598-H601 CarbonylContact O-C 3.5Å; V599-H601 VanDerWaalsContact C-N 3.33Å; V599-H601 PolarHBondContact O-N 3.31Å; H601-N603 PolarHBondContact O-N 3.04Å; H601-T604 HydrophobicContact CB-CG2 3.81Å; H601-T604 WeakPolarHBondContact O-CB 3.41Å; H601-T604 WeakPolarHBondContact O-CG2 3.14Å; H601-T604 PolarHBondContact O-N 2.99Å; H601-T604 PolarHBondContact O-OG1 3.47Å; H601-I828 HydrophobicContact CB-CG2 4.03Å
602	N	84.4	Confident	85.7	Confident	44 Å²	44	59.3 Å²	59.3	24%	0.235	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-16.2	-171.7	-164.2	32.6	0	0	0	114.8	F598 V599 R612 Y616	F598-N602 VanDerWaalsContact O-CA 3.22Å; F598-N602 WeakPolarHBondContact O-CA 3.32Å; F598-N602 WeakPolarHBondContact O-CB 3.22Å; F598-N602 PolarHBondContact O-N 2.76Å; V599-N602 VanDerWaalsContact O-CB 3.31Å; V599-N602 WeakPolarHBondContact O-CB 3.33Å; V599-N602 PolarHBondContact O-N 3.33Å; N602-R612 WeakPolarHBondContact O-CD 3.39Å; N602-R612 PolarHBondContact O-NH1 2.9Å; N602-R612 VanDerWaalsContact OD1-CD 3.31Å; N602-R612 WeakPolarHBondContact OD1-CD 3.44Å; N602-Y616 PolarHBondContact OD1-OH 2.89Å; N602-Y616 VanDerWaalsContact OD1-OH 3.07Å
603	N	80.8	Confident	85.5	Confident	120 Å²	120	61.6 Å²	61.6	64%	0.642	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-6.9	178.5	-77.3	-33.8	0	0	0	114.6	H601 K608	H601-N603 PolarHBondContact O-N 3.04Å; N603-K608 WeakPolarHBondContact O-CE 3.18Å; N603-K608 PolarHBondContact O-NZ 2.89Å; N603-K608 VanDerWaalsContact O-NZ 3.12Å
604	T	82.6	Confident	85.3	Confident	22 Å²	22	56.8 Å²	56.8	14%	0.135	28%	0.281	C	S	.	.	S	Bend	trans	-64.6	145.4	179.3	57.3	0	0	0	0	112	H601 L606 V607 K608 N835	H601-T604 HydrophobicContact CB-CG2 3.81Å; H601-T604 WeakPolarHBondContact O-CB 3.41Å; H601-T604 WeakPolarHBondContact O-CG2 3.14Å; H601-T604 PolarHBondContact O-N 2.99Å; H601-T604 PolarHBondContact O-OG1 3.47Å; T604-L606 VanDerWaalsContact C-N 3.26Å; T604-L606 PolarHBondContact O-N 3.19Å; T604-V607 PolarHBondContact O-N 3.22Å; T604-V607 WeakPolarHBondContact OG1-CG2 3.42Å; T604-K608 PolarHBondContact O-N 2.81Å; T604-K608 VanDerWaalsContact O-N 3.14Å; T604-N835 WeakPolarHBondContact CB-ND2 3.41Å; T604-N835 VanDerWaalsContact CG2-ND2 3.33Å; T604-N835 WeakPolarHBondContact CG2-ND2 3.26Å
605	P	76.7	Confident	85.3	Confident	38 Å²	38	56 Å²	56	25%	0.247	28%	0.276	C	S	.	.	H	α-helix	trans	-62.7	-32.5	-177	23.6	-32.4	0	0	0	112.7	K608 A609 N835 T837	P605-K608 PolarHBondContact O-N 3.42Å; P605-A609 VanDerWaalsContact O-CB 3.27Å; P605-A609 WeakPolarHBondContact O-CB 3.3Å; P605-A609 PolarHBondContact O-N 2.94Å; P605-N835 WeakPolarHBondContact CD-OD1 3.4Å; P605-N835 WeakPolarHBondContact CG-O 3.43Å; P605-N835 WeakPolarHBondContact CG-OD1 3.3Å; P605-T837 HydrophobicContact CB-CG2 3.69Å
606	L	81.7	Confident	85.3	Confident	41 Å²	41	56.2 Å²	56.2	22%	0.215	27%	0.272	C	S	.	.	H	α-helix	trans	-60.8	-49.2	175.3	-174.1	70.4	0	0	0	112.5	T604 A609 S610 I827 I828 N835	T604-L606 VanDerWaalsContact C-N 3.26Å; T604-L606 PolarHBondContact O-N 3.19Å; L606-A609 PolarHBondContact O-N 2.93Å; L606-S610 PolarHBondContact O-N 3.36Å; L606-I827 HydrophobicContact CD2-CB 4.15Å; L606-I827 HydrophobicContact CD2-CG2 3.91Å; L606-I828 HydrophobicContact CD2-CD1 4.23Å; L606-I828 HydrophobicContact CD2-CG1 3.82Å; L606-N835 WeakPolarHBondContact CB-OD1 3.47Å; L606-N835 PolarHBondContact N-OD1 3.45Å
607	V	83.3	Confident	85.4	Confident	3 Å²	3	50 Å²	50	2%	0.018	25%	0.25	C	S	.	.	H	α-helix	trans	-68.1	-38	-178.2	175.6	0	0	0	0	111	F598 T604 R612 I828	F598-V607 HydrophobicContact CD1-CG1 4.11Å; F598-V607 HydrophobicContact CD1-CG2 4.25Å; F598-V607 HydrophobicContact CE1-CG2 4.3Å; T604-V607 PolarHBondContact O-N 3.22Å; T604-V607 WeakPolarHBondContact OG1-CG2 3.42Å; V607-R612 HydrophobicContact CG1-CG 3.97Å; V607-R612 WeakPolarHBondContact O-CG 3.34Å; V607-I828 HydrophobicContact CG2-CD1 3.78Å
608	K	80.3	Confident	85.5	Confident	103 Å²	103	49.5 Å²	49.5	45%	0.448	25%	0.247	S	C	.	.	H	α-helix	trans	-64.7	-42.9	173.9	-76	175.1	174	160.8	0	112.5	N603 T604 P605 G611 R612	N603-K608 WeakPolarHBondContact O-CE 3.18Å; N603-K608 PolarHBondContact O-NZ 2.89Å; N603-K608 VanDerWaalsContact O-NZ 3.12Å; T604-K608 PolarHBondContact O-N 2.81Å; T604-K608 VanDerWaalsContact O-N 3.14Å; P605-K608 PolarHBondContact O-N 3.42Å; K608-G611 PolarHBondContact O-N 2.88Å; K608-R612 HydrophobicContact CG-CG 4.48Å
609	A	75	Confident	85.8	Confident	59 Å²	59	49.6 Å²	49.6	49%	0.488	25%	0.248	S	C	.	.	H	α-helix	trans	-63.5	-43.5	-178.6	0	0	0	0	0	112.6	P605 L606 G611 R665	P605-A609 VanDerWaalsContact O-CB 3.27Å; P605-A609 WeakPolarHBondContact O-CB 3.3Å; P605-A609 PolarHBondContact O-N 2.94Å; L606-A609 PolarHBondContact O-N 2.93Å; A609-G611 PolarHBondContact O-N 2.82Å; A609-R665 PolarHBondContact O-NH1 2.8Å; A609-R665 PolarHBondContact O-NH2 3.49Å
610	S	79.3	Confident	86	Confident	4 Å²	4	48.4 Å²	48.4	3%	0.028	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-8	179	-71	0	0	0	0	115.2	L606 E769 K824	L606-S610 PolarHBondContact O-N 3.36Å; S610-E769 WeakPolarHBondContact CB-OE1 3.24Å; S610-E769 VanDerWaalsContact OG-CD 3.27Å; S610-E769 PolarHBondContact OG-OE1 3.09Å; S610-E769 PolarHBondContact OG-OE2 3.11Å; S610-K824 VanDerWaalsContact CB-NZ 3.28Å; S610-K824 PolarHBondContact OG-NZ 2.75Å
611	G	83.3	Confident	86.2	Confident	12 Å²	12	39.1 Å²	39.1	12%	0.124	21%	0.208	C	C	.	.			trans	82.9	91.7	-179.8	0	0	0	0	0	112.6	K608 A609 E613 L614 C615	K608-G611 PolarHBondContact O-N 2.88Å; A609-G611 PolarHBondContact O-N 2.82Å; G611-E613 PolarHBondContact O-N 2.91Å; G611-L614 PolarHBondContact O-N 3.17Å; G611-C615 PolarHBondContact O-N 2.94Å; G611-C615 VanDerWaalsContact O-N 3.13Å; G611-C615 PolarHBondContact O-SG 3.16Å
612	R	85.3	Confident	86.7	Confident	72 Å²	72	36 Å²	36	27%	0.272	19%	0.194	S	C	.	.	H	α-helix	trans	-53.7	-51.7	-173	-51.9	-168.8	-63.2	179.6	1	113.2	N602 V607 K608 L614 C615 Y616	N602-R612 WeakPolarHBondContact O-CD 3.39Å; N602-R612 PolarHBondContact O-NH1 2.9Å; N602-R612 VanDerWaalsContact OD1-CD 3.31Å; N602-R612 WeakPolarHBondContact OD1-CD 3.44Å; V607-R612 HydrophobicContact CG1-CG 3.97Å; V607-R612 WeakPolarHBondContact O-CG 3.34Å; K608-R612 HydrophobicContact CG-CG 4.48Å; R612-L614 PolarHBondContact O-N 3.37Å; R612-C615 WeakPolarHBondContact O-CB 3.42Å; R612-C615 PolarHBondContact O-N 2.9Å; R612-C615 VanDerWaalsContact O-N 3.11Å; R612-Y616 HydrophobicContact CB-CE2 4.34Å; R612-Y616 VanDerWaalsContact O-CD2 3.22Å; R612-Y616 WeakPolarHBondContact O-CD2 3.44Å; R612-Y616 PolarHBondContact O-N 2.91Å; R612-Y616 VanDerWaalsContact O-N 3.08Å
613	E	90	Very high	87.2	Confident	90 Å²	90	39 Å²	39	42%	0.421	21%	0.205	S	C	.	.	H	α-helix	trans	-59.4	-45.1	-177.2	-49.2	-48.3	138.6	0	0	112.3	G611 C615 Y616 I617 V691	G611-E613 PolarHBondContact O-N 2.91Å; E613-C615 VanDerWaalsContact C-N 3.31Å; E613-C615 PolarHBondContact O-N 2.8Å; E613-Y616 PolarHBondContact O-N 2.84Å; E613-I617 WeakPolarHBondContact O-CG1 3.46Å; E613-I617 PolarHBondContact O-N 3.16Å; E613-V691 HydrophobicContact CB-CG2 3.5Å; E613-V691 VanDerWaalsContact CB-CG2 3.5Å; E613-V691 HydrophobicContact CG-CG2 4.08Å
614	L	89.1	Confident	87.8	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-70.7	-25.9	179	-61.4	177.7	0	0	0	112.8	G611 R612 I617 L618 T661 K662 Q690 C694	G611-L614 PolarHBondContact O-N 3.17Å; R612-L614 PolarHBondContact O-N 3.37Å; L614-I617 HydrophobicContact CD2-CD1 4.46Å; L614-L618 VanDerWaalsContact O-CB 3.26Å; L614-L618 WeakPolarHBondContact O-CB 3.41Å; L614-L618 PolarHBondContact O-N 3.45Å; L614-L618 VanDerWaalsContact O-N 3.1Å; L614-T661 HydrophobicContact CD1-CG2 3.82Å; L614-T661 HydrophobicContact CD2-CG2 3.99Å; L614-K662 HydrophobicContact CB-CD 4.36Å; L614-K662 VanDerWaalsContact CB-CE 3.49Å; L614-K662 HydrophobicContact CB-CG 4.1Å; L614-K662 HydrophobicContact CD1-CG 3.71Å; L614-Q690 HydrophobicContact CD1-CB 4.14Å; L614-Q690 HydrophobicContact CD2-CB 4.46Å; L614-C694 HydrophobicContact CD2-CB 3.94Å
615	C	90.9	Very high	88.4	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.007	19%	0.185	C	C	.	.	H	α-helix	trans	-69.2	-42.3	170.9	-70.7	0	0	0	0	111.5	F598 G611 R612 E613 L618 L619 K662 F821	F598-C615 HydrophobicContact CE1-CB 4.35Å; G611-C615 PolarHBondContact O-N 2.94Å; G611-C615 VanDerWaalsContact O-N 3.13Å; G611-C615 PolarHBondContact O-SG 3.16Å; R612-C615 WeakPolarHBondContact O-CB 3.42Å; R612-C615 PolarHBondContact O-N 2.9Å; R612-C615 VanDerWaalsContact O-N 3.11Å; E613-C615 VanDerWaalsContact C-N 3.31Å; E613-C615 PolarHBondContact O-N 2.8Å; C615-L618 PolarHBondContact O-N 3.31Å; C615-L619 WeakPolarHBondContact O-CB 3.44Å; C615-L619 WeakPolarHBondContact O-CG 3.29Å; C615-L619 PolarHBondContact O-N 3.23Å; C615-K662 PolarHBondContact SG-NZ 2.91Å; C615-F821 HydrophobicContact CB-CE1 4.19Å; C615-F821 HydrophobicContact CB-CZ 4.41Å
616	Y	92.3	Very high	89.3	Confident	56 Å²	56	34 Å²	34	22%	0.22	17%	0.174	C	C	.	.	H	α-helix	trans	-67.8	-41.1	176.8	-67.2	-55.9	0	0	0	112.2	F598 V599 N602 R612 E613 L618 L619 S620	F598-Y616 HydrophobicContact CB-CE1 4.33Å; F598-Y616 PolarHBondContact O-OH 3.49Å; V599-Y616 HydrophobicContact CG2-CE1 3.91Å; N602-Y616 PolarHBondContact OD1-OH 2.89Å; N602-Y616 VanDerWaalsContact OD1-OH 3.07Å; R612-Y616 HydrophobicContact CB-CE2 4.34Å; R612-Y616 VanDerWaalsContact O-CD2 3.22Å; R612-Y616 WeakPolarHBondContact O-CD2 3.44Å; R612-Y616 PolarHBondContact O-N 2.91Å; R612-Y616 VanDerWaalsContact O-N 3.08Å; E613-Y616 PolarHBondContact O-N 2.84Å; Y616-L618 VanDerWaalsContact C-N 3.33Å; Y616-L618 PolarHBondContact O-N 3.21Å; Y616-L619 PolarHBondContact O-N 3.31Å; Y616-S620 WeakPolarHBondContact O-CB 3.32Å; Y616-S620 PolarHBondContact O-N 3.3Å
617	I	94.1	Very high	89.9	Confident	28 Å²	28	33.5 Å²	33.5	14%	0.144	18%	0.176	C	C	.	.	H	α-helix	trans	-59.7	-45.7	173.5	-65.1	167.2	0	0	0	110.2	E613 L614 L619 S620 G621 V654 A658 V691 I698	E613-I617 WeakPolarHBondContact O-CG1 3.46Å; E613-I617 PolarHBondContact O-N 3.16Å; L614-I617 HydrophobicContact CD2-CD1 4.46Å; I617-L619 PolarHBondContact O-N 3.04Å; I617-S620 PolarHBondContact O-N 2.96Å; I617-S620 PolarHBondContact O-OG 3.02Å; I617-G621 PolarHBondContact O-N 3.19Å; I617-V654 HydrophobicContact CG2-CG1 3.9Å; I617-V654 VanDerWaalsContact O-CG1 3.31Å; I617-V654 WeakPolarHBondContact O-CG1 3.31Å; I617-A658 HydrophobicContact CG2-CB 4.19Å; I617-V691 HydrophobicContact CD1-CG1 4.27Å; I617-V691 HydrophobicContact CD1-CG2 4.4Å; I617-I698 HydrophobicContact CG2-CD1 4.15Å
618	L	93.4	Very high	90.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.8	-44	176.8	-178.5	58.5	0	0	0	112.8	L614 C615 Y616 S620 G621 V622 C655 A658 L659 V816 M820 F821	L614-L618 VanDerWaalsContact O-CB 3.26Å; L614-L618 WeakPolarHBondContact O-CB 3.41Å; L614-L618 PolarHBondContact O-N 3.45Å; L614-L618 VanDerWaalsContact O-N 3.1Å; C615-L618 PolarHBondContact O-N 3.31Å; Y616-L618 VanDerWaalsContact C-N 3.33Å; Y616-L618 PolarHBondContact O-N 3.21Å; L618-S620 VanDerWaalsContact C-N 3.29Å; L618-S620 PolarHBondContact O-N 3.2Å; L618-G621 PolarHBondContact O-N 2.89Å; L618-V622 WeakPolarHBondContact O-CG2 3.28Å; L618-V622 PolarHBondContact O-N 3.46Å; L618-C655 HydrophobicContact CD1-CB 4.02Å; L618-C655 WeakPolarHBondContact CD1-O 3.47Å; L618-A658 HydrophobicContact CB-CB 3.93Å; L618-A658 HydrophobicContact CD1-CB 4.37Å; L618-L659 HydrophobicContact CD1-CD1 4.38Å; L618-L659 HydrophobicContact CD1-CG 4.04Å; L618-L659 HydrophobicContact CD2-CD2 3.9Å; L618-L659 HydrophobicContact CD2-CG 4.19Å; L618-V816 HydrophobicContact CD1-CG1 3.94Å; L618-V816 HydrophobicContact CD2-CG1 3.92Å; L618-V816 HydrophobicContact CG-CG1 3.91Å; L618-M820 HydrophobicContact CD2-CE 4.03Å; L618-M820 HydrophobicContact CD2-SD 3.26Å; L618-M820 WeakPolarHBondContact CD2-SD 3.39Å; L618-F821 HydrophobicContact CB-CZ 4.48Å; L618-F821 HydrophobicContact CD2-CE2 3.73Å; L618-F821 HydrophobicContact CD2-CZ 3.94Å; L618-F821 HydrophobicContact CG-CE2 4.02Å; L618-F821 HydrophobicContact CG-CZ 4.28Å
619	L	93.9	Very high	90.9	Very high	4 Å²	4	28.7 Å²	28.7	2%	0.021	16%	0.155	C	C	.	.	H	α-helix	trans	-64.6	-33.6	176.4	-73.7	165.3	0	0	0	112	T591 V594 V595 C615 Y616 I617 V622 F623 L817 F821	T591-L619 HydrophobicContact CG2-CD2 4.3Å; V594-L619 HydrophobicContact CB-CD2 4.39Å; V594-L619 HydrophobicContact CG1-CD1 4.22Å; V594-L619 HydrophobicContact CG1-CD2 3.88Å; V595-L619 HydrophobicContact CG2-CB 4.14Å; V595-L619 HydrophobicContact CG2-CD1 3.91Å; V595-L619 HydrophobicContact CG2-CG 4.41Å; C615-L619 WeakPolarHBondContact O-CB 3.44Å; C615-L619 WeakPolarHBondContact O-CG 3.29Å; C615-L619 PolarHBondContact O-N 3.23Å; Y616-L619 PolarHBondContact O-N 3.31Å; I617-L619 PolarHBondContact O-N 3.04Å; L619-V622 PolarHBondContact O-N 3.44Å; L619-F623 WeakPolarHBondContact O-CB 3.26Å; L619-F623 PolarHBondContact O-N 2.89Å; L619-L817 HydrophobicContact CD2-CD2 4.04Å; L619-F821 HydrophobicContact CD1-CE1 3.97Å; L619-F821 HydrophobicContact CD1-CZ 4.1Å; L619-F821 HydrophobicContact CD2-CD1 4.42Å; L619-F821 HydrophobicContact CD2-CD2 4.09Å; L619-F821 HydrophobicContact CD2-CE1 4.18Å; L619-F821 HydrophobicContact CD2-CE2 3.82Å; L619-F821 HydrophobicContact CD2-CG 4.37Å; L619-F821 HydrophobicContact CD2-CZ 3.87Å; L619-F821 HydrophobicContact CG-CE1 4Å; L619-F821 HydrophobicContact CG-CE2 4.04Å; L619-F821 HydrophobicContact CG-CZ 3.63Å
620	S	94.5	Very high	91.8	Very high	57 Å²	57	29 Å²	29	40%	0.399	15%	0.145	S	C	.	.	H	α-helix	trans	-66.2	-38.5	173.4	75.7	0	0	0	0	112.3	Y616 I617 L618 F623 M624	Y616-S620 WeakPolarHBondContact O-CB 3.32Å; Y616-S620 PolarHBondContact O-N 3.3Å; I617-S620 PolarHBondContact O-N 2.96Å; I617-S620 PolarHBondContact O-OG 3.02Å; L618-S620 VanDerWaalsContact C-N 3.29Å; L618-S620 PolarHBondContact O-N 3.2Å; S620-F623 WeakPolarHBondContact O-CB 3.49Å; S620-F623 PolarHBondContact O-N 2.99Å; S620-M624 WeakPolarHBondContact O-CG 3.39Å; S620-M624 PolarHBondContact O-N 3.12Å
621	G	94.1	Very high	92.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.6	-43.5	172.7	0	0	0	0	0	112.4	I617 L618 F623 M624 C625	I617-G621 PolarHBondContact O-N 3.19Å; L618-G621 PolarHBondContact O-N 2.89Å; G621-F623 VanDerWaalsContact C-N 3.34Å; G621-F623 PolarHBondContact O-N 3.25Å; G621-M624 WeakPolarHBondContact O-CB 3.1Å; G621-M624 PolarHBondContact O-N 2.91Å; G621-M624 VanDerWaalsContact O-N 3.16Å; G621-C625 PolarHBondContact O-N 3.35Å; G621-C625 PolarHBondContact O-SG 2.9Å; G621-C625 VanDerWaalsContact O-SG 3.33Å
622	V	95.1	Very high	92.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61.4	-42.5	175.6	171.4	0	0	0	0	111.3	T591 L618 L619 M624 C625 Y626 V816 L817	T591-V622 HydrophobicContact CG2-CG1 4.4Å; L618-V622 WeakPolarHBondContact O-CG2 3.28Å; L618-V622 PolarHBondContact O-N 3.46Å; L619-V622 PolarHBondContact O-N 3.44Å; V622-M624 VanDerWaalsContact C-N 3.34Å; V622-M624 PolarHBondContact O-N 3.33Å; V622-C625 WeakPolarHBondContact O-CB 3.43Å; V622-C625 PolarHBondContact O-N 3.34Å; V622-Y626 HydrophobicContact CG1-CD2 4.16Å; V622-Y626 HydrophobicContact CG1-CE2 3.53Å; V622-Y626 VanDerWaalsContact O-CD2 3.22Å; V622-Y626 WeakPolarHBondContact O-CD2 3.36Å; V622-Y626 PolarHBondContact O-N 2.93Å; V622-V816 HydrophobicContact CG2-CB 3.87Å; V622-V816 HydrophobicContact CG2-CG1 3.7Å; V622-V816 HydrophobicContact CG2-CG2 4.47Å; V622-L817 HydrophobicContact CG1-CD1 4.12Å; V622-L817 HydrophobicContact CG1-CD2 4.1Å; V622-L817 HydrophobicContact CG1-CG 3.92Å
623	F	95.2	Very high	93	Very high	108 Å²	108	27.6 Å²	27.6	47%	0.474	14%	0.139	S	C	.	.	H	α-helix	trans	-60	-43.9	173.6	-177.2	-85.4	0	0	0	111.7	F588 T591 L619 S620 G621 C625 Y626 A627	F588-F623 AromaticContact CD1-CD2 3.49Å; F588-F623 HydrophobicContact CD1-CD2 3.49Å; F588-F623 VanDerWaalsContact CD1-CD2 3.49Å; F588-F623 AromaticContact CD1-CE2 3.35Å; F588-F623 HydrophobicContact CD1-CE2 3.35Å; F588-F623 HydrophobicContact CD1-CG 4.27Å; F588-F623 HydrophobicContact CD1-CZ 4.02Å; F588-F623 HydrophobicContact CE1-CD1 4.01Å; F588-F623 AromaticContact CE1-CD2 3.43Å; F588-F623 HydrophobicContact CE1-CD2 3.43Å; F588-F623 VanDerWaalsContact CE1-CD2 3.43Å; F588-F623 AromaticContact CE1-CE1 3.85Å; F588-F623 HydrophobicContact CE1-CE1 3.85Å; F588-F623 AromaticContact CE1-CE2 3.26Å; F588-F623 HydrophobicContact CE1-CE2 3.26Å; F588-F623 AromaticContact CE1-CG 3.8Å; F588-F623 HydrophobicContact CE1-CG 3.8Å; F588-F623 AromaticContact CE1-CZ 3.48Å; F588-F623 HydrophobicContact CE1-CZ 3.48Å; F588-F623 VanDerWaalsContact CE1-CZ 3.48Å; F588-F623 WeakPolarHBondContact CE1-O 3.47Å; F588-F623 HydrophobicContact CZ-CE2 4.45Å; F588-F623 HydrophobicContact CZ-CZ 4.34Å; T591-F623 HydrophobicContact CG2-CB 4.45Å; L619-F623 WeakPolarHBondContact O-CB 3.26Å; L619-F623 PolarHBondContact O-N 2.89Å; S620-F623 WeakPolarHBondContact O-CB 3.49Å; S620-F623 PolarHBondContact O-N 2.99Å; G621-F623 VanDerWaalsContact C-N 3.34Å; G621-F623 PolarHBondContact O-N 3.25Å; F623-C625 VanDerWaalsContact C-N 3.35Å; F623-C625 PolarHBondContact O-N 3.16Å; F623-Y626 PolarHBondContact O-N 2.98Å; F623-A627 PolarHBondContact O-N 2.81Å; F623-A627 VanDerWaalsContact O-N 3.08Å
624	M	93.8	Very high	93	Very high	72 Å²	72	24.1 Å²	24.1	36%	0.355	13%	0.126	S	C	.	.	H	α-helix	trans	-62.2	-38.9	175.8	-70.8	178.8	73.9	0	0	112.3	S620 G621 V622 Y626 A627 M628 T650	S620-M624 WeakPolarHBondContact O-CG 3.39Å; S620-M624 PolarHBondContact O-N 3.12Å; G621-M624 WeakPolarHBondContact O-CB 3.1Å; G621-M624 PolarHBondContact O-N 2.91Å; G621-M624 VanDerWaalsContact O-N 3.16Å; V622-M624 VanDerWaalsContact C-N 3.34Å; V622-M624 PolarHBondContact O-N 3.33Å; M624-Y626 VanDerWaalsContact C-N 3.31Å; M624-Y626 PolarHBondContact O-N 2.8Å; M624-A627 WeakPolarHBondContact O-CB 3.45Å; M624-A627 PolarHBondContact O-N 2.86Å; M624-A627 VanDerWaalsContact O-N 3.15Å; M624-M628 WeakPolarHBondContact O-CG 3.34Å; M624-M628 PolarHBondContact O-N 2.87Å; M624-T650 HydrophobicContact CE-CG2 4.17Å
625	C	94.2	Very high	93.1	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.007	15%	0.146	C	C	.	.	H	α-helix	trans	-57.4	-42.1	175.3	-67.7	0	0	0	0	112.1	G621 V622 F623 M628 V809	G621-C625 PolarHBondContact O-N 3.35Å; G621-C625 PolarHBondContact O-SG 2.9Å; G621-C625 VanDerWaalsContact O-SG 3.33Å; V622-C625 WeakPolarHBondContact O-CB 3.43Å; V622-C625 PolarHBondContact O-N 3.34Å; F623-C625 VanDerWaalsContact C-N 3.35Å; F623-C625 PolarHBondContact O-N 3.16Å; C625-M628 PolarHBondContact O-N 2.84Å; C625-V809 HydrophobicContact CB-CG1 4.04Å; C625-V809 WeakPolarHBondContact O-CG1 3.16Å
626	Y	95.6	Very high	93	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-71.8	-33.1	176.5	-62.7	-54.5	0	0	0	112.9	G587 T591 V622 F623 M624 M628 T629 S810 F814 L817	G587-Y626 VanDerWaalsContact C-CE2 3.48Å; G587-Y626 WeakPolarHBondContact O-CE2 3.32Å; T591-Y626 WeakPolarHBondContact OG1-CE2 3.41Å; V622-Y626 HydrophobicContact CG1-CD2 4.16Å; V622-Y626 HydrophobicContact CG1-CE2 3.53Å; V622-Y626 VanDerWaalsContact O-CD2 3.22Å; V622-Y626 WeakPolarHBondContact O-CD2 3.36Å; V622-Y626 PolarHBondContact O-N 2.93Å; F623-Y626 PolarHBondContact O-N 2.98Å; M624-Y626 VanDerWaalsContact C-N 3.31Å; M624-Y626 PolarHBondContact O-N 2.8Å; Y626-M628 VanDerWaalsContact C-N 3.28Å; Y626-M628 PolarHBondContact O-N 2.79Å; Y626-T629 PolarHBondContact O-N 2.89Å; Y626-S810 WeakPolarHBondContact CE1-O 3.43Å; Y626-F814 AromaticContact CE1-CD2 3.85Å; Y626-F814 HydrophobicContact CE1-CD2 3.85Å; Y626-F814 AromaticContact CE1-CE2 3.66Å; Y626-F814 HydrophobicContact CE1-CE2 3.66Å; Y626-F814 HydrophobicContact CE1-CZ 4.28Å; Y626-F814 WeakPolarHBondContact OH-CA 3.28Å; Y626-F814 WeakPolarHBondContact OH-CD1 3.5Å; Y626-F814 WeakPolarHBondContact OH-CD2 3.47Å; Y626-F814 VanDerWaalsContact OH-CG 3.28Å; Y626-F814 WeakPolarHBondContact OH-CG 3.43Å; Y626-F814 PolarHBondContact OH-N 2.98Å; Y626-F814 VanDerWaalsContact OH-N 3.1Å; Y626-L817 HydrophobicContact CE2-CD1 4.06Å; Y626-L817 WeakPolarHBondContact OH-CD1 3.34Å
627	A	94.5	Very high	92.8	Very high	32 Å²	32	28.6 Å²	28.6	26%	0.264	15%	0.153	S	C	.	.	H	α-helix	trans	-64.8	-32.1	175.4	0	0	0	0	0	112.7	F588 F623 M624 T629 F630 L631	F588-A627 HydrophobicContact CZ-CB 3.93Å; F588-A627 VanDerWaalsContact CZ-N 3.33Å; F623-A627 PolarHBondContact O-N 2.81Å; F623-A627 VanDerWaalsContact O-N 3.08Å; M624-A627 WeakPolarHBondContact O-CB 3.45Å; M624-A627 PolarHBondContact O-N 2.86Å; M624-A627 VanDerWaalsContact O-N 3.15Å; A627-T629 PolarHBondContact O-N 2.96Å; A627-F630 PolarHBondContact O-N 2.74Å; A627-L631 PolarHBondContact O-N 2.69Å
628	M	92.8	Very high	92.5	Very high	5 Å²	5	30.8 Å²	30.8	3%	0.025	17%	0.169	C	C	.	.	H	α-helix	trans	-59.2	-33.2	179	-72.5	-51.2	-59.4	0	0	113.3	M624 C625 Y626 F630 L631 F632 R644 G647 L648 V809	M624-M628 WeakPolarHBondContact O-CG 3.34Å; M624-M628 PolarHBondContact O-N 2.87Å; C625-M628 PolarHBondContact O-N 2.84Å; Y626-M628 VanDerWaalsContact C-N 3.28Å; Y626-M628 PolarHBondContact O-N 2.79Å; M628-F630 VanDerWaalsContact C-N 3.29Å; M628-F630 PolarHBondContact O-N 3.14Å; M628-L631 HydrophobicContact CE-CD1 4.28Å; M628-L631 PolarHBondContact O-N 3.33Å; M628-L631 VanDerWaalsContact O-N 3.14Å; M628-L631 HydrophobicContact SD-CD1 3.77Å; M628-F632 HydrophobicContact CB-CD2 4.27Å; M628-F632 HydrophobicContact CB-CE2 4.28Å; M628-F632 HydrophobicContact CE-CD2 4.05Å; M628-F632 HydrophobicContact CE-CE2 3.44Å; M628-F632 VanDerWaalsContact CE-CE2 3.44Å; M628-F632 HydrophobicContact CE-CZ 3.99Å; M628-F632 WeakPolarHBondContact O-CD2 3.5Å; M628-F632 PolarHBondContact O-N 2.74Å; M628-R644 WeakPolarHBondContact CE-O 3.44Å; M628-G647 WeakPolarHBondContact SD-CA 3.47Å; M628-L648 HydrophobicContact CE-CB 4.11Å; M628-L648 VanDerWaalsContact CE-N 3.34Å; M628-V809 HydrophobicContact CB-CG1 4.38Å
629	T	93.1	Very high	92.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-56.3	-42.7	177.5	-59.8	0	0	0	0	112	P580 A584 Y626 A627 F632 L633 C806 S810	P580-T629 HydrophobicContact CB-CG2 3.75Å; A584-T629 HydrophobicContact CB-CG2 3.97Å; Y626-T629 PolarHBondContact O-N 2.89Å; A627-T629 PolarHBondContact O-N 2.96Å; T629-F632 PolarHBondContact O-N 3.16Å; T629-L633 HydrophobicContact CG2-CD1 4.13Å; T629-L633 WeakPolarHBondContact O-CG 3.41Å; T629-L633 PolarHBondContact O-N 2.94Å; T629-L633 VanDerWaalsContact O-N 3.17Å; T629-C806 HydrophobicContact CG2-CB 3.94Å; T629-S810 PolarHBondContact OG1-OG 3.15Å
630	F	93.4	Very high	92.3	Very high	64 Å²	64	35.1 Å²	35.1	28%	0.281	20%	0.201	S	C	.	.	H	α-helix	trans	-70.2	-37.4	178.3	-66.5	-89.2	0	0	0	112.1	W572 I581 A584 F588 A627 M628 F632 L633 A634	W572-F630 HydrophobicContact CH2-CD1 4.23Å; W572-F630 AromaticContact CZ3-CD1 3.97Å; W572-F630 HydrophobicContact CZ3-CD1 3.97Å; I581-F630 HydrophobicContact CG1-CE1 4.49Å; I581-F630 HydrophobicContact CG2-CE1 4.12Å; I581-F630 HydrophobicContact CG2-CZ 4.21Å; A584-F630 HydrophobicContact CB-CE2 3.99Å; F588-F630 HydrophobicContact CD2-CE2 4.27Å; F588-F630 HydrophobicContact CE2-CD2 4.13Å; F588-F630 AromaticContact CE2-CE2 3.67Å; F588-F630 HydrophobicContact CE2-CE2 3.67Å; A627-F630 PolarHBondContact O-N 2.74Å; M628-F630 VanDerWaalsContact C-N 3.29Å; M628-F630 PolarHBondContact O-N 3.14Å; F630-F632 VanDerWaalsContact C-N 3.33Å; F630-F632 PolarHBondContact O-N 3.03Å; F630-L633 PolarHBondContact O-N 3.06Å; F630-A634 WeakPolarHBondContact O-CB 3.48Å; F630-A634 PolarHBondContact O-N 3.22Å
631	L	92.3	Very high	92	Very high	43 Å²	43	32.5 Å²	32.5	23%	0.225	18%	0.183	C	C	.	.	H	α-helix	trans	-64.9	-37.8	175.8	-66.8	175.5	0	0	0	111.7	A627 M628 I640 L643 R644	A627-L631 PolarHBondContact O-N 2.69Å; M628-L631 HydrophobicContact CE-CD1 4.28Å; M628-L631 PolarHBondContact O-N 3.33Å; M628-L631 VanDerWaalsContact O-N 3.14Å; M628-L631 HydrophobicContact SD-CD1 3.77Å; L631-I640 HydrophobicContact CD2-CD1 4.3Å; L631-I640 WeakPolarHBondContact O-CG2 3.42Å; L631-L643 HydrophobicContact CD1-CB 4.23Å; L631-L643 HydrophobicContact CD2-CB 4.24Å; L631-L643 HydrophobicContact CD2-CD1 4.13Å; L631-R644 HydrophobicContact CB-CG 4.39Å; L631-R644 VanDerWaalsContact O-CZ 3.26Å; L631-R644 PolarHBondContact O-NE 3Å; L631-R644 PolarHBondContact O-NH2 3.43Å
632	F	89.6	Confident	91.8	Very high	11 Å²	11	33.3 Å²	33.3	5%	0.048	19%	0.189	C	C	.	.	H	α-helix	trans	-73.7	-24.7	177.8	-80.8	-63.6	0	0	0	114.8	M628 T629 F630 R644 L648 M739 T802 M805 C806	M628-F632 HydrophobicContact CB-CD2 4.27Å; M628-F632 HydrophobicContact CB-CE2 4.28Å; M628-F632 HydrophobicContact CE-CD2 4.05Å; M628-F632 HydrophobicContact CE-CE2 3.44Å; M628-F632 VanDerWaalsContact CE-CE2 3.44Å; M628-F632 HydrophobicContact CE-CZ 3.99Å; M628-F632 WeakPolarHBondContact O-CD2 3.5Å; M628-F632 PolarHBondContact O-N 2.74Å; T629-F632 PolarHBondContact O-N 3.16Å; F630-F632 VanDerWaalsContact C-N 3.33Å; F630-F632 PolarHBondContact O-N 3.03Å; F632-R644 HydrophobicContact CD1-CB 4.27Å; F632-R644 HydrophobicContact CD1-CG 3.74Å; F632-R644 HydrophobicContact CE1-CB 3.8Å; F632-R644 HydrophobicContact CE1-CG 3.79Å; F632-R644 HydrophobicContact CG-CG 4.32Å; F632-R644 HydrophobicContact CZ-CB 4.21Å; F632-R644 HydrophobicContact CZ-CG 4.42Å; F632-R644 PolarHBondContact O-NH1 3.31Å; F632-R644 PolarHBondContact O-NH2 3.17Å; F632-L648 HydrophobicContact CE2-CB 4.31Å; F632-L648 HydrophobicContact CE2-CD1 3.94Å; F632-L648 HydrophobicContact CZ-CB 4.08Å; F632-L648 HydrophobicContact CZ-CD1 4.19Å; F632-L648 HydrophobicContact CZ-CD2 4.16Å; F632-L648 HydrophobicContact CZ-CG 4.35Å; F632-M739 HydrophobicContact CE1-SD 4.38Å; F632-T802 HydrophobicContact CB-CG2 4.24Å; F632-M805 HydrophobicContact CB-CE 4.4Å; F632-M805 HydrophobicContact CD1-CE 3.12Å; F632-M805 HydrophobicContact CD1-SD 4.46Å; F632-M805 HydrophobicContact CD2-CE 3.91Å; F632-M805 HydrophobicContact CE1-CE 3.1Å; F632-M805 HydrophobicContact CE1-SD 3.94Å; F632-M805 HydrophobicContact CE2-CE 3.89Å; F632-M805 HydrophobicContact CE2-SD 4.22Å; F632-M805 HydrophobicContact CG-CE 3.56Å; F632-M805 HydrophobicContact CZ-CE 3.51Å; F632-M805 HydrophobicContact CZ-SD 3.81Å; F632-C806 VanDerWaalsContact CB-SG 3.56Å
633	L	91.4	Very high	91.6	Very high	5 Å²	5	37.2 Å²	37.2	3%	0.026	21%	0.21	C	C	.	.	H	α-helix	trans	-93.3	-20.4	177.2	-67.2	172.7	0	0	0	113.7	I570 W572 A577 P580 I581 T629 F630	I570-L633 HydrophobicContact CD1-CD2 4.4Å; I570-L633 HydrophobicContact CG2-CD2 4.13Å; W572-L633 HydrophobicContact CH2-CB 4.33Å; W572-L633 HydrophobicContact CZ3-CB 4.14Å; A577-L633 HydrophobicContact CB-CD1 4.18Å; A577-L633 HydrophobicContact CB-CD2 4.12Å; P580-L633 HydrophobicContact CB-CD1 4.36Å; I581-L633 HydrophobicContact CD1-CD1 3.9Å; I581-L633 HydrophobicContact CG1-CD1 3.54Å; T629-L633 HydrophobicContact CG2-CD1 4.13Å; T629-L633 WeakPolarHBondContact O-CG 3.41Å; T629-L633 PolarHBondContact O-N 2.94Å; T629-L633 VanDerWaalsContact O-N 3.17Å; F630-L633 PolarHBondContact O-N 3.06Å
634	A	90.6	Very high	91.3	Very high	18 Å²	18	33.7 Å²	33.7	15%	0.149	19%	0.193	C	C	.	.	S	Bend	trans	-58.9	153.1	177.7	0	0	0	0	0	113	W572 F630 I640 R644	W572-A634 HydrophobicContact CZ2-CB 4.18Å; F630-A634 WeakPolarHBondContact O-CB 3.48Å; F630-A634 PolarHBondContact O-N 3.22Å; A634-I640 HydrophobicContact CB-CD1 4.04Å; A634-I640 HydrophobicContact CB-CG1 4.31Å; A634-I640 HydrophobicContact CB-CG2 4.11Å; A634-R644 PolarHBondContact O-NH2 2.97Å
635	K	89.6	Confident	91	Very high	95 Å²	95	31.4 Å²	31.4	41%	0.413	18%	0.181	S	C	.	.	P	Polyproline II helix	trans	-54.4	127	177.1	-175.2	173.7	180	171.6	0	110.2	E567 Y569 S637 L730	E567-K635 IonicContact OE2-NZ 2.68Å; E567-K635 PolarHBondContact OE2-NZ 2.99Å; Y569-K635 HydrophobicContact CD2-CB 4.37Å; Y569-K635 HydrophobicContact CD2-CG 4.21Å; Y569-K635 HydrophobicContact CE1-CD 4.07Å; Y569-K635 HydrophobicContact CE2-CB 4.17Å; Y569-K635 HydrophobicContact CE2-CD 4.24Å; Y569-K635 HydrophobicContact CE2-CG 4.12Å; Y569-K635 HydrophobicContact CG-CG 4.46Å; K635-S637 PolarHBondContact O-N 2.91Å; K635-S637 VanDerWaalsContact O-N 3.15Å; K635-L730 HydrophobicContact CG-CD2 4.43Å
636	P	88.9	Confident	90.8	Very high	16 Å²	16	33.8 Å²	33.8	10%	0.104	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-57	120.9	178.8	-25.7	34.5	0	0	0	111.3	T716 L730	P636-T716 HydrophobicContact CB-CG2 4.28Å; P636-L730 HydrophobicContact CB-CD2 4.28Å; P636-L730 HydrophobicContact CB-CG 4.23Å; P636-L730 HydrophobicContact CG-CG 4.44Å
637	S	89.3	Confident	90.5	Very high	41 Å²	41	34.3 Å²	34.3	29%	0.287	20%	0.199	S	C	.	.			trans	-139	160.1	172.7	73.6	0	0	0	0	108.4	K635 A639 I640 C641	K635-S637 PolarHBondContact O-N 2.91Å; K635-S637 VanDerWaalsContact O-N 3.15Å; S637-A639 PolarHBondContact O-N 3.31Å; S637-A639 VanDerWaalsContact O-N 3.13Å; S637-I640 PolarHBondContact O-N 3.13Å; S637-I640 VanDerWaalsContact OG-CG1 3.31Å; S637-I640 WeakPolarHBondContact OG-CG1 3.27Å; S637-I640 PolarHBondContact OG-N 3.2Å; S637-C641 WeakPolarHBondContact O-CB 3.26Å; S637-C641 PolarHBondContact O-N 3.13Å; S637-C641 PolarHBondContact O-SG 3.25Å
638	P	87.9	Confident	90.2	Very high	74 Å²	74	33 Å²	33	48%	0.481	19%	0.187	S	C	.	.	H	α-helix	trans	-51.9	-39.8	179.1	-28.2	35.7	0	0	0	112.8	A642	P638-A642 WeakPolarHBondContact O-CB 3.26Å; P638-A642 PolarHBondContact O-N 3.48Å; P638-A642 VanDerWaalsContact O-N 3.08Å
639	A	89.7	Confident	90.2	Very high	63 Å²	63	32.8 Å²	32.8	52%	0.521	19%	0.186	S	C	.	.	H	α-helix	trans	-67.4	-47	176.5	0	0	0	0	0	112.8	S637 C641 A642 L643	S637-A639 PolarHBondContact O-N 3.31Å; S637-A639 VanDerWaalsContact O-N 3.13Å; A639-C641 PolarHBondContact O-N 3.36Å; A639-A642 WeakPolarHBondContact O-CB 3.28Å; A639-A642 PolarHBondContact O-N 2.93Å; A639-L643 WeakPolarHBondContact O-CG 3.43Å; A639-L643 PolarHBondContact O-N 3.33Å
640	I	91.8	Very high	90.1	Very high	32 Å²	32	33.3 Å²	33.3	16%	0.164	19%	0.19	C	C	.	.	H	α-helix	trans	-65.2	-40.9	179.4	-67	-64.2	0	0	0	110.9	L631 A634 S637 A642 L643 R644	L631-I640 HydrophobicContact CD2-CD1 4.3Å; L631-I640 WeakPolarHBondContact O-CG2 3.42Å; A634-I640 HydrophobicContact CB-CD1 4.04Å; A634-I640 HydrophobicContact CB-CG1 4.31Å; A634-I640 HydrophobicContact CB-CG2 4.11Å; S637-I640 PolarHBondContact O-N 3.13Å; S637-I640 VanDerWaalsContact OG-CG1 3.31Å; S637-I640 WeakPolarHBondContact OG-CG1 3.27Å; S637-I640 PolarHBondContact OG-N 3.2Å; I640-A642 VanDerWaalsContact C-N 3.33Å; I640-A642 PolarHBondContact O-N 3.48Å; I640-L643 PolarHBondContact O-N 2.94Å; I640-R644 HydrophobicContact CG2-CG 4.41Å; I640-R644 VanDerWaalsContact O-CG 3.31Å; I640-R644 WeakPolarHBondContact O-CG 3.33Å; I640-R644 PolarHBondContact O-N 2.84Å
641	C	89.8	Confident	90.1	Very high	3 Å²	3	30.3 Å²	30.3	2%	0.02	18%	0.176	C	C	.	.	H	α-helix	trans	-63.6	-38.2	176.6	-63.1	0	0	0	0	111.9	S637 A639 R645 P714 C732	S637-C641 WeakPolarHBondContact O-CB 3.26Å; S637-C641 PolarHBondContact O-N 3.13Å; S637-C641 PolarHBondContact O-SG 3.25Å; A639-C641 PolarHBondContact O-N 3.36Å; C641-R645 PolarHBondContact O-N 3.04Å; C641-P714 HydrophobicContact CB-CB 4.49Å; C641-C732 VanDerWaalsContact CA-SG 3.57Å; C641-C732 HydrophobicContact CB-CB 3.79Å; C641-C732 WeakPolarHBondContact CB-SG 3.47Å; C641-C732 VanDerWaalsContact SG-CA 3.51Å; C641-C732 WeakPolarHBondContact SG-CB 3.5Å; C641-C732 CovalentContact SG-SG 2.03Å; C641-C732 PolarHBondContact SG-SG 2.7Å
642	A	89.4	Confident	90.2	Very high	16 Å²	16	28.3 Å²	28.3	13%	0.132	17%	0.166	C	C	.	.	H	α-helix	trans	-63.6	-46.8	172.7	0	0	0	0	0	111.8	P638 A639 I640 R644 R645 L646 L709 P714	P638-A642 WeakPolarHBondContact O-CB 3.26Å; P638-A642 PolarHBondContact O-N 3.48Å; P638-A642 VanDerWaalsContact O-N 3.08Å; A639-A642 WeakPolarHBondContact O-CB 3.28Å; A639-A642 PolarHBondContact O-N 2.93Å; I640-A642 VanDerWaalsContact C-N 3.33Å; I640-A642 PolarHBondContact O-N 3.48Å; A642-R644 PolarHBondContact O-N 2.99Å; A642-R645 PolarHBondContact O-N 3.28Å; A642-L646 WeakPolarHBondContact O-CG 3.35Å; A642-L646 PolarHBondContact O-N 3.32Å; A642-L709 HydrophobicContact CB-CD1 4.16Å; A642-P714 HydrophobicContact CB-CB 3.99Å; A642-P714 HydrophobicContact CB-CG 3.85Å
643	L	90	Very high	90.4	Very high	83 Å²	83	27.8 Å²	27.8	44%	0.435	16%	0.164	S	C	.	.	H	α-helix	trans	-64.4	-38.4	179.3	-72.2	171.7	0	0	0	112.8	L631 A639 I640 R645 G647	L631-L643 HydrophobicContact CD1-CB 4.23Å; L631-L643 HydrophobicContact CD2-CB 4.24Å; L631-L643 HydrophobicContact CD2-CD1 4.13Å; A639-L643 WeakPolarHBondContact O-CG 3.43Å; A639-L643 PolarHBondContact O-N 3.33Å; I640-L643 PolarHBondContact O-N 2.94Å; L643-R645 VanDerWaalsContact C-N 3.3Å; L643-R645 PolarHBondContact O-N 3.41Å; L643-G647 WeakPolarHBondContact O-CA 3.49Å; L643-G647 PolarHBondContact O-N 2.87Å
644	R	90	Very high	90.6	Very high	33 Å²	33	28.1 Å²	28.1	13%	0.125	17%	0.166	C	C	.	.	H	α-helix	trans	-57.2	-45.1	173.5	-75.8	174.2	-170.2	-160.3	1.1	111.6	M628 L631 F632 A634 I640 A642 L648	M628-R644 WeakPolarHBondContact CE-O 3.44Å; L631-R644 HydrophobicContact CB-CG 4.39Å; L631-R644 VanDerWaalsContact O-CZ 3.26Å; L631-R644 PolarHBondContact O-NE 3Å; L631-R644 PolarHBondContact O-NH2 3.43Å; F632-R644 HydrophobicContact CD1-CB 4.27Å; F632-R644 HydrophobicContact CD1-CG 3.74Å; F632-R644 HydrophobicContact CE1-CB 3.8Å; F632-R644 HydrophobicContact CE1-CG 3.79Å; F632-R644 HydrophobicContact CG-CG 4.32Å; F632-R644 HydrophobicContact CZ-CB 4.21Å; F632-R644 HydrophobicContact CZ-CG 4.42Å; F632-R644 PolarHBondContact O-NH1 3.31Å; F632-R644 PolarHBondContact O-NH2 3.17Å; A634-R644 PolarHBondContact O-NH2 2.97Å; I640-R644 HydrophobicContact CG2-CG 4.41Å; I640-R644 VanDerWaalsContact O-CG 3.31Å; I640-R644 WeakPolarHBondContact O-CG 3.33Å; I640-R644 PolarHBondContact O-N 2.84Å; A642-R644 PolarHBondContact O-N 2.99Å; R644-L648 PolarHBondContact O-N 2.9Å
645	R	87.6	Confident	90.8	Very high	25 Å²	25	27.4 Å²	27.4	9%	0.094	16%	0.16	C	C	.	.	H	α-helix	trans	-70.7	-44	-177.4	-163.3	173.7	-174.5	-154.9	-1.7	112.1	C641 A642 L643 V705 W708 E712	C641-R645 PolarHBondContact O-N 3.04Å; A642-R645 PolarHBondContact O-N 3.28Å; L643-R645 VanDerWaalsContact C-N 3.3Å; L643-R645 PolarHBondContact O-N 3.41Å; R645-V705 WeakPolarHBondContact O-CG1 3.48Å; R645-W708 VanDerWaalsContact NE-CD1 3.28Å; R645-W708 PolarHBondContact NH1-O 3.42Å; R645-W708 PolarHBondContact NH2-O 3.19Å; R645-E712 IonicContact CZ-OE2 3.7Å; R645-E712 PolarHBondContact NH1-O 2.94Å; R645-E712 IonicContact NH2-OE2 3.23Å; R645-E712 PolarHBondContact NH2-OE2 3.45Å
646	L	88.7	Confident	91	Very high	51 Å²	51	23 Å²	23	27%	0.267	14%	0.141	S	C	.	.	H	α-helix	trans	-65.8	-42.6	175.6	-72.7	174.6	0	0	0	111.9	A642 T650 V705 L709	A642-L646 WeakPolarHBondContact O-CG 3.35Å; A642-L646 PolarHBondContact O-N 3.32Å; L646-T650 VanDerWaalsContact O-CB 3.24Å; L646-T650 WeakPolarHBondContact O-CB 3.49Å; L646-T650 PolarHBondContact O-OG1 3.14Å; L646-V705 HydrophobicContact CD2-CB 4.43Å; L646-V705 HydrophobicContact CD2-CG1 3.84Å; L646-L709 HydrophobicContact CD1-CD2 4.23Å; L646-L709 HydrophobicContact CD2-CD2 4.35Å; L646-L709 HydrophobicContact CG-CD2 4.35Å
647	G	89.9	Confident	91.2	Very high	11 Å²	11	22.2 Å²	22.2	11%	0.113	14%	0.136	C	C	.	.	H	α-helix	trans	-77.4	-40.6	-167.8	0	0	0	0	0	114.6	M628 L643 T650 S651	M628-G647 WeakPolarHBondContact SD-CA 3.47Å; L643-G647 WeakPolarHBondContact O-CA 3.49Å; L643-G647 PolarHBondContact O-N 2.87Å; G647-T650 PolarHBondContact O-N 3.38Å; G647-S651 PolarHBondContact O-N 3.41Å; G647-S651 PolarHBondContact O-OG 2.88Å
648	L	89.4	Confident	91.4	Very high	4 Å²	4	20.3 Å²	20.3	2%	0.021	12%	0.122	C	C	.	.	H	α-helix	trans	-59.4	-54.4	-171	179.4	68.4	0	0	0	112.8	M628 F632 R644 S651 F652 M739 L743 M805 V809	M628-L648 HydrophobicContact CE-CB 4.11Å; M628-L648 VanDerWaalsContact CE-N 3.34Å; F632-L648 HydrophobicContact CE2-CB 4.31Å; F632-L648 HydrophobicContact CE2-CD1 3.94Å; F632-L648 HydrophobicContact CZ-CB 4.08Å; F632-L648 HydrophobicContact CZ-CD1 4.19Å; F632-L648 HydrophobicContact CZ-CD2 4.16Å; F632-L648 HydrophobicContact CZ-CG 4.35Å; R644-L648 PolarHBondContact O-N 2.9Å; L648-S651 PolarHBondContact O-OG 3.13Å; L648-F652 HydrophobicContact CD1-CE2 3.88Å; L648-F652 WeakPolarHBondContact O-CD2 3.31Å; L648-M739 HydrophobicContact CD2-CG 3.88Å; L648-M739 HydrophobicContact CD2-SD 4.15Å; L648-L743 HydrophobicContact CD2-CD1 4.35Å; L648-L743 HydrophobicContact CD2-CD2 4.22Å; L648-L743 HydrophobicContact CG-CD2 4.09Å; L648-M805 HydrophobicContact CD2-SD 4.32Å; L648-V809 HydrophobicContact CD1-CG2 3.67Å
649	G	90.8	Very high	91.6	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.01	10%	0.099	C	C	.	.	H	α-helix	trans	-70.6	-38.5	178.4	0	0	0	0	0	112.2	S651 F652 A653 D746	G649-S651 PolarHBondContact O-N 3.33Å; G649-F652 PolarHBondContact O-N 2.93Å; G649-A653 WeakPolarHBondContact O-CB 3.48Å; G649-A653 PolarHBondContact O-N 2.91Å; G649-D746 VanDerWaalsContact CA-OD2 3.27Å; G649-D746 WeakPolarHBondContact CA-OD2 3.42Å
650	T	92.6	Very high	91.7	Very high	11 Å²	11	14.3 Å²	14.3	7%	0.067	8%	0.077	C	C	.	.	H	α-helix	trans	-62.7	-40.1	-178.8	-56.6	0	0	0	0	112.3	M624 L646 G647 F652 A653 V654 L702	M624-T650 HydrophobicContact CE-CG2 4.17Å; L646-T650 VanDerWaalsContact O-CB 3.24Å; L646-T650 WeakPolarHBondContact O-CB 3.49Å; L646-T650 PolarHBondContact O-OG1 3.14Å; G647-T650 PolarHBondContact O-N 3.38Å; T650-F652 VanDerWaalsContact C-N 3.31Å; T650-F652 PolarHBondContact O-N 3.07Å; T650-A653 PolarHBondContact O-N 3.05Å; T650-V654 HydrophobicContact CG2-CG2 4.44Å; T650-V654 VanDerWaalsContact O-CG2 3.3Å; T650-V654 WeakPolarHBondContact O-CG2 3.25Å; T650-V654 PolarHBondContact O-N 3.23Å; T650-L702 HydrophobicContact CG2-CD2 3.65Å; T650-L702 HydrophobicContact CG2-CG 4.26Å
651	S	93.7	Very high	91.7	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-61.3	-40.1	178.7	55.9	0	0	0	0	112.4	G647 L648 G649 C655	G647-S651 PolarHBondContact O-N 3.41Å; G647-S651 PolarHBondContact O-OG 2.88Å; L648-S651 PolarHBondContact O-OG 3.13Å; G649-S651 PolarHBondContact O-N 3.33Å; S651-C655 PolarHBondContact O-N 3.03Å; S651-C655 PolarHBondContact O-SG 3.23Å
652	F	92.8	Very high	91.6	Very high	2 Å²	2	12.9 Å²	12.9	1%	0.009	7%	0.07	C	C	.	.	H	α-helix	trans	-72.1	-42.7	176.6	-70.2	-54.3	0	0	0	112.3	L648 G649 T650 V654 C655 Y656 L743 D746 W784 V809	L648-F652 HydrophobicContact CD1-CE2 3.88Å; L648-F652 WeakPolarHBondContact O-CD2 3.31Å; G649-F652 PolarHBondContact O-N 2.93Å; T650-F652 VanDerWaalsContact C-N 3.31Å; T650-F652 PolarHBondContact O-N 3.07Å; F652-V654 VanDerWaalsContact C-N 3.29Å; F652-V654 PolarHBondContact O-N 3.32Å; F652-C655 WeakPolarHBondContact O-CB 3.35Å; F652-C655 PolarHBondContact O-N 2.94Å; F652-Y656 HydrophobicContact CB-CD2 4.03Å; F652-Y656 HydrophobicContact CB-CE2 3.84Å; F652-Y656 AromaticContact CD1-CE2 3.86Å; F652-Y656 HydrophobicContact CD1-CE2 3.86Å; F652-Y656 HydrophobicContact CG-CE2 4.17Å; F652-Y656 WeakPolarHBondContact O-CD2 3.26Å; F652-Y656 PolarHBondContact O-N 3.27Å; F652-L743 HydrophobicContact CD2-CD2 4.19Å; F652-D746 HydrophobicContact CB-CB 4.24Å; F652-W784 AromaticContact CD1-CZ2 3.8Å; F652-W784 HydrophobicContact CD1-CZ2 3.8Å; F652-W784 AromaticContact CD2-CH2 3.74Å; F652-W784 HydrophobicContact CD2-CH2 3.74Å; F652-W784 AromaticContact CD2-CZ2 3.6Å; F652-W784 HydrophobicContact CD2-CZ2 3.6Å; F652-W784 HydrophobicContact CE1-CH2 4.42Å; F652-W784 AromaticContact CE1-CZ2 3.59Å; F652-W784 HydrophobicContact CE1-CZ2 3.59Å; F652-W784 AromaticContact CE2-CH2 3.39Å; F652-W784 HydrophobicContact CE2-CH2 3.39Å; F652-W784 AromaticContact CE2-CZ2 3.38Å; F652-W784 HydrophobicContact CE2-CZ2 3.38Å; F652-W784 HydrophobicContact CG-CH2 4.39Å; F652-W784 AromaticContact CG-CZ2 3.8Å; F652-W784 HydrophobicContact CG-CZ2 3.8Å; F652-W784 AromaticContact CZ-CH2 3.77Å; F652-W784 HydrophobicContact CZ-CH2 3.77Å; F652-W784 AromaticContact CZ-CZ2 3.36Å; F652-W784 HydrophobicContact CZ-CZ2 3.36Å; F652-V809 HydrophobicContact CE2-CG2 4.09Å; F652-V809 HydrophobicContact CZ-CB 4.14Å; F652-V809 HydrophobicContact CZ-CG1 3.97Å; F652-V809 HydrophobicContact CZ-CG2 3.81Å
653	A	94.7	Very high	91.6	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-57.8	-41.3	176.6	0	0	0	0	0	111.9	G649 T650 C655 A657 Q701 D746 L749	G649-A653 WeakPolarHBondContact O-CB 3.48Å; G649-A653 PolarHBondContact O-N 2.91Å; T650-A653 PolarHBondContact O-N 3.05Å; A653-C655 PolarHBondContact O-N 3.11Å; A653-A657 WeakPolarHBondContact O-CB 3.5Å; A653-A657 PolarHBondContact O-N 2.77Å; A653-Q701 HydrophobicContact CB-CB 3.69Å; A653-Q701 HydrophobicContact CB-CG 3.76Å; A653-D746 WeakPolarHBondContact CA-OD1 3.42Å; A653-D746 WeakPolarHBondContact CB-OD1 3.4Å; A653-D746 PolarHBondContact N-OD1 2.99Å; A653-L749 HydrophobicContact CB-CD1 4.31Å
654	V	95.2	Very high	91.5	Very high	11 Å²	11	10 Å²	10	7%	0.067	5%	0.053	C	C	.	.	H	α-helix	trans	-61.1	-44.6	174.9	175.4	0	0	0	0	111.3	I617 T650 F652 A658 I698	I617-V654 HydrophobicContact CG2-CG1 3.9Å; I617-V654 VanDerWaalsContact O-CG1 3.31Å; I617-V654 WeakPolarHBondContact O-CG1 3.31Å; T650-V654 HydrophobicContact CG2-CG2 4.44Å; T650-V654 VanDerWaalsContact O-CG2 3.3Å; T650-V654 WeakPolarHBondContact O-CG2 3.25Å; T650-V654 PolarHBondContact O-N 3.23Å; F652-V654 VanDerWaalsContact C-N 3.29Å; F652-V654 PolarHBondContact O-N 3.32Å; V654-A658 WeakPolarHBondContact O-CB 3.31Å; V654-A658 PolarHBondContact O-N 3.2Å; V654-I698 HydrophobicContact CB-CD1 4.42Å; V654-I698 HydrophobicContact CG1-CD1 4.43Å; V654-I698 HydrophobicContact CG2-CD1 4.09Å; V654-I698 HydrophobicContact CG2-CG1 4.23Å; V654-I698 HydrophobicContact CG2-CG2 4.03Å
655	C	94.1	Very high	91.2	Very high	4 Å²	4	11.1 Å²	11.1	3%	0.027	6%	0.057	C	C	.	.	H	α-helix	trans	-64.2	-53.1	179.2	-66.6	0	0	0	0	112	L618 S651 F652 A653 A658 L659	L618-C655 HydrophobicContact CD1-CB 4.02Å; L618-C655 WeakPolarHBondContact CD1-O 3.47Å; S651-C655 PolarHBondContact O-N 3.03Å; S651-C655 PolarHBondContact O-SG 3.23Å; F652-C655 WeakPolarHBondContact O-CB 3.35Å; F652-C655 PolarHBondContact O-N 2.94Å; A653-C655 PolarHBondContact O-N 3.11Å; C655-A658 PolarHBondContact O-N 2.8Å; C655-L659 WeakPolarHBondContact O-CG 3.2Å; C655-L659 PolarHBondContact O-N 3.09Å
656	Y	93.9	Very high	91	Very high	2 Å²	2	10.9 Å²	10.9	1%	0.008	6%	0.057	C	C	.	.	H	α-helix	trans	-77.1	-31.7	-173.1	-59.2	-52.2	0	0	0	112.7	F652 A658 L659 L660 V750 C753 M777 T780 W784	F652-Y656 HydrophobicContact CB-CD2 4.03Å; F652-Y656 HydrophobicContact CB-CE2 3.84Å; F652-Y656 AromaticContact CD1-CE2 3.86Å; F652-Y656 HydrophobicContact CD1-CE2 3.86Å; F652-Y656 HydrophobicContact CG-CE2 4.17Å; F652-Y656 WeakPolarHBondContact O-CD2 3.26Å; F652-Y656 PolarHBondContact O-N 3.27Å; Y656-A658 VanDerWaalsContact C-N 3.33Å; Y656-A658 PolarHBondContact O-N 2.85Å; Y656-L659 HydrophobicContact CD1-CD1 4.07Å; Y656-L659 HydrophobicContact CE1-CD1 4.46Å; Y656-L659 PolarHBondContact O-N 3.4Å; Y656-L660 VanDerWaalsContact O-CB 3.23Å; Y656-L660 WeakPolarHBondContact O-CB 3.5Å; Y656-L660 PolarHBondContact O-N 3.24Å; Y656-V750 HydrophobicContact CD1-CG2 3.99Å; Y656-V750 HydrophobicContact CD2-CG2 3.58Å; Y656-V750 HydrophobicContact CE1-CG2 3.97Å; Y656-V750 HydrophobicContact CE2-CG2 3.51Å; Y656-V750 HydrophobicContact CG-CG2 3.84Å; Y656-C753 PolarHBondContact O-SG 3.15Å; Y656-C753 VanDerWaalsContact O-SG 3.37Å; Y656-M777 HydrophobicContact CD1-CE 4.49Å; Y656-M777 HydrophobicContact CD1-SD 4.49Å; Y656-T780 HydrophobicContact CE1-CG2 3.7Å; Y656-T780 WeakPolarHBondContact OH-CG2 3.47Å; Y656-W784 PolarHBondContact OH-NE1 2.59Å; Y656-W784 VanDerWaalsContact OH-NE1 3.08Å
657	A	94.8	Very high	90.6	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-62.5	-40.2	171.7	0	0	0	0	0	111.8	A653 T661 M697 I698	A653-A657 WeakPolarHBondContact O-CB 3.5Å; A653-A657 PolarHBondContact O-N 2.77Å; A657-T661 WeakPolarHBondContact O-CB 3.41Å; A657-T661 PolarHBondContact O-N 3.12Å; A657-T661 PolarHBondContact O-OG1 3.47Å; A657-M697 HydrophobicContact CB-CB 3.87Å; A657-M697 HydrophobicContact CB-CE 4.19Å; A657-I698 HydrophobicContact CB-CD1 4.46Å; A657-I698 HydrophobicContact CB-CG1 3.85Å
658	A	93.2	Very high	90.1	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-68.1	-42.8	176.7	0	0	0	0	0	111.8	I617 L618 V654 C655 Y656 T661 K662	I617-A658 HydrophobicContact CG2-CB 4.19Å; L618-A658 HydrophobicContact CB-CB 3.93Å; L618-A658 HydrophobicContact CD1-CB 4.37Å; V654-A658 WeakPolarHBondContact O-CB 3.31Å; V654-A658 PolarHBondContact O-N 3.2Å; C655-A658 PolarHBondContact O-N 2.8Å; Y656-A658 VanDerWaalsContact C-N 3.33Å; Y656-A658 PolarHBondContact O-N 2.85Å; A658-T661 PolarHBondContact O-N 3.06Å; A658-K662 WeakPolarHBondContact O-CG 3.42Å; A658-K662 PolarHBondContact O-N 2.9Å
659	L	91.9	Very high	89.5	Confident	0 Å²	0	13.5 Å²	13.5	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-63	-44.7	174.4	-74.9	170.2	0	0	0	111.9	L618 C655 Y656 T661 K662 T663 T776 M777 M820	L618-L659 HydrophobicContact CD1-CD1 4.38Å; L618-L659 HydrophobicContact CD1-CG 4.04Å; L618-L659 HydrophobicContact CD2-CD2 3.9Å; L618-L659 HydrophobicContact CD2-CG 4.19Å; C655-L659 WeakPolarHBondContact O-CG 3.2Å; C655-L659 PolarHBondContact O-N 3.09Å; Y656-L659 HydrophobicContact CD1-CD1 4.07Å; Y656-L659 HydrophobicContact CE1-CD1 4.46Å; Y656-L659 PolarHBondContact O-N 3.4Å; L659-T661 VanDerWaalsContact C-N 3.35Å; L659-T661 PolarHBondContact O-N 3.15Å; L659-K662 WeakPolarHBondContact O-CB 3.46Å; L659-K662 PolarHBondContact O-N 3.49Å; L659-T663 WeakPolarHBondContact O-CG2 3.16Å; L659-T663 PolarHBondContact O-N 2.83Å; L659-T663 PolarHBondContact O-OG1 2.91Å; L659-T776 HydrophobicContact CD1-CG2 4.47Å; L659-M777 HydrophobicContact CD1-SD 4.14Å; L659-M820 HydrophobicContact CD2-CE 3.87Å; L659-M820 HydrophobicContact CD2-SD 3.52Å; L659-M820 VanDerWaalsContact CD2-SD 3.52Å
660	L	92.4	Very high	88.7	Confident	11 Å²	11	16.2 Å²	16.2	6%	0.058	8%	0.076	C	C	.	.	H	α-helix	trans	-61.3	-43.5	177.1	-171.6	52.4	0	0	0	111.6	Y656 K662 T663 N664 M697 L749 L752 C753 Y756	Y656-L660 VanDerWaalsContact O-CB 3.23Å; Y656-L660 WeakPolarHBondContact O-CB 3.5Å; Y656-L660 PolarHBondContact O-N 3.24Å; L660-K662 VanDerWaalsContact C-N 3.28Å; L660-K662 PolarHBondContact O-N 2.87Å; L660-T663 WeakPolarHBondContact CA-OG1 3.48Å; L660-T663 PolarHBondContact O-N 3.48Å; L660-T663 PolarHBondContact O-OG1 3.32Å; L660-N664 WeakPolarHBondContact O-CB 3.49Å; L660-N664 PolarHBondContact O-N 3Å; L660-M697 HydrophobicContact CD2-SD 3.77Å; L660-M697 HydrophobicContact CG-SD 4.45Å; L660-L749 HydrophobicContact CD2-CD2 4.01Å; L660-L752 HydrophobicContact CD1-CB 4.21Å; L660-L752 HydrophobicContact CD2-CB 4.17Å; L660-C753 WeakPolarHBondContact CB-SG 3.04Å; L660-Y756 HydrophobicContact CD1-CD2 3.66Å; L660-Y756 HydrophobicContact CD1-CE2 4.3Å; L660-Y756 HydrophobicContact CD1-CG 4.37Å
661	T	91.4	Very high	87.6	Confident	2 Å²	2	17.9 Å²	17.9	1%	0.012	8%	0.084	C	C	.	.	H	α-helix	trans	-63.2	-39.2	178	-55.5	0	0	0	0	110.7	L614 A657 A658 L659 R665 Q690 C694 M697	L614-T661 HydrophobicContact CD1-CG2 3.82Å; L614-T661 HydrophobicContact CD2-CG2 3.99Å; A657-T661 WeakPolarHBondContact O-CB 3.41Å; A657-T661 PolarHBondContact O-N 3.12Å; A657-T661 PolarHBondContact O-OG1 3.47Å; A658-T661 PolarHBondContact O-N 3.06Å; L659-T661 VanDerWaalsContact C-N 3.35Å; L659-T661 PolarHBondContact O-N 3.15Å; T661-R665 WeakPolarHBondContact O-CB 3.42Å; T661-R665 PolarHBondContact O-N 3.21Å; T661-Q690 HydrophobicContact CG2-CB 3.93Å; T661-Q690 HydrophobicContact CG2-CG 4.41Å; T661-Q690 WeakPolarHBondContact CG2-O 3.35Å; T661-C694 HydrophobicContact CG2-CB 4.42Å; T661-M697 WeakPolarHBondContact OG1-CE 3.47Å
662	K	88.3	Confident	86.2	Confident	4 Å²	4	18.9 Å²	18.9	2%	0.017	10%	0.095	C	C	.	.	H	α-helix	trans	-66.6	-46.1	175.1	-77	-179.8	174.6	172.2	0	112.7	L614 C615 A658 L659 L660 R665 I666 M820	L614-K662 HydrophobicContact CB-CD 4.36Å; L614-K662 VanDerWaalsContact CB-CE 3.49Å; L614-K662 HydrophobicContact CB-CG 4.1Å; L614-K662 HydrophobicContact CD1-CG 3.71Å; C615-K662 PolarHBondContact SG-NZ 2.91Å; A658-K662 WeakPolarHBondContact O-CG 3.42Å; A658-K662 PolarHBondContact O-N 2.9Å; L659-K662 WeakPolarHBondContact O-CB 3.46Å; L659-K662 PolarHBondContact O-N 3.49Å; L660-K662 VanDerWaalsContact C-N 3.28Å; L660-K662 PolarHBondContact O-N 2.87Å; K662-R665 WeakPolarHBondContact O-CB 3.29Å; K662-R665 PolarHBondContact O-N 2.7Å; K662-I666 WeakPolarHBondContact O-CG1 3.18Å; K662-I666 PolarHBondContact O-N 3.34Å; K662-M820 HydrophobicContact CD-CE 3.56Å
663	T	88.3	Confident	84.9	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-67.2	-40.5	178	52.4	0	0	0	0	111.8	L659 L660 R665 I666 A667 I773	L659-T663 WeakPolarHBondContact O-CG2 3.16Å; L659-T663 PolarHBondContact O-N 2.83Å; L659-T663 PolarHBondContact O-OG1 2.91Å; L660-T663 WeakPolarHBondContact CA-OG1 3.48Å; L660-T663 PolarHBondContact O-N 3.48Å; L660-T663 PolarHBondContact O-OG1 3.32Å; T663-R665 PolarHBondContact O-N 2.82Å; T663-I666 PolarHBondContact O-N 2.9Å; T663-A667 WeakPolarHBondContact O-CB 3.24Å; T663-A667 PolarHBondContact O-N 2.7Å; T663-I773 HydrophobicContact CG2-CB 4.31Å; T663-I773 HydrophobicContact CG2-CD1 4.25Å; T663-I773 HydrophobicContact CG2-CG2 3.27Å
664	N	87.1	Confident	83.4	Confident	39 Å²	39	31.7 Å²	31.7	21%	0.209	16%	0.16	C	C	.	.	H	α-helix	trans	-63	-41.1	176	-172.5	-18.7	0	0	0	111.4	L660 I666 A667 R668	L660-N664 WeakPolarHBondContact O-CB 3.49Å; L660-N664 PolarHBondContact O-N 3Å; N664-I666 PolarHBondContact O-N 3.14Å; N664-A667 PolarHBondContact O-N 3.22Å; N664-R668 WeakPolarHBondContact O-CG 3.25Å; N664-R668 PolarHBondContact O-N 2.91Å; N664-R668 WeakPolarHBondContact OD1-CD 3.37Å; N664-R668 WeakPolarHBondContact OD1-CG 3.49Å; N664-R668 PolarHBondContact OD1-NE 3.05Å
665	R	85.4	Confident	81.7	Confident	56 Å²	56	37.3 Å²	37.3	21%	0.211	19%	0.19	C	C	.	.	H	α-helix	trans	-54.3	-50.4	170.8	178.1	-164.6	171.7	-164.2	-11.9	111.2	A609 T661 K662 T663 R668 I669 Q690	A609-R665 PolarHBondContact O-NH1 2.8Å; A609-R665 PolarHBondContact O-NH2 3.49Å; T661-R665 WeakPolarHBondContact O-CB 3.42Å; T661-R665 PolarHBondContact O-N 3.21Å; K662-R665 WeakPolarHBondContact O-CB 3.29Å; K662-R665 PolarHBondContact O-N 2.7Å; T663-R665 PolarHBondContact O-N 2.82Å; R665-R668 PolarHBondContact O-N 2.84Å; R665-I669 HydrophobicContact CG-CD1 3.97Å; R665-I669 VanDerWaalsContact O-CG1 3.29Å; R665-I669 WeakPolarHBondContact O-CG1 3.23Å; R665-I669 PolarHBondContact O-N 2.86Å; R665-I669 VanDerWaalsContact O-N 3.11Å; R665-Q690 VanDerWaalsContact CD-NE2 3.27Å
666	I	82.6	Confident	79.8	Confident	20 Å²	20	40.4 Å²	40.4	10%	0.103	22%	0.222	C	C	.	.	H	α-helix	trans	-62.5	-44.7	179.6	-63.9	167.6	0	0	0	110.7	K662 T663 N664 R668 I669 F670 T760 I773	K662-I666 WeakPolarHBondContact O-CG1 3.18Å; K662-I666 PolarHBondContact O-N 3.34Å; T663-I666 PolarHBondContact O-N 2.9Å; N664-I666 PolarHBondContact O-N 3.14Å; I666-R668 PolarHBondContact O-N 3.46Å; I666-I669 PolarHBondContact O-N 3.37Å; I666-F670 PolarHBondContact O-N 2.88Å; I666-T760 HydrophobicContact CB-CG2 4.24Å; I666-T760 HydrophobicContact CG2-CG2 3.86Å; I666-I773 HydrophobicContact CD1-CD1 3.83Å
667	A	79.9	Confident	78	Confident	4 Å²	4	42.8 Å²	42.8	3%	0.033	24%	0.242	C	C	.	.	H	α-helix	trans	-61.9	-39	179.2	0	0	0	0	0	112.9	T663 N664 N671 Y756 T760	T663-A667 WeakPolarHBondContact O-CB 3.24Å; T663-A667 PolarHBondContact O-N 2.7Å; N664-A667 PolarHBondContact O-N 3.22Å; A667-N671 WeakPolarHBondContact O-CB 3.46Å; A667-N671 PolarHBondContact O-N 2.86Å; A667-N671 PolarHBondContact O-ND2 3.31Å; A667-N671 VanDerWaalsContact O-ND2 3.1Å; A667-Y756 HydrophobicContact CB-CD1 4.03Å; A667-Y756 HydrophobicContact CB-CE1 4.49Å; A667-T760 HydrophobicContact CB-CG2 3.72Å
668	R	79.6	Confident	76.1	Confident	56 Å²	56	46.4 Å²	46.4	21%	0.211	28%	0.28	C	S	.	.	H	α-helix	trans	-70.2	-38.8	176.9	-73.8	-172.4	-64	-171.2	7.2	112.7	N664 R665 I666 G672 F684	N664-R668 WeakPolarHBondContact O-CG 3.25Å; N664-R668 PolarHBondContact O-N 2.91Å; N664-R668 WeakPolarHBondContact OD1-CD 3.37Å; N664-R668 WeakPolarHBondContact OD1-CG 3.49Å; N664-R668 PolarHBondContact OD1-NE 3.05Å; R665-R668 PolarHBondContact O-N 2.84Å; I666-R668 PolarHBondContact O-N 3.46Å; R668-G672 PolarHBondContact O-N 3.14Å; R668-G672 VanDerWaalsContact O-N 3.08Å; R668-F684 VanDerWaalsContact NH1-CB 3.35Å; R668-F684 PolarHBondContact NH2-O 3.47Å
669	I	77.3	Confident	74	Confident	60 Å²	60	53.2 Å²	53.2	31%	0.308	32%	0.321	S	S	.	.	H	α-helix	trans	-61.7	-46.5	174.3	-67.5	166.1	0	0	0	109.8	R665 I666 V673 I685	R665-I669 HydrophobicContact CG-CD1 3.97Å; R665-I669 VanDerWaalsContact O-CG1 3.29Å; R665-I669 WeakPolarHBondContact O-CG1 3.23Å; R665-I669 PolarHBondContact O-N 2.86Å; R665-I669 VanDerWaalsContact O-N 3.11Å; I666-I669 PolarHBondContact O-N 3.37Å; I669-V673 WeakPolarHBondContact O-CG2 3.49Å; I669-V673 PolarHBondContact O-N 2.98Å; I669-I685 HydrophobicContact CG1-CD1 3.98Å
670	F	72.9	Confident	72.3	Confident	59 Å²	59	58.5 Å²	58.5	26%	0.259	35%	0.353	S	S	.	.	H	α-helix	trans	-70.2	-41.7	-177.7	-172.4	-100.7	0	0	0	113.7	I666 V673 K674	I666-F670 PolarHBondContact O-N 2.88Å; F670-V673 PolarHBondContact O-N 3.17Å; F670-K674 PolarHBondContact O-N 2.59Å
671	N	69.8	Low	70.7	Confident	45 Å²	45	69.1 Å²	69.1	24%	0.241	39%	0.393	C	S	.	.	H	α-helix	trans	-65	-40.4	176	-65.2	-28.1	0	0	0	111.3	A667 V673 K674 D675 K759	A667-N671 WeakPolarHBondContact O-CB 3.46Å; A667-N671 PolarHBondContact O-N 2.86Å; A667-N671 PolarHBondContact O-ND2 3.31Å; A667-N671 VanDerWaalsContact O-ND2 3.1Å; N671-V673 VanDerWaalsContact C-N 3.26Å; N671-V673 PolarHBondContact O-N 2.97Å; N671-K674 PolarHBondContact O-N 2.8Å; N671-D675 VanDerWaalsContact O-CG 3.28Å; N671-D675 PolarHBondContact O-N 2.96Å; N671-K759 PolarHBondContact ND2-NZ 2.88Å
672	G	64.9	Low	69.2	Low	22 Å²	22	71.4 Å²	71.4	23%	0.227	41%	0.407	C	S	.	.	H	α-helix	trans	-61.5	-32.2	176.1	0	0	0	0	0	113.8	R668	R668-G672 PolarHBondContact O-N 3.14Å; R668-G672 VanDerWaalsContact O-N 3.08Å
673	V	64.9	Low	68.1	Low	111 Å²	111	81.5 Å²	81.5	67%	0.673	45%	0.445	S	S	*	.	H	α-helix	trans	-73.5	-36	172.7	173.4	0	0	0	0	111.7	I669 F670 N671	I669-V673 WeakPolarHBondContact O-CG2 3.49Å; I669-V673 PolarHBondContact O-N 2.98Å; F670-V673 PolarHBondContact O-N 3.17Å; N671-V673 VanDerWaalsContact C-N 3.26Å; N671-V673 PolarHBondContact O-N 2.97Å
674	K	62.7	Low	67.1	Low	159 Å²	159	87.7 Å²	87.7	69%	0.691	47%	0.473	S	S	*	.	H	α-helix	trans	-73.1	-31.4	-178.7	-163.8	179.7	178.7	-169.9	0	113.3	F670 N671 G676	F670-K674 PolarHBondContact O-N 2.59Å; N671-K674 PolarHBondContact O-N 2.8Å; K674-G676 VanDerWaalsContact C-N 3.25Å; K674-G676 PolarHBondContact O-N 2.99Å
675	D	60.5	Low	66.3	Low	130 Å²	130	88.1 Å²	88.1	70%	0.695	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	10.8	-177.6	-61.5	-23.5	0	0	0	113.4	N671 A677	N671-D675 VanDerWaalsContact O-CG 3.28Å; N671-D675 PolarHBondContact O-N 2.96Å; D675-A677 PolarHBondContact O-N 3.44Å
676	G	54.8	Low	66.1	Low	69 Å²	69	88.6 Å²	88.6	71%	0.711	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	2.2	174.4	0	0	0	0	0	115.8	K674 G678	K674-G676 VanDerWaalsContact C-N 3.25Å; K674-G676 PolarHBondContact O-N 2.99Å; G676-G678 PolarHBondContact O-N 3.28Å
677	A	55	Low	65.9	Low	51 Å²	51	91.5 Å²	91.5	42%	0.421	51%	0.506	S	S	.	.			trans	-81.8	51.7	-179.4	0	0	0	0	0	113.1	D675 T679 V680	D675-A677 PolarHBondContact O-N 3.44Å; A677-T679 PolarHBondContact O-N 3.02Å; A677-V680 PolarHBondContact O-N 3.19Å
678	G	54.6	Low	66.1	Low	77 Å²	77	95.9 Å²	95.9	79%	0.794	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-5.8	-176.3	0	0	0	0	0	116.2	G676	G676-G678 PolarHBondContact O-N 3.28Å
679	T	50.5	Low	66.4	Low	142 Å²	142	94.4 Å²	94.4	87%	0.871	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	-5.4	-175.3	38.9	0	0	0	0	115.3	A677	A677-T679 PolarHBondContact O-N 3.02Å
680	V	55.3	Low	66.8	Low	111 Å²	111	91.9 Å²	91.9	67%	0.673	52%	0.522	S	S	*	.	S	Bend	trans	-117.4	118.4	178.5	-176.6	0	0	0	0	110.7	A677 P682	A677-V680 PolarHBondContact O-N 3.19Å; V680-P682 WeakPolarHBondContact O-CD 3.39Å
681	R	58.1	Low	67.7	Low	234 Å²	234	90.7 Å²	90.7	88%	0.883	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-61.1	123.2	173.7	-74.9	-175.7	178.9	173.3	1	109.5
682	P	61.8	Low	68.8	Low	50 Å²	50	95.7 Å²	95.7	33%	0.325	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-59.4	140.5	178.7	-15.3	21.8	0	0	0	111.6	V680 I685	V680-P682 WeakPolarHBondContact O-CD 3.39Å; P682-I685 HydrophobicContact CB-CD1 3.53Å; P682-I685 HydrophobicContact CB-CG1 4.33Å; P682-I685 HydrophobicContact CG-CD1 3.51Å
683	R	64.3	Low	70	Confident	216 Å²	216	96.9 Å²	96.9	82%	0.815	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	148.8	178.8	-69.3	-178.1	171.7	171.9	-2.6	110.9
684	F	66.4	Low	71.3	Confident	130 Å²	130	91.6 Å²	91.6	57%	0.57	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.3	29.9	177.2	-48.2	-75.9	0	0	0	117.1	R668 S689 I693	R668-F684 VanDerWaalsContact NH1-CB 3.35Å; R668-F684 PolarHBondContact NH2-O 3.47Å; F684-S689 VanDerWaalsContact C-OG 3.26Å; F684-S689 WeakPolarHBondContact CA-OG 3.26Å; F684-S689 PolarHBondContact O-OG 3.05Å; F684-I693 HydrophobicContact CB-CD1 4.26Å
685	I	71.7	Confident	72.7	Confident	48 Å²	48	88.4 Å²	88.4	25%	0.246	50%	0.498	C	S	.	.			trans	-91.3	-12.2	172.9	-68.1	178	0	0	0	112.6	I669 P682 Q690	I669-I685 HydrophobicContact CG1-CD1 3.98Å; P682-I685 HydrophobicContact CB-CD1 3.53Å; P682-I685 HydrophobicContact CB-CG1 4.33Å; P682-I685 HydrophobicContact CG-CD1 3.51Å; I685-Q690 PolarHBondContact O-NE2 3.03Å
686	S	79.4	Confident	74.3	Confident	66 Å²	66	85 Å²	85	46%	0.462	48%	0.484	S	S	.	.	S	Bend	trans	-63.2	140.5	179.1	177.9	0	0	0	0	112.1	S688 S689 Q690	S686-S688 VanDerWaalsContact C-N 3.28Å; S686-S688 PolarHBondContact O-N 2.89Å; S686-S689 PolarHBondContact N-OG 2.93Å; S686-S689 PolarHBondContact O-N 3.24Å; S686-S689 PolarHBondContact O-OG 3.25Å; S686-Q690 PolarHBondContact O-N 3Å
687	P	80.2	Confident	76.1	Confident	81 Å²	81	83.2 Å²	83.2	53%	0.526	46%	0.458	S	S	.	.	H	α-helix	trans	-49.4	-44.4	176.1	-28.7	35.9	0	0	0	113.7	S689 Q690 V691	P687-S689 VanDerWaalsContact C-N 3.33Å; P687-S689 PolarHBondContact O-N 3.39Å; P687-Q690 PolarHBondContact O-N 3.12Å; P687-Q690 VanDerWaalsContact O-N 3.15Å; P687-V691 WeakPolarHBondContact O-CG2 3.46Å; P687-V691 PolarHBondContact O-N 3.35Å
688	S	82.9	Confident	78	Confident	96 Å²	96	81.5 Å²	81.5	67%	0.671	44%	0.441	S	S	*	.	H	α-helix	trans	-63.7	-38.1	179.1	-46.9	0	0	0	0	112.4	S686 Q690 F692	S686-S688 VanDerWaalsContact C-N 3.28Å; S686-S688 PolarHBondContact O-N 2.89Å; S688-Q690 VanDerWaalsContact C-N 3.34Å; S688-F692 PolarHBondContact O-N 2.84Å; S688-F692 VanDerWaalsContact O-N 3.07Å
689	S	85.6	Confident	79.9	Confident	25 Å²	25	80.4 Å²	80.4	18%	0.175	42%	0.422	C	S	.	.	H	α-helix	trans	-69.9	-30.6	176	64	0	0	0	0	113	F684 S686 P687 I693	F684-S689 VanDerWaalsContact C-OG 3.26Å; F684-S689 WeakPolarHBondContact CA-OG 3.26Å; F684-S689 PolarHBondContact O-OG 3.05Å; S686-S689 PolarHBondContact N-OG 2.93Å; S686-S689 PolarHBondContact O-N 3.24Å; S686-S689 PolarHBondContact O-OG 3.25Å; P687-S689 VanDerWaalsContact C-N 3.33Å; P687-S689 PolarHBondContact O-N 3.39Å; S689-I693 WeakPolarHBondContact O-CD1 3.27Å; S689-I693 VanDerWaalsContact O-CG1 3.24Å; S689-I693 WeakPolarHBondContact O-CG1 3.28Å; S689-I693 PolarHBondContact O-N 2.88Å; S689-I693 VanDerWaalsContact O-N 3.1Å
690	Q	87.4	Confident	82	Confident	7 Å²	7	76.7 Å²	76.7	3%	0.033	40%	0.399	C	S	.	.	H	α-helix	trans	-72.3	-42.7	176.4	-68.1	174.4	12.8	0	0	111.6	L614 T661 R665 I685 S686 P687 S688 F692 I693 C694	L614-Q690 HydrophobicContact CD1-CB 4.14Å; L614-Q690 HydrophobicContact CD2-CB 4.46Å; T661-Q690 HydrophobicContact CG2-CB 3.93Å; T661-Q690 HydrophobicContact CG2-CG 4.41Å; T661-Q690 WeakPolarHBondContact CG2-O 3.35Å; R665-Q690 VanDerWaalsContact CD-NE2 3.27Å; I685-Q690 PolarHBondContact O-NE2 3.03Å; S686-Q690 PolarHBondContact O-N 3Å; P687-Q690 PolarHBondContact O-N 3.12Å; P687-Q690 VanDerWaalsContact O-N 3.15Å; S688-Q690 VanDerWaalsContact C-N 3.34Å; Q690-F692 VanDerWaalsContact C-N 3.32Å; Q690-F692 PolarHBondContact O-N 3.21Å; Q690-I693 PolarHBondContact O-N 3.26Å; Q690-C694 WeakPolarHBondContact O-CB 3.42Å; Q690-C694 PolarHBondContact O-N 3.29Å
691	V	91.1	Very high	83.8	Confident	34 Å²	34	71.4 Å²	71.4	21%	0.206	37%	0.367	C	S	.	.	H	α-helix	trans	-61.5	-43.6	174.6	173.6	0	0	0	0	110.3	E613 I617 P687 I693 C694 L695	E613-V691 HydrophobicContact CB-CG2 3.5Å; E613-V691 VanDerWaalsContact CB-CG2 3.5Å; E613-V691 HydrophobicContact CG-CG2 4.08Å; I617-V691 HydrophobicContact CD1-CG1 4.27Å; I617-V691 HydrophobicContact CD1-CG2 4.4Å; P687-V691 WeakPolarHBondContact O-CG2 3.46Å; P687-V691 PolarHBondContact O-N 3.35Å; V691-I693 PolarHBondContact O-N 3.36Å; V691-C694 PolarHBondContact O-N 3.49Å; V691-L695 HydrophobicContact CG1-CD1 3.71Å; V691-L695 HydrophobicContact CG1-CG 4.14Å; V691-L695 WeakPolarHBondContact O-CB 3.34Å; V691-L695 WeakPolarHBondContact O-CG 3.31Å; V691-L695 PolarHBondContact O-N 3.19Å
692	F	92	Very high	85.4	Confident	151 Å²	151	63.8 Å²	63.8	66%	0.662	34%	0.343	S	S	*	.	H	α-helix	trans	-60.1	-45.6	176.3	-175.5	-96.8	0	0	0	112.9	S688 Q690 C694 L695 S696	S688-F692 PolarHBondContact O-N 2.84Å; S688-F692 VanDerWaalsContact O-N 3.07Å; Q690-F692 VanDerWaalsContact C-N 3.32Å; Q690-F692 PolarHBondContact O-N 3.21Å; F692-C694 VanDerWaalsContact C-N 3.34Å; F692-C694 PolarHBondContact O-N 3.13Å; F692-L695 PolarHBondContact O-N 3.26Å; F692-S696 VanDerWaalsContact O-CB 3.32Å; F692-S696 WeakPolarHBondContact O-CB 3.35Å; F692-S696 PolarHBondContact O-N 3.28Å
693	I	90.3	Very high	86.8	Confident	46 Å²	46	65.8 Å²	65.8	24%	0.236	35%	0.354	C	S	.	.	H	α-helix	trans	-60.9	-44.5	176.1	-70	163.9	0	0	0	110.8	F684 S689 Q690 V691 S696 M697	F684-I693 HydrophobicContact CB-CD1 4.26Å; S689-I693 WeakPolarHBondContact O-CD1 3.27Å; S689-I693 VanDerWaalsContact O-CG1 3.24Å; S689-I693 WeakPolarHBondContact O-CG1 3.28Å; S689-I693 PolarHBondContact O-N 2.88Å; S689-I693 VanDerWaalsContact O-N 3.1Å; Q690-I693 PolarHBondContact O-N 3.26Å; V691-I693 PolarHBondContact O-N 3.36Å; I693-S696 PolarHBondContact O-N 3.36Å; I693-M697 HydrophobicContact CG2-CE 3.82Å; I693-M697 PolarHBondContact O-N 3.32Å; I693-M697 VanDerWaalsContact O-N 3.15Å
694	C	93.1	Very high	88	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-63	-48.4	178.8	-175.3	0	0	0	0	111.9	L614 T661 Q690 V691 F692 S696 M697 I698	L614-C694 HydrophobicContact CD2-CB 3.94Å; T661-C694 HydrophobicContact CG2-CB 4.42Å; Q690-C694 WeakPolarHBondContact O-CB 3.42Å; Q690-C694 PolarHBondContact O-N 3.29Å; V691-C694 PolarHBondContact O-N 3.49Å; F692-C694 VanDerWaalsContact C-N 3.34Å; F692-C694 PolarHBondContact O-N 3.13Å; C694-S696 VanDerWaalsContact C-N 3.31Å; C694-S696 PolarHBondContact O-N 2.97Å; C694-M697 PolarHBondContact O-N 3.1Å; C694-I698 WeakPolarHBondContact O-CG1 3.18Å; C694-I698 PolarHBondContact O-N 2.78Å
695	L	92.4	Very high	89.1	Confident	92 Å²	92	54.2 Å²	54.2	48%	0.482	31%	0.313	S	S	.	.	H	α-helix	trans	-64.4	-35.3	177.6	-70.6	175.9	0	0	0	112.3	V691 F692 I698 S699	V691-L695 HydrophobicContact CG1-CD1 3.71Å; V691-L695 HydrophobicContact CG1-CG 4.14Å; V691-L695 WeakPolarHBondContact O-CB 3.34Å; V691-L695 WeakPolarHBondContact O-CG 3.31Å; V691-L695 PolarHBondContact O-N 3.19Å; F692-L695 PolarHBondContact O-N 3.26Å; L695-I698 HydrophobicContact CD2-CD1 4.39Å; L695-I698 PolarHBondContact O-N 2.92Å; L695-S699 WeakPolarHBondContact O-CB 3.32Å; L695-S699 PolarHBondContact O-N 3.07Å
696	S	92.8	Very high	89.8	Confident	58 Å²	58	54.6 Å²	54.6	41%	0.406	32%	0.319	S	S	.	.	H	α-helix	trans	-62.2	-43.7	174.6	175.9	0	0	0	0	111.6	F692 I693 C694 S699 V700	F692-S696 VanDerWaalsContact O-CB 3.32Å; F692-S696 WeakPolarHBondContact O-CB 3.35Å; F692-S696 PolarHBondContact O-N 3.28Å; I693-S696 PolarHBondContact O-N 3.36Å; C694-S696 VanDerWaalsContact C-N 3.31Å; C694-S696 PolarHBondContact O-N 2.97Å; S696-S699 PolarHBondContact O-N 3.26Å; S696-S699 PolarHBondContact O-OG 3.19Å; S696-V700 PolarHBondContact O-N 3.37Å
697	M	93.6	Very high	90.3	Very high	32 Å²	32	55 Å²	55	16%	0.158	32%	0.319	C	S	.	.	H	α-helix	trans	-65.5	-39.4	175.5	-68.3	-178.4	-68.9	0	0	112	A657 L660 T661 I693 C694 S699 V700 Y745 L749	A657-M697 HydrophobicContact CB-CB 3.87Å; A657-M697 HydrophobicContact CB-CE 4.19Å; L660-M697 HydrophobicContact CD2-SD 3.77Å; L660-M697 HydrophobicContact CG-SD 4.45Å; T661-M697 WeakPolarHBondContact OG1-CE 3.47Å; I693-M697 HydrophobicContact CG2-CE 3.82Å; I693-M697 PolarHBondContact O-N 3.32Å; I693-M697 VanDerWaalsContact O-N 3.15Å; C694-M697 PolarHBondContact O-N 3.1Å; M697-S699 VanDerWaalsContact C-N 3.34Å; M697-S699 PolarHBondContact O-N 2.9Å; M697-V700 PolarHBondContact O-N 2.7Å; M697-Y745 PolarHBondContact O-OH 3.39Å; M697-Y745 VanDerWaalsContact O-OH 3.13Å; M697-L749 HydrophobicContact SD-CD2 4.49Å
698	I	94.9	Very high	90.6	Very high	15 Å²	15	55.1 Å²	55.1	8%	0.077	31%	0.309	C	S	.	.	H	α-helix	trans	-63.2	-40.6	175.3	-64.7	163.2	0	0	0	111.2	I617 V654 A657 C694 L695 V700 Q701 L702	I617-I698 HydrophobicContact CG2-CD1 4.15Å; V654-I698 HydrophobicContact CB-CD1 4.42Å; V654-I698 HydrophobicContact CG1-CD1 4.43Å; V654-I698 HydrophobicContact CG2-CD1 4.09Å; V654-I698 HydrophobicContact CG2-CG1 4.23Å; V654-I698 HydrophobicContact CG2-CG2 4.03Å; A657-I698 HydrophobicContact CB-CD1 4.46Å; A657-I698 HydrophobicContact CB-CG1 3.85Å; C694-I698 WeakPolarHBondContact O-CG1 3.18Å; C694-I698 PolarHBondContact O-N 2.78Å; L695-I698 HydrophobicContact CD2-CD1 4.39Å; L695-I698 PolarHBondContact O-N 2.92Å; I698-V700 VanDerWaalsContact C-N 3.26Å; I698-V700 PolarHBondContact O-N 2.87Å; I698-Q701 PolarHBondContact O-N 3.01Å; I698-L702 HydrophobicContact CG2-CD1 4.11Å; I698-L702 PolarHBondContact O-N 3.02Å; I698-L702 VanDerWaalsContact O-N 3.15Å
699	S	93.6	Very high	90.7	Very high	55 Å²	55	52.4 Å²	52.4	39%	0.385	29%	0.287	S	S	.	.	H	α-helix	trans	-63.5	-30.5	179.7	69.2	0	0	0	0	113.4	L695 S696 M697 L702 V703	L695-S699 WeakPolarHBondContact O-CB 3.32Å; L695-S699 PolarHBondContact O-N 3.07Å; S696-S699 PolarHBondContact O-N 3.26Å; S696-S699 PolarHBondContact O-OG 3.19Å; M697-S699 VanDerWaalsContact C-N 3.34Å; M697-S699 PolarHBondContact O-N 2.9Å; S699-L702 PolarHBondContact O-N 3.24Å; S699-V703 WeakPolarHBondContact O-CG2 3.11Å; S699-V703 PolarHBondContact O-N 2.84Å
700	V	94.3	Very high	90.7	Very high	63 Å²	63	58.1 Å²	58.1	38%	0.382	32%	0.315	S	S	.	.	H	α-helix	trans	-61.7	-47.3	176.3	172.4	0	0	0	0	110.1	S696 M697 I698 V703 M704 Y745	S696-V700 PolarHBondContact O-N 3.37Å; M697-V700 PolarHBondContact O-N 2.7Å; I698-V700 VanDerWaalsContact C-N 3.26Å; I698-V700 PolarHBondContact O-N 2.87Å; V700-V703 PolarHBondContact O-N 3.31Å; V700-M704 HydrophobicContact CG1-SD 4.15Å; V700-M704 WeakPolarHBondContact O-CG 3.44Å; V700-M704 PolarHBondContact O-N 3.19Å; V700-Y745 HydrophobicContact CB-CE1 4.46Å; V700-Y745 HydrophobicContact CB-CE2 4.39Å; V700-Y745 HydrophobicContact CG1-CD2 4.24Å; V700-Y745 HydrophobicContact CG1-CE1 4.42Å; V700-Y745 HydrophobicContact CG1-CE2 3.75Å
701	Q	93.5	Very high	90.6	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-63.3	-44.4	177.1	-174.5	62.2	9.8	0	0	111.8	A653 I698 V703 M704 V705 S742 Y745	A653-Q701 HydrophobicContact CB-CB 3.69Å; A653-Q701 HydrophobicContact CB-CG 3.76Å; I698-Q701 PolarHBondContact O-N 3.01Å; Q701-V703 VanDerWaalsContact C-N 3.34Å; Q701-V703 PolarHBondContact O-N 3.19Å; Q701-M704 PolarHBondContact O-N 3.01Å; Q701-V705 HydrophobicContact CG-CG2 4.32Å; Q701-V705 WeakPolarHBondContact O-CG2 3.47Å; Q701-V705 PolarHBondContact O-N 2.78Å; Q701-S742 PolarHBondContact NE2-O 3.48Å; Q701-S742 VanDerWaalsContact NE2-O 3.13Å; Q701-Y745 HydrophobicContact CB-CD1 3.83Å; Q701-Y745 HydrophobicContact CB-CE1 4Å; Q701-Y745 HydrophobicContact CG-CD1 4.36Å
702	L	91.4	Very high	90.2	Very high	73 Å²	73	65.8 Å²	65.8	38%	0.382	35%	0.352	S	S	.	.	H	α-helix	trans	-60.1	-42.8	179.7	-76.1	172.5	0	0	0	112.4	T650 I698 S699 S706	T650-L702 HydrophobicContact CG2-CD2 3.65Å; T650-L702 HydrophobicContact CG2-CG 4.26Å; I698-L702 HydrophobicContact CG2-CD1 4.11Å; I698-L702 PolarHBondContact O-N 3.02Å; I698-L702 VanDerWaalsContact O-N 3.15Å; S699-L702 PolarHBondContact O-N 3.24Å; L702-S706 VanDerWaalsContact O-CB 3.25Å; L702-S706 WeakPolarHBondContact O-CB 3.26Å; L702-S706 PolarHBondContact O-N 3.05Å; L702-S706 PolarHBondContact O-OG 2.98Å
703	V	91.9	Very high	89.8	Confident	92 Å²	92	64.1 Å²	64.1	56%	0.558	35%	0.354	S	S	*	.	H	α-helix	trans	-65.9	-45.5	177.2	172	0	0	0	0	110.7	S699 V700 Q701 V705 S706 V707	S699-V703 WeakPolarHBondContact O-CG2 3.11Å; S699-V703 PolarHBondContact O-N 2.84Å; V700-V703 PolarHBondContact O-N 3.31Å; Q701-V703 VanDerWaalsContact C-N 3.34Å; Q701-V703 PolarHBondContact O-N 3.19Å; V703-V705 PolarHBondContact O-N 3.04Å; V703-S706 PolarHBondContact O-N 3.3Å; V703-V707 HydrophobicContact CG1-CG2 4.4Å; V703-V707 WeakPolarHBondContact O-CG2 3.36Å; V703-V707 PolarHBondContact O-N 2.8Å
704	M	89.4	Confident	89.5	Confident	99 Å²	99	63.3 Å²	63.3	49%	0.488	35%	0.351	S	S	.	.	H	α-helix	trans	-56.6	-49.7	178.3	-75.1	179.7	63.5	0	0	111.8	V700 Q701 W708 Y745	V700-M704 HydrophobicContact CG1-SD 4.15Å; V700-M704 WeakPolarHBondContact O-CG 3.44Å; V700-M704 PolarHBondContact O-N 3.19Å; Q701-M704 PolarHBondContact O-N 3.01Å; M704-W708 WeakPolarHBondContact O-CB 3.26Å; M704-W708 PolarHBondContact O-N 3.39Å; M704-W708 VanDerWaalsContact O-N 3.08Å; M704-Y745 HydrophobicContact SD-CG 4.45Å
705	V	88.6	Confident	89.1	Confident	5 Å²	5	64.1 Å²	64.1	3%	0.03	36%	0.36	C	S	.	.	H	α-helix	trans	-72	-32.2	-178.2	-173.1	0	0	0	0	111.8	R645 L646 Q701 V703 W708 L709	R645-V705 WeakPolarHBondContact O-CG1 3.48Å; L646-V705 HydrophobicContact CD2-CB 4.43Å; L646-V705 HydrophobicContact CD2-CG1 3.84Å; Q701-V705 HydrophobicContact CG-CG2 4.32Å; Q701-V705 WeakPolarHBondContact O-CG2 3.47Å; Q701-V705 PolarHBondContact O-N 2.78Å; V703-V705 PolarHBondContact O-N 3.04Å; V705-W708 PolarHBondContact O-N 3.35Å; V705-L709 WeakPolarHBondContact O-CB 3.46Å; V705-L709 PolarHBondContact O-N 3.22Å
706	S	88.1	Confident	88.7	Confident	55 Å²	55	62.6 Å²	62.6	39%	0.385	36%	0.355	S	S	.	.	H	α-helix	trans	-66.2	-44.2	175.6	-60.2	0	0	0	0	112.2	L702 V703 W708 L709 L710	L702-S706 VanDerWaalsContact O-CB 3.25Å; L702-S706 WeakPolarHBondContact O-CB 3.26Å; L702-S706 PolarHBondContact O-N 3.05Å; L702-S706 PolarHBondContact O-OG 2.98Å; V703-S706 PolarHBondContact O-N 3.3Å; S706-W708 VanDerWaalsContact C-N 3.3Å; S706-W708 PolarHBondContact O-N 3.33Å; S706-L709 WeakPolarHBondContact O-CB 3.34Å; S706-L709 PolarHBondContact O-N 3.43Å; S706-L710 PolarHBondContact O-N 3.49Å
707	V	89.1	Confident	88.2	Confident	76 Å²	76	66.9 Å²	66.9	46%	0.461	36%	0.362	S	S	.	.	H	α-helix	trans	-61.7	-42.5	173.9	172.1	0	0	0	0	110.4	V703 L709 L710 L711	V703-V707 HydrophobicContact CG1-CG2 4.4Å; V703-V707 WeakPolarHBondContact O-CG2 3.36Å; V703-V707 PolarHBondContact O-N 2.8Å; V707-L709 VanDerWaalsContact C-N 3.3Å; V707-L709 PolarHBondContact O-N 3.24Å; V707-L710 PolarHBondContact O-N 3.39Å; V707-L710 VanDerWaalsContact O-N 3.12Å; V707-L711 HydrophobicContact CG1-CD1 4.15Å; V707-L711 HydrophobicContact CG1-CG 4.49Å; V707-L711 WeakPolarHBondContact O-CG 3.48Å; V707-L711 PolarHBondContact O-N 2.93Å; V707-L711 VanDerWaalsContact O-N 3.11Å
708	W	86.2	Confident	87.5	Confident	83 Å²	83	72.5 Å²	72.5	31%	0.314	38%	0.381	S	S	.	.	H	α-helix	trans	-63.6	-34.2	178.9	-161.1	-100.4	0	0	0	112.4	R645 M704 V705 S706 L710 L711 E712 S738 L741	R645-W708 VanDerWaalsContact NE-CD1 3.28Å; R645-W708 PolarHBondContact NH1-O 3.42Å; R645-W708 PolarHBondContact NH2-O 3.19Å; M704-W708 WeakPolarHBondContact O-CB 3.26Å; M704-W708 PolarHBondContact O-N 3.39Å; M704-W708 VanDerWaalsContact O-N 3.08Å; V705-W708 PolarHBondContact O-N 3.35Å; S706-W708 VanDerWaalsContact C-N 3.3Å; S706-W708 PolarHBondContact O-N 3.33Å; W708-L710 VanDerWaalsContact C-N 3.35Å; W708-L711 PolarHBondContact O-N 3.23Å; W708-E712 PolarHBondContact O-N 3.48Å; W708-E712 VanDerWaalsContact O-N 3.16Å; W708-S738 PolarHBondContact NE1-OG 2.91Å; W708-L741 HydrophobicContact CH2-CD2 3.51Å; W708-L741 HydrophobicContact CZ2-CD2 4.08Å; W708-L741 HydrophobicContact CZ3-CD2 4.24Å
709	L	86.1	Confident	86.6	Confident	38 Å²	38	75.8 Å²	75.8	20%	0.199	40%	0.395	C	S	.	.	H	α-helix	trans	-67.2	-31.2	173.4	-164.6	74	0	0	0	113.4	A642 L646 V705 S706 V707 E712 P714	A642-L709 HydrophobicContact CB-CD1 4.16Å; L646-L709 HydrophobicContact CD1-CD2 4.23Å; L646-L709 HydrophobicContact CD2-CD2 4.35Å; L646-L709 HydrophobicContact CG-CD2 4.35Å; V705-L709 WeakPolarHBondContact O-CB 3.46Å; V705-L709 PolarHBondContact O-N 3.22Å; S706-L709 WeakPolarHBondContact O-CB 3.34Å; S706-L709 PolarHBondContact O-N 3.43Å; V707-L709 VanDerWaalsContact C-N 3.3Å; V707-L709 PolarHBondContact O-N 3.24Å; L709-E712 CarbonylContact O-C 3.49Å; L709-E712 VanDerWaalsContact O-O 3.07Å; L709-P714 HydrophobicContact CD1-CB 4.25Å; L709-P714 HydrophobicContact CD1-CG 3.91Å; L709-P714 HydrophobicContact CG-CG 4.49Å
710	L	85.3	Confident	85.4	Confident	146 Å²	146	75.1 Å²	75.1	76%	0.764	39%	0.389	S	S	*	.	H	α-helix	trans	-76.7	-35.4	176.4	-66.5	171.8	0	0	0	112.2	S706 V707 W708	S706-L710 PolarHBondContact O-N 3.49Å; V707-L710 PolarHBondContact O-N 3.39Å; V707-L710 VanDerWaalsContact O-N 3.12Å; W708-L710 VanDerWaalsContact C-N 3.35Å
711	L	85.8	Confident	84.1	Confident	132 Å²	132	75.5 Å²	75.5	69%	0.691	39%	0.388	S	S	*	.	H	α-helix	trans	-74.6	-38	-179.5	-67.4	176	0	0	0	113	V707 W708	V707-L711 HydrophobicContact CG1-CD1 4.15Å; V707-L711 HydrophobicContact CG1-CG 4.49Å; V707-L711 WeakPolarHBondContact O-CG 3.48Å; V707-L711 PolarHBondContact O-N 2.93Å; V707-L711 VanDerWaalsContact O-N 3.11Å; W708-L711 PolarHBondContact O-N 3.23Å
712	E	82.5	Confident	82.6	Confident	70 Å²	70	81.5 Å²	81.5	33%	0.327	43%	0.427	S	S	.	.	S	Bend	trans	-120	108.4	172.3	-52.1	174.7	145.1	0	0	109.4	R645 W708 L709 S738	R645-E712 IonicContact CZ-OE2 3.7Å; R645-E712 PolarHBondContact NH1-O 2.94Å; R645-E712 IonicContact NH2-OE2 3.23Å; R645-E712 PolarHBondContact NH2-OE2 3.45Å; W708-E712 PolarHBondContact O-N 3.48Å; W708-E712 VanDerWaalsContact O-N 3.16Å; L709-E712 CarbonylContact O-C 3.49Å; L709-E712 VanDerWaalsContact O-O 3.07Å; E712-S738 PolarHBondContact OE2-OG 3.23Å
713	V	83.6	Confident	81.2	Confident	115 Å²	115	87 Å²	87	70%	0.697	45%	0.451	S	S	*	.			trans	-65.5	129.1	-177.2	-179	0	0	0	0	110.4	G715	V713-G715 PolarHBondContact O-N 2.96Å
714	P	82.8	Confident	79.9	Confident	29 Å²	29	91.7 Å²	91.7	19%	0.188	46%	0.459	C	S	.	.			trans	-67.7	123.1	177.3	28.8	-34.9	0	0	0	110.4	C641 A642 L709	C641-P714 HydrophobicContact CB-CB 4.49Å; A642-P714 HydrophobicContact CB-CB 3.99Å; A642-P714 HydrophobicContact CB-CG 3.85Å; L709-P714 HydrophobicContact CD1-CB 4.25Å; L709-P714 HydrophobicContact CD1-CG 3.91Å; L709-P714 HydrophobicContact CG-CG 4.49Å
715	G	84.2	Confident	78.7	Confident	17 Å²	17	93 Å²	93	18%	0.175	46%	0.458	C	S	.	.			trans	-141.5	-177.4	175.4	0	0	0	0	0	111.8	V713 N733	V713-G715 PolarHBondContact O-N 2.96Å; G715-N733 WeakPolarHBondContact O-CB 3.4Å; G715-N733 PolarHBondContact O-N 3.47Å
716	T	85.6	Confident	77.6	Confident	61 Å²	61	98.8 Å²	98.8	37%	0.374	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	144.9	173.2	50	0	0	0	0	109.7	P636 K731	P636-T716 HydrophobicContact CB-CG2 4.28Å; T716-K731 CarbonylContact C-O 3.5Å; T716-K731 WeakPolarHBondContact CA-O 3.35Å
717	R	80.9	Confident	76.9	Confident	148 Å²	148	99 Å²	99	56%	0.558	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.7	132.2	177.3	-173.7	177.1	-177.4	-175.8	1.6	109.5	K731 N733	R717-K731 PolarHBondContact N-O 3.46Å; R717-K731 PolarHBondContact O-N 3.43Å; R717-N733 HydrophobicContact CB-CB 4.28Å
718	R	80.3	Confident	76.6	Confident	149 Å²	149	95.4 Å²	95.4	56%	0.562	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.1	128.2	169.3	-70.6	178.5	178.4	167.8	-2.1	108.8	E567 V728 L730	E567-R718 IonicContact OE1-CZ 3.62Å; E567-R718 IonicContact OE1-NE 2.78Å; E567-R718 PolarHBondContact OE1-NE 3.43Å; E567-R718 IonicContact OE1-NH2 3.66Å; E567-R718 PolarHBondContact OE1-NH2 2.84Å; R718-V728 HydrophobicContact CB-CG1 3.63Å; R718-V728 HydrophobicContact CG-CG1 3.8Å; R718-L730 HydrophobicContact CG-CD1 4.37Å
719	F	74.6	Confident	76.5	Confident	85 Å²	85	92.2 Å²	92.2	37%	0.373	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	125.5	-177.6	-172.7	-93.8	0	0	0	110.1	L721 I729	F719-L721 HydrophobicContact CD1-CD1 4.39Å; F719-L721 HydrophobicContact CE1-CD1 4.28Å; F719-L721 HydrophobicContact CE1-CG 4.25Å; F719-I729 PolarHBondContact N-O 3.33Å; F719-I729 PolarHBondContact O-N 3.26Å
720	T	68.8	Low	76.4	Confident	41 Å²	41	90.9 Å²	90.9	25%	0.252	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	130.8	176.8	51.8	0	0	0	0	109.3	V728	T720-V728 HydrophobicContact CG2-CG2 3.87Å
721	L	68.1	Low	76.3	Confident	71 Å²	71	87.1 Å²	87.1	37%	0.372	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	137.9	172.3	-80.3	91.2	0	0	0	110	F719 E723 R724 R725 I729	F719-L721 HydrophobicContact CD1-CD1 4.39Å; F719-L721 HydrophobicContact CE1-CD1 4.28Å; F719-L721 HydrophobicContact CE1-CG 4.25Å; L721-E723 VanDerWaalsContact C-N 3.26Å; L721-E723 PolarHBondContact O-N 3.37Å; L721-R724 CarbonylContact O-C 3.53Å; L721-R724 VanDerWaalsContact O-C 3.24Å; L721-R724 PolarHBondContact O-N 3.2Å; L721-R724 VanDerWaalsContact O-N 3.09Å; L721-R725 PolarHBondContact O-N 3.15Å; L721-I729 HydrophobicContact CD1-CD1 3.44Å; L721-I729 VanDerWaalsContact CD1-CD1 3.44Å; L721-I729 HydrophobicContact CD1-CG1 4.49Å
722	P	62.1	Low	76.3	Confident	127 Å²	127	82.2 Å²	82.2	83%	0.825	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-37.2	177.8	-25.3	33.4	0	0	0	113.9
723	E	61.8	Low	76.3	Confident	189 Å²	189	83 Å²	83	88%	0.883	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-19.5	178.3	-80.6	-177.3	147.1	0	0	114.3	L721	L721-E723 VanDerWaalsContact C-N 3.26Å; L721-E723 PolarHBondContact O-N 3.37Å
724	R	63.5	Low	76	Confident	190 Å²	190	80 Å²	80	72%	0.717	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.5	70.4	-178.7	-73.2	-167.5	-178.6	168.5	1.5	110.3	L721 Q726 T727	L721-R724 CarbonylContact O-C 3.53Å; L721-R724 VanDerWaalsContact O-C 3.24Å; L721-R724 PolarHBondContact O-N 3.2Å; L721-R724 VanDerWaalsContact O-N 3.09Å; R724-Q726 PolarHBondContact O-N 3.18Å; R724-Q726 VanDerWaalsContact O-N 3.13Å; R724-T727 PolarHBondContact O-N 2.87Å
725	R	64.4	Low	75.6	Confident	125 Å²	125	87.4 Å²	87.4	47%	0.472	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	-9.4	-178	-140	178.1	-164.2	-175.5	-0.3	113.7	H537 W554 L565 L721	H537-R725 PolarHBondContact CD2-NH1 3.3Å; H537-R725 PolarHBondContact CE1-NH1 3Å; H537-R725 PolarHBondContact NE2-NH1 2.88Å; W554-R725 HydrophobicContact CZ3-CB 4.08Å; L565-R725 VanDerWaalsContact CD1-O 3.24Å; L565-R725 WeakPolarHBondContact CD1-O 3.5Å; L721-R725 PolarHBondContact O-N 3.15Å
726	Q	66.9	Low	75	Confident	128 Å²	128	90.3 Å²	90.3	60%	0.598	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.6	-5.1	-180	-66.3	178.6	-21	0	0	114.6	W554 L565 R724	W554-Q726 HydrophobicContact CE3-CG 4.38Å; W554-Q726 HydrophobicContact CH2-CG 3.87Å; W554-Q726 HydrophobicContact CZ2-CG 4.23Å; W554-Q726 HydrophobicContact CZ3-CG 3.96Å; L565-Q726 WeakPolarHBondContact CD2-O 3.46Å; R724-Q726 PolarHBondContact O-N 3.18Å; R724-Q726 VanDerWaalsContact O-N 3.13Å
727	T	73.1	Confident	74.5	Confident	58 Å²	58	90.8 Å²	90.8	36%	0.356	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	138.3	177.9	59.4	0	0	0	0	111.8	R724	R724-T727 PolarHBondContact O-N 2.87Å
728	V	81.8	Confident	74.4	Confident	2 Å²	2	84 Å²	84	1%	0.012	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	111.9	179.1	179.7	0	0	0	0	108.9	L565 E567 D568 R718 T720	L565-V728 HydrophobicContact CB-CG2 3.73Å; L565-V728 HydrophobicContact CD1-CG2 4.18Å; E567-V728 CarbonylContact C-O 3.45Å; E567-V728 WeakPolarHBondContact CA-O 3.32Å; D568-V728 PolarHBondContact N-O 3.5Å; R718-V728 HydrophobicContact CB-CG1 3.63Å; R718-V728 HydrophobicContact CG-CG1 3.8Å; T720-V728 HydrophobicContact CG2-CG2 3.87Å
729	I	83.9	Confident	74.2	Confident	15 Å²	15	78.9 Å²	78.9	8%	0.077	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	127.3	177.8	-54.9	174.2	0	0	0	109.1	F719 L721 K731 Y798	F719-I729 PolarHBondContact N-O 3.33Å; F719-I729 PolarHBondContact O-N 3.26Å; L721-I729 HydrophobicContact CD1-CD1 3.44Å; L721-I729 VanDerWaalsContact CD1-CD1 3.44Å; L721-I729 HydrophobicContact CD1-CG1 4.49Å; I729-K731 HydrophobicContact CG2-CG 4.03Å; I729-Y798 HydrophobicContact CD1-CD1 4.23Å; I729-Y798 HydrophobicContact CD1-CE1 4.01Å; I729-Y798 HydrophobicContact CG1-CE1 4.33Å; I729-Y798 HydrophobicContact CG2-CD1 3.87Å; I729-Y798 HydrophobicContact CG2-CE1 3.64Å; I729-Y798 HydrophobicContact CG2-CE2 4.36Å; I729-Y798 HydrophobicContact CG2-CG 4.32Å
730	L	84.1	Confident	74.4	Confident	10 Å²	10	75.9 Å²	75.9	5%	0.052	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	115.1	176	-172.6	68.1	0	0	0	110.6	D568 K635 P636 R718	D568-L730 PolarHBondContact O-N 3.38Å; D568-L730 VanDerWaalsContact O-N 3.11Å; K635-L730 HydrophobicContact CG-CD2 4.43Å; P636-L730 HydrophobicContact CB-CD2 4.28Å; P636-L730 HydrophobicContact CB-CG 4.23Å; P636-L730 HydrophobicContact CG-CG 4.44Å; R718-L730 HydrophobicContact CG-CD1 4.37Å
731	K	83.9	Confident	75	Confident	67 Å²	67	79.4 Å²	79.4	29%	0.291	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	160	176.8	-64.9	-171.7	178.6	-173.2	0	111.7	T716 R717 I729	T716-K731 CarbonylContact C-O 3.5Å; T716-K731 WeakPolarHBondContact CA-O 3.35Å; R717-K731 PolarHBondContact N-O 3.46Å; R717-K731 PolarHBondContact O-N 3.43Å; I729-K731 HydrophobicContact CG2-CG 4.03Å
732	C	85.8	Confident	75.7	Confident	29 Å²	29	76.9 Å²	76.9	20%	0.196	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	141.9	164.5	-68.4	0	0	0	0	109.7	C641 V734	C641-C732 VanDerWaalsContact CA-SG 3.57Å; C641-C732 HydrophobicContact CB-CB 3.79Å; C641-C732 WeakPolarHBondContact CB-SG 3.47Å; C641-C732 VanDerWaalsContact SG-CA 3.51Å; C641-C732 WeakPolarHBondContact SG-CB 3.5Å; C641-C732 CovalentContact SG-SG 2.03Å; C641-C732 PolarHBondContact SG-SG 2.7Å; C732-V734 HydrophobicContact CB-CG2 4.28Å; C732-V734 PolarHBondContact O-N 3.27Å
733	N	83	Confident	76.8	Confident	87 Å²	87	71.2 Å²	71.2	47%	0.465	34%	0.341	S	S	.	.	S	Bend	trans	-77.2	71.2	177.6	-173.2	27.5	0	0	0	110.5	G715 R717	G715-N733 WeakPolarHBondContact O-CB 3.4Å; G715-N733 PolarHBondContact O-N 3.47Å; R717-N733 HydrophobicContact CB-CB 4.28Å
734	V	75.9	Confident	78.1	Confident	51 Å²	51	64.2 Å²	64.2	31%	0.309	32%	0.32	S	S	.	.			trans	-138.8	141.9	-177.9	-179.4	0	0	0	0	108.5	C732	C732-V734 HydrophobicContact CB-CG2 4.28Å; C732-V734 PolarHBondContact O-N 3.27Å
735	R	76.1	Confident	79.5	Confident	186 Å²	186	56.7 Å²	56.7	70%	0.702	29%	0.292	S	S	*	.			trans	-77	133.2	170.1	-71.8	177.4	165.6	168.9	-4.5	109.4	S737 S738	R735-S737 PolarHBondContact O-N 3.47Å; R735-S737 VanDerWaalsContact O-N 3.11Å; R735-S738 WeakPolarHBondContact O-CA 3.45Å; R735-S738 VanDerWaalsContact O-CB 3.25Å; R735-S738 WeakPolarHBondContact O-CB 3.19Å; R735-S738 PolarHBondContact O-N 3.14Å
736	D	70.4	Confident	80.7	Confident	78 Å²	78	50.9 Å²	50.9	42%	0.417	27%	0.27	S	S	.	.	H	α-helix	trans	-55	-35.2	-179.7	-63.2	-24	0	0	0	112.8	S738 M739	D736-S738 VanDerWaalsContact C-N 3.32Å; D736-S738 PolarHBondContact O-N 3.41Å; D736-M739 PolarHBondContact O-N 2.96Å
737	S	74.6	Confident	81.9	Confident	71 Å²	71	48.2 Å²	48.2	50%	0.497	26%	0.263	S	S	.	.	H	α-helix	trans	-65.1	-30.4	174.6	54.7	0	0	0	0	113.9	R735 M739 L740 L741	R735-S737 PolarHBondContact O-N 3.47Å; R735-S737 VanDerWaalsContact O-N 3.11Å; S737-M739 VanDerWaalsContact C-N 3.34Å; S737-L740 PolarHBondContact O-N 3.36Å; S737-L741 WeakPolarHBondContact O-CB 3.41Å; S737-L741 PolarHBondContact O-N 3.16Å
738	S	78.9	Confident	82.8	Confident	6 Å²	6	49.7 Å²	49.7	4%	0.042	27%	0.268	C	S	.	.	H	α-helix	trans	-67.3	-36.6	177.9	176.1	0	0	0	0	111.6	W708 E712 R735 D736 L741 S742	W708-S738 PolarHBondContact NE1-OG 2.91Å; E712-S738 PolarHBondContact OE2-OG 3.23Å; R735-S738 WeakPolarHBondContact O-CA 3.45Å; R735-S738 VanDerWaalsContact O-CB 3.25Å; R735-S738 WeakPolarHBondContact O-CB 3.19Å; R735-S738 PolarHBondContact O-N 3.14Å; D736-S738 VanDerWaalsContact C-N 3.32Å; D736-S738 PolarHBondContact O-N 3.41Å; S738-L741 PolarHBondContact O-N 3.28Å; S738-S742 PolarHBondContact O-N 3.1Å; S738-S742 VanDerWaalsContact O-N 3.16Å
739	M	76.1	Confident	83.3	Confident	40 Å²	40	49.8 Å²	49.8	20%	0.197	27%	0.268	C	S	.	.	H	α-helix	trans	-65.7	-42.1	178	-169.4	173.4	74.3	0	0	111.4	F632 L648 D736 S737 S742 F791 M805	F632-M739 HydrophobicContact CE1-SD 4.38Å; L648-M739 HydrophobicContact CD2-CG 3.88Å; L648-M739 HydrophobicContact CD2-SD 4.15Å; D736-M739 PolarHBondContact O-N 2.96Å; S737-M739 VanDerWaalsContact C-N 3.34Å; M739-S742 PolarHBondContact O-N 2.93Å; M739-S742 PolarHBondContact O-OG 3.02Å; M739-F791 HydrophobicContact CE-CD2 4.32Å; M739-F791 HydrophobicContact CE-CE1 4.2Å; M739-F791 HydrophobicContact CE-CE2 3.25Å; M739-F791 HydrophobicContact CE-CZ 3.18Å; M739-M805 HydrophobicContact CE-CE 4.27Å; M739-M805 HydrophobicContact CE-SD 3.34Å; M739-M805 WeakPolarHBondContact CE-SD 3.5Å; M739-M805 HydrophobicContact SD-CE 4.3Å; M739-M805 HydrophobicContact SD-SD 3.69Å; M739-M805 VanDerWaalsContact SD-SD 3.69Å
740	L	78.3	Confident	83.7	Confident	23 Å²	23	49.7 Å²	49.7	12%	0.12	27%	0.268	C	S	.	.	H	α-helix	trans	-68.8	-39.6	176.9	-69.9	172.4	0	0	0	112.8	S737 S742 L743 F787 L788 F791 Y792	S737-L740 PolarHBondContact O-N 3.36Å; L740-S742 PolarHBondContact O-N 3.34Å; L740-L743 WeakPolarHBondContact O-CB 3.43Å; L740-L743 PolarHBondContact O-N 3.47Å; L740-L743 VanDerWaalsContact O-N 3.12Å; L740-F787 HydrophobicContact CD2-CE1 4.24Å; L740-L788 HydrophobicContact CD2-CD2 3.92Å; L740-F791 HydrophobicContact CD1-CD1 3.78Å; L740-F791 HydrophobicContact CD1-CE1 3.92Å; L740-F791 HydrophobicContact CD2-CD1 4Å; L740-F791 HydrophobicContact CD2-CE1 4.3Å; L740-F791 HydrophobicContact CD2-CG 4.49Å; L740-F791 HydrophobicContact CG-CD1 4.07Å; L740-F791 HydrophobicContact CG-CE1 4Å; L740-Y792 HydrophobicContact CD1-CD2 4.24Å; L740-Y792 HydrophobicContact CD1-CE1 4.06Å; L740-Y792 HydrophobicContact CD1-CE2 3.36Å; L740-Y792 WeakPolarHBondContact CD1-OH 3.42Å
741	L	81.4	Confident	84	Confident	114 Å²	114	53.6 Å²	53.6	60%	0.597	29%	0.288	S	S	*	.	H	α-helix	trans	-61.4	-33.2	177.3	-172.9	63.7	0	0	0	111.9	W708 S737 S738 L743 G744	W708-L741 HydrophobicContact CH2-CD2 3.51Å; W708-L741 HydrophobicContact CZ2-CD2 4.08Å; W708-L741 HydrophobicContact CZ3-CD2 4.24Å; S737-L741 WeakPolarHBondContact O-CB 3.41Å; S737-L741 PolarHBondContact O-N 3.16Å; S738-L741 PolarHBondContact O-N 3.28Å; L741-L743 PolarHBondContact O-N 3.49Å; L741-G744 PolarHBondContact O-N 2.93Å; L741-G744 VanDerWaalsContact O-N 3.1Å
742	S	82.9	Confident	84.4	Confident	18 Å²	18	53.7 Å²	53.7	13%	0.126	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-19.7	177.6	78.9	0	0	0	0	114.3	Q701 S738 M739 L740	Q701-S742 PolarHBondContact NE2-O 3.48Å; Q701-S742 VanDerWaalsContact NE2-O 3.13Å; S738-S742 PolarHBondContact O-N 3.1Å; S738-S742 VanDerWaalsContact O-N 3.16Å; M739-S742 PolarHBondContact O-N 2.93Å; M739-S742 PolarHBondContact O-OG 3.02Å; L740-S742 PolarHBondContact O-N 3.34Å
743	L	86.9	Confident	84.6	Confident	8 Å²	8	52.3 Å²	52.3	4%	0.042	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-0.6	177.7	-61.3	172	0	0	0	113.1	L648 F652 L740 L741 Y745 D746 V747 W784	L648-L743 HydrophobicContact CD2-CD1 4.35Å; L648-L743 HydrophobicContact CD2-CD2 4.22Å; L648-L743 HydrophobicContact CG-CD2 4.09Å; F652-L743 HydrophobicContact CD2-CD2 4.19Å; L740-L743 WeakPolarHBondContact O-CB 3.43Å; L740-L743 PolarHBondContact O-N 3.47Å; L740-L743 VanDerWaalsContact O-N 3.12Å; L741-L743 PolarHBondContact O-N 3.49Å; L743-Y745 VanDerWaalsContact C-N 3.29Å; L743-Y745 PolarHBondContact O-N 2.96Å; L743-D746 WeakPolarHBondContact O-CB 3.48Å; L743-D746 PolarHBondContact O-N 3.2Å; L743-D746 VanDerWaalsContact O-N 3.08Å; L743-V747 WeakPolarHBondContact O-CG2 3.27Å; L743-V747 PolarHBondContact O-N 3.27Å; L743-W784 HydrophobicContact CD1-CH2 4.02Å; L743-W784 HydrophobicContact CD1-CZ3 3.84Å; L743-W784 HydrophobicContact CD2-CH2 4.25Å
744	G	88.9	Confident	85	Confident	42 Å²	42	49.6 Å²	49.6	43%	0.433	27%	0.269	S	S	.	.	H	α-helix	trans	-58.8	-38	-176.5	0	0	0	0	0	113.7	L741 V747 L748	L741-G744 PolarHBondContact O-N 2.93Å; L741-G744 VanDerWaalsContact O-N 3.1Å; G744-V747 PolarHBondContact O-N 3.45Å; G744-L748 PolarHBondContact O-N 2.89Å; G744-L748 VanDerWaalsContact O-N 3.15Å
745	Y	91.8	Very high	85.7	Confident	33 Å²	33	51.4 Å²	51.4	13%	0.129	28%	0.28	C	S	.	.	H	α-helix	trans	-69.6	-37.3	175	-179.8	-107.6	0	0	0	112.3	M697 V700 Q701 M704 L743 V747 L748 L749	M697-Y745 PolarHBondContact O-OH 3.39Å; M697-Y745 VanDerWaalsContact O-OH 3.13Å; V700-Y745 HydrophobicContact CB-CE1 4.46Å; V700-Y745 HydrophobicContact CB-CE2 4.39Å; V700-Y745 HydrophobicContact CG1-CD2 4.24Å; V700-Y745 HydrophobicContact CG1-CE1 4.42Å; V700-Y745 HydrophobicContact CG1-CE2 3.75Å; Q701-Y745 HydrophobicContact CB-CD1 3.83Å; Q701-Y745 HydrophobicContact CB-CE1 4Å; Q701-Y745 HydrophobicContact CG-CD1 4.36Å; M704-Y745 HydrophobicContact SD-CG 4.45Å; L743-Y745 VanDerWaalsContact C-N 3.29Å; L743-Y745 PolarHBondContact O-N 2.96Å; Y745-V747 VanDerWaalsContact C-N 3.33Å; Y745-V747 PolarHBondContact O-N 3.48Å; Y745-L748 HydrophobicContact CD2-CD2 4.46Å; Y745-L748 WeakPolarHBondContact O-CB 3.38Å; Y745-L748 PolarHBondContact O-N 3.2Å; Y745-L749 HydrophobicContact CD1-CD1 3.94Å; Y745-L749 HydrophobicContact CD1-CG 4.22Å; Y745-L749 HydrophobicContact CE1-CD1 3.49Å; Y745-L749 VanDerWaalsContact CE1-CD1 3.49Å; Y745-L749 HydrophobicContact CE1-CD2 4.27Å; Y745-L749 HydrophobicContact CE1-CG 3.85Å; Y745-L749 PolarHBondContact O-N 2.92Å
746	D	90.9	Very high	86.2	Confident	3 Å²	3	46.3 Å²	46.3	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-63.4	-40.8	175.5	-65	-54.8	0	0	0	111.3	G649 F652 A653 L743 L748 L749 V750	G649-D746 VanDerWaalsContact CA-OD2 3.27Å; G649-D746 WeakPolarHBondContact CA-OD2 3.42Å; F652-D746 HydrophobicContact CB-CB 4.24Å; A653-D746 WeakPolarHBondContact CA-OD1 3.42Å; A653-D746 WeakPolarHBondContact CB-OD1 3.4Å; A653-D746 PolarHBondContact N-OD1 2.99Å; L743-D746 WeakPolarHBondContact O-CB 3.48Å; L743-D746 PolarHBondContact O-N 3.2Å; L743-D746 VanDerWaalsContact O-N 3.08Å; D746-L748 VanDerWaalsContact C-N 3.32Å; D746-L748 PolarHBondContact O-N 3.19Å; D746-L749 WeakPolarHBondContact O-CB 3.29Å; D746-L749 PolarHBondContact O-N 3.06Å; D746-V750 WeakPolarHBondContact O-CG2 3.49Å; D746-V750 PolarHBondContact O-N 2.89Å
747	V	91.1	Very high	87	Confident	72 Å²	72	42.7 Å²	42.7	44%	0.436	24%	0.242	S	C	.	.	H	α-helix	trans	-59.8	-43.5	173.1	173.9	0	0	0	0	110.9	L743 G744 Y745 L749 V750 I751	L743-V747 WeakPolarHBondContact O-CG2 3.27Å; L743-V747 PolarHBondContact O-N 3.27Å; G744-V747 PolarHBondContact O-N 3.45Å; Y745-V747 VanDerWaalsContact C-N 3.33Å; Y745-V747 PolarHBondContact O-N 3.48Å; V747-L749 PolarHBondContact O-N 2.94Å; V747-V750 PolarHBondContact O-N 3.29Å; V747-I751 HydrophobicContact CG1-CD1 3.89Å; V747-I751 HydrophobicContact CG1-CG1 4.48Å; V747-I751 VanDerWaalsContact O-CG1 3.29Å; V747-I751 WeakPolarHBondContact O-CG1 3.22Å; V747-I751 PolarHBondContact O-N 3.3Å
748	L	92	Very high	87.6	Confident	89 Å²	89	44.2 Å²	44.2	47%	0.466	24%	0.24	S	C	.	.	H	α-helix	trans	-60.7	-44.6	174.9	-179	68.4	0	0	0	111.7	G744 Y745 D746 V750 I751 L752	G744-L748 PolarHBondContact O-N 2.89Å; G744-L748 VanDerWaalsContact O-N 3.15Å; Y745-L748 HydrophobicContact CD2-CD2 4.46Å; Y745-L748 WeakPolarHBondContact O-CB 3.38Å; Y745-L748 PolarHBondContact O-N 3.2Å; D746-L748 VanDerWaalsContact C-N 3.32Å; D746-L748 PolarHBondContact O-N 3.19Å; L748-V750 PolarHBondContact O-N 3.42Å; L748-I751 PolarHBondContact O-N 3.16Å; L748-L752 HydrophobicContact CG-CD1 4.18Å; L748-L752 WeakPolarHBondContact O-CB 3.43Å; L748-L752 VanDerWaalsContact O-CG 3.32Å; L748-L752 WeakPolarHBondContact O-CG 3.44Å; L748-L752 PolarHBondContact O-N 3.27Å
749	L	91.9	Very high	87.8	Confident	3 Å²	3	49.2 Å²	49.2	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-61.1	-42.9	176	-73.2	-179.4	0	0	0	111.8	A653 L660 M697 Y745 D746 V747 L752 C753	A653-L749 HydrophobicContact CB-CD1 4.31Å; L660-L749 HydrophobicContact CD2-CD2 4.01Å; M697-L749 HydrophobicContact SD-CD2 4.49Å; Y745-L749 HydrophobicContact CD1-CD1 3.94Å; Y745-L749 HydrophobicContact CD1-CG 4.22Å; Y745-L749 HydrophobicContact CE1-CD1 3.49Å; Y745-L749 VanDerWaalsContact CE1-CD1 3.49Å; Y745-L749 HydrophobicContact CE1-CD2 4.27Å; Y745-L749 HydrophobicContact CE1-CG 3.85Å; Y745-L749 PolarHBondContact O-N 2.92Å; D746-L749 WeakPolarHBondContact O-CB 3.29Å; D746-L749 PolarHBondContact O-N 3.06Å; V747-L749 PolarHBondContact O-N 2.94Å; L749-L752 PolarHBondContact O-N 2.89Å; L749-C753 VanDerWaalsContact O-CB 3.3Å; L749-C753 WeakPolarHBondContact O-CB 3.39Å; L749-C753 PolarHBondContact O-N 2.86Å; L749-C753 PolarHBondContact O-SG 3.04Å
750	V	92.1	Very high	88	Confident	13 Å²	13	47.4 Å²	47.4	8%	0.079	25%	0.252	C	S	.	.	H	α-helix	trans	-62.3	-45.7	176.5	169.7	0	0	0	0	110.9	Y656 D746 V747 L748 L752 C753 T754 M777	Y656-V750 HydrophobicContact CD1-CG2 3.99Å; Y656-V750 HydrophobicContact CD2-CG2 3.58Å; Y656-V750 HydrophobicContact CE1-CG2 3.97Å; Y656-V750 HydrophobicContact CE2-CG2 3.51Å; Y656-V750 HydrophobicContact CG-CG2 3.84Å; D746-V750 WeakPolarHBondContact O-CG2 3.49Å; D746-V750 PolarHBondContact O-N 2.89Å; V747-V750 PolarHBondContact O-N 3.29Å; L748-V750 PolarHBondContact O-N 3.42Å; V750-L752 PolarHBondContact O-N 3.2Å; V750-C753 WeakPolarHBondContact O-CB 3.31Å; V750-C753 PolarHBondContact O-N 2.95Å; V750-T754 WeakPolarHBondContact O-CB 3.34Å; V750-T754 PolarHBondContact O-N 3.06Å; V750-T754 PolarHBondContact O-OG1 3.02Å; V750-M777 HydrophobicContact CB-CE 4.4Å; V750-M777 HydrophobicContact CG1-CE 3.92Å
751	I	91.7	Very high	88.1	Confident	93 Å²	93	53.3 Å²	53.3	48%	0.477	27%	0.273	S	S	.	.	H	α-helix	trans	-59.6	-49.7	177.1	-69.1	165.9	0	0	0	110.5	V747 L748 C753 T754 V755	V747-I751 HydrophobicContact CG1-CD1 3.89Å; V747-I751 HydrophobicContact CG1-CG1 4.48Å; V747-I751 VanDerWaalsContact O-CG1 3.29Å; V747-I751 WeakPolarHBondContact O-CG1 3.22Å; V747-I751 PolarHBondContact O-N 3.3Å; L748-I751 PolarHBondContact O-N 3.16Å; I751-C753 VanDerWaalsContact C-N 3.35Å; I751-C753 PolarHBondContact O-N 2.88Å; I751-T754 PolarHBondContact O-N 2.9Å; I751-V755 HydrophobicContact CG2-CG2 4.47Å; I751-V755 WeakPolarHBondContact O-CG2 3.5Å; I751-V755 PolarHBondContact O-N 2.95Å
752	L	91.7	Very high	87.7	Confident	68 Å²	68	55.5 Å²	55.5	36%	0.356	28%	0.277	S	S	.	.	H	α-helix	trans	-59.9	-45.5	177.8	-70	173.7	0	0	0	111	L660 L748 L749 V750 T754 V755 Y756	L660-L752 HydrophobicContact CD1-CB 4.21Å; L660-L752 HydrophobicContact CD2-CB 4.17Å; L748-L752 HydrophobicContact CG-CD1 4.18Å; L748-L752 WeakPolarHBondContact O-CB 3.43Å; L748-L752 VanDerWaalsContact O-CG 3.32Å; L748-L752 WeakPolarHBondContact O-CG 3.44Å; L748-L752 PolarHBondContact O-N 3.27Å; L749-L752 PolarHBondContact O-N 2.89Å; V750-L752 PolarHBondContact O-N 3.2Å; L752-T754 VanDerWaalsContact C-N 3.31Å; L752-T754 PolarHBondContact O-N 2.93Å; L752-V755 PolarHBondContact O-N 2.89Å; L752-Y756 VanDerWaalsContact O-CD2 3.25Å; L752-Y756 WeakPolarHBondContact O-CD2 2.91Å; L752-Y756 PolarHBondContact O-N 2.78Å
753	C	91	Very high	87	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-56.1	-45.4	175.3	-75	0	0	0	0	112	Y656 L660 L749 V750 I751 Y756 A757 M777	Y656-C753 PolarHBondContact O-SG 3.15Å; Y656-C753 VanDerWaalsContact O-SG 3.37Å; L660-C753 WeakPolarHBondContact CB-SG 3.04Å; L749-C753 VanDerWaalsContact O-CB 3.3Å; L749-C753 WeakPolarHBondContact O-CB 3.39Å; L749-C753 PolarHBondContact O-N 2.86Å; L749-C753 PolarHBondContact O-SG 3.04Å; V750-C753 WeakPolarHBondContact O-CB 3.31Å; V750-C753 PolarHBondContact O-N 2.95Å; I751-C753 VanDerWaalsContact C-N 3.35Å; I751-C753 PolarHBondContact O-N 2.88Å; C753-Y756 PolarHBondContact O-N 2.95Å; C753-A757 WeakPolarHBondContact O-CB 3.25Å; C753-A757 PolarHBondContact O-N 3.07Å; C753-M777 HydrophobicContact CB-CE 3.29Å; C753-M777 HydrophobicContact CB-CG 4.23Å; C753-M777 HydrophobicContact CB-SD 3.61Å
754	T	90.6	Very high	85.8	Confident	30 Å²	30	59.1 Å²	59.1	18%	0.184	30%	0.301	C	S	.	.	H	α-helix	trans	-66.9	-42.3	-179.6	-61.5	0	0	0	0	111.7	V750 I751 L752 A757 F758 Y778 C781	V750-T754 WeakPolarHBondContact O-CB 3.34Å; V750-T754 PolarHBondContact O-N 3.06Å; V750-T754 PolarHBondContact O-OG1 3.02Å; I751-T754 PolarHBondContact O-N 2.9Å; L752-T754 VanDerWaalsContact C-N 3.31Å; L752-T754 PolarHBondContact O-N 2.93Å; T754-A757 PolarHBondContact O-N 3.39Å; T754-F758 WeakPolarHBondContact O-CB 3.29Å; T754-F758 PolarHBondContact O-N 3.04Å; T754-Y778 HydrophobicContact CG2-CD1 4.41Å; T754-Y778 HydrophobicContact CG2-CE1 4.24Å; T754-C781 PolarHBondContact OG1-SG 3.42Å; T754-C781 VanDerWaalsContact OG1-SG 3.4Å
755	V	90.4	Very high	84.2	Confident	90 Å²	90	65.3 Å²	65.3	55%	0.545	32%	0.319	S	S	.	.	H	α-helix	trans	-60.9	-46.5	175.2	171	0	0	0	0	111	I751 L752 F758 K759	I751-V755 HydrophobicContact CG2-CG2 4.47Å; I751-V755 WeakPolarHBondContact O-CG2 3.5Å; I751-V755 PolarHBondContact O-N 2.95Å; L752-V755 PolarHBondContact O-N 2.89Å; V755-F758 PolarHBondContact O-N 3.22Å; V755-K759 PolarHBondContact O-N 3.13Å
756	Y	87.1	Confident	82.5	Confident	79 Å²	79	71 Å²	71	31%	0.31	35%	0.352	S	S	.	.	H	α-helix	trans	-67.5	-40.3	177.3	-83.4	-74.3	0	0	0	112.3	L660 A667 L752 C753 F758 K759 T760	L660-Y756 HydrophobicContact CD1-CD2 3.66Å; L660-Y756 HydrophobicContact CD1-CE2 4.3Å; L660-Y756 HydrophobicContact CD1-CG 4.37Å; A667-Y756 HydrophobicContact CB-CD1 4.03Å; A667-Y756 HydrophobicContact CB-CE1 4.49Å; L752-Y756 VanDerWaalsContact O-CD2 3.25Å; L752-Y756 WeakPolarHBondContact O-CD2 2.91Å; L752-Y756 PolarHBondContact O-N 2.78Å; C753-Y756 PolarHBondContact O-N 2.95Å; Y756-F758 VanDerWaalsContact C-N 3.32Å; Y756-F758 PolarHBondContact O-N 3.48Å; Y756-K759 PolarHBondContact O-N 3.28Å; Y756-T760 WeakPolarHBondContact O-CG2 3.46Å; Y756-T760 PolarHBondContact O-N 2.92Å; Y756-T760 PolarHBondContact O-OG1 2.98Å; Y756-T760 VanDerWaalsContact O-OG1 3.1Å
757	A	87.2	Confident	81	Confident	1 Å²	1	76.3 Å²	76.3	1%	0.008	38%	0.375	C	S	.	.	H	α-helix	trans	-58.8	-44.7	175.1	0	0	0	0	0	111.1	C753 T754 T760 R761 M777	C753-A757 WeakPolarHBondContact O-CB 3.25Å; C753-A757 PolarHBondContact O-N 3.07Å; T754-A757 PolarHBondContact O-N 3.39Å; A757-T760 WeakPolarHBondContact CA-OG1 3.41Å; A757-T760 PolarHBondContact O-N 2.93Å; A757-T760 PolarHBondContact O-OG1 2.95Å; A757-R761 PolarHBondContact O-N 3.18Å; A757-M777 HydrophobicContact CB-CG 4.31Å
758	F	86.5	Confident	80	Confident	104 Å²	104	77.7 Å²	77.7	46%	0.456	38%	0.38	S	S	.	.	H	α-helix	trans	-62.3	-43	174.8	-176.1	-95	0	0	0	112.3	T754 V755 Y756 T760 R761	T754-F758 WeakPolarHBondContact O-CB 3.29Å; T754-F758 PolarHBondContact O-N 3.04Å; V755-F758 PolarHBondContact O-N 3.22Å; Y756-F758 VanDerWaalsContact C-N 3.32Å; Y756-F758 PolarHBondContact O-N 3.48Å; F758-T760 PolarHBondContact O-N 3Å; F758-R761 VanDerWaalsContact CE2-NH1 3.3Å; F758-R761 WeakPolarHBondContact O-CB 3.43Å; F758-R761 WeakPolarHBondContact O-CD 3.09Å; F758-R761 WeakPolarHBondContact O-CG 3.43Å; F758-R761 PolarHBondContact O-N 3.21Å
759	K	84.3	Confident	79.4	Confident	110 Å²	110	75.1 Å²	75.1	48%	0.478	37%	0.365	S	S	.	.	H	α-helix	trans	-60.2	-35.4	175.8	-171.1	174.8	178.4	174.8	0	111.7	N671 V755 Y756	N671-K759 PolarHBondContact ND2-NZ 2.88Å; V755-K759 PolarHBondContact O-N 3.13Å; Y756-K759 PolarHBondContact O-N 3.28Å
760	T	79.8	Confident	78.9	Confident	3 Å²	3	75.3 Å²	75.3	2%	0.018	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-84.4	-2.3	179.6	55.7	0	0	0	0	114.9	I666 A667 Y756 A757 F758 K762 C763	I666-T760 HydrophobicContact CB-CG2 4.24Å; I666-T760 HydrophobicContact CG2-CG2 3.86Å; A667-T760 HydrophobicContact CB-CG2 3.72Å; Y756-T760 WeakPolarHBondContact O-CG2 3.46Å; Y756-T760 PolarHBondContact O-N 2.92Å; Y756-T760 PolarHBondContact O-OG1 2.98Å; Y756-T760 VanDerWaalsContact O-OG1 3.1Å; A757-T760 WeakPolarHBondContact CA-OG1 3.41Å; A757-T760 PolarHBondContact O-N 2.93Å; A757-T760 PolarHBondContact O-OG1 2.95Å; F758-T760 PolarHBondContact O-N 3Å; T760-K762 PolarHBondContact O-N 3.47Å; T760-K762 VanDerWaalsContact O-N 3.16Å; T760-C763 WeakPolarHBondContact O-CB 3.38Å; T760-C763 PolarHBondContact O-N 3.15Å; T760-C763 VanDerWaalsContact O-N 3.16Å; T760-C763 PolarHBondContact O-SG 3.44Å
761	R	79.8	Confident	78.5	Confident	146 Å²	146	82.5 Å²	82.5	55%	0.551	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-63.5	-23	-175.8	80.6	-171	172.9	146.7	-1.2	115	A757 F758 C763	A757-R761 PolarHBondContact O-N 3.18Å; F758-R761 VanDerWaalsContact CE2-NH1 3.3Å; F758-R761 WeakPolarHBondContact O-CB 3.43Å; F758-R761 WeakPolarHBondContact O-CD 3.09Å; F758-R761 WeakPolarHBondContact O-CG 3.43Å; F758-R761 PolarHBondContact O-N 3.21Å; R761-C763 VanDerWaalsContact C-N 3.32Å
762	K	72.8	Confident	78.3	Confident	161 Å²	161	81.4 Å²	81.4	70%	0.7	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-89.6	10.4	-179.6	-63.8	-172.5	177.1	-174	0	113.2	T760	T760-K762 PolarHBondContact O-N 3.47Å; T760-K762 VanDerWaalsContact O-N 3.16Å
763	C	67.9	Low	78.1	Confident	24 Å²	24	78.2 Å²	78.2	16%	0.162	37%	0.373	C	S	.	.	S	Bend	trans	-64.3	139.6	174.7	-68.4	0	0	0	0	110.3	T760 R761	T760-C763 WeakPolarHBondContact O-CB 3.38Å; T760-C763 PolarHBondContact O-N 3.15Å; T760-C763 VanDerWaalsContact O-N 3.16Å; T760-C763 PolarHBondContact O-SG 3.44Å; R761-C763 VanDerWaalsContact C-N 3.32Å
764	P	62.8	Low	77.9	Confident	77 Å²	77	78.4 Å²	78.4	50%	0.5	38%	0.375	S	S	.	.			trans	-60.6	150.3	-178.1	23.3	-32.6	0	0	0	112.2	N766 F767	P764-N766 PolarHBondContact O-N 3.21Å; P764-F767 PolarHBondContact O-N 3.21Å
765	E	55.7	Low	77.9	Confident	172 Å²	172	82.8 Å²	82.8	80%	0.804	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-18.8	-170.1	-67.2	-169.9	148.1	0	0	115.2	F767 N768	E765-F767 PolarHBondContact O-N 3.18Å; E765-N768 PolarHBondContact O-OD1 2.84Å
766	N	55.6	Low	77.9	Confident	154 Å²	154	78.5 Å²	78.5	82%	0.824	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-15.9	174.2	-62.9	-30.2	0	0	0	113.5	P764	P764-N766 PolarHBondContact O-N 3.21Å
767	F	60.2	Low	78.1	Confident	113 Å²	113	74.8 Å²	74.8	50%	0.496	35%	0.351	S	S	.	.			trans	-110.6	64.7	174.5	-88.5	-90.3	0	0	0	112.4	P764 E765 E769 A770	P764-F767 PolarHBondContact O-N 3.21Å; E765-F767 PolarHBondContact O-N 3.18Å; F767-E769 PolarHBondContact O-N 3.22Å; F767-A770 PolarHBondContact O-N 3.49Å
768	N	68.5	Low	78.3	Confident	102 Å²	102	79.4 Å²	79.4	55%	0.545	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-17.2	177.8	-75.5	-42.5	0	0	0	115	E765 A770 K771 F772	E765-N768 PolarHBondContact O-OD1 2.84Å; N768-A770 PolarHBondContact O-N 3.46Å; N768-K771 PolarHBondContact O-N 3.22Å; N768-F772 HydrophobicContact CB-CE2 4.25Å; N768-F772 WeakPolarHBondContact O-CD2 3.18Å
769	E	79.2	Confident	78.5	Confident	35 Å²	35	76.2 Å²	76.2	16%	0.164	36%	0.358	C	S	.	.	H	α-helix	trans	-64.1	-33.9	179.6	-174.6	159.7	-163.5	0	0	113.6	S610 F767 K771 F772 I773 K824	S610-E769 WeakPolarHBondContact CB-OE1 3.24Å; S610-E769 VanDerWaalsContact OG-CD 3.27Å; S610-E769 PolarHBondContact OG-OE1 3.09Å; S610-E769 PolarHBondContact OG-OE2 3.11Å; F767-E769 PolarHBondContact O-N 3.22Å; E769-K771 VanDerWaalsContact C-N 3.34Å; E769-K771 PolarHBondContact O-N 3.28Å; E769-F772 PolarHBondContact O-N 3.35Å; E769-I773 HydrophobicContact CG-CD1 4.07Å; E769-I773 WeakPolarHBondContact O-CG1 3.3Å; E769-I773 PolarHBondContact O-N 2.78Å; E769-K824 IonicContact OE1-NZ 3.94Å; E769-K824 PolarHBondContact OE1-NZ 3.37Å; E769-K824 IonicContact OE2-NZ 3.66Å
770	A	81.4	Confident	78.8	Confident	7 Å²	7	71 Å²	71	6%	0.058	34%	0.335	C	S	.	.	H	α-helix	trans	-67.3	-33.6	-179.8	0	0	0	0	0	112.8	F767 N768 I773 G774	F767-A770 PolarHBondContact O-N 3.49Å; N768-A770 PolarHBondContact O-N 3.46Å; A770-I773 PolarHBondContact O-N 2.66Å; A770-G774 PolarHBondContact O-N 2.79Å
771	K	83.6	Confident	79.4	Confident	164 Å²	164	72.4 Å²	72.4	71%	0.713	35%	0.345	S	S	*	.	H	α-helix	trans	-66.2	-44.6	177.6	-176.6	179.5	177.8	179.2	0	111.6	N768 E769 I773 G774 F775	N768-K771 PolarHBondContact O-N 3.22Å; E769-K771 VanDerWaalsContact C-N 3.34Å; E769-K771 PolarHBondContact O-N 3.28Å; K771-I773 VanDerWaalsContact C-N 3.35Å; K771-G774 PolarHBondContact O-N 3.37Å; K771-F775 PolarHBondContact O-N 3Å
772	F	87.5	Confident	79.9	Confident	69 Å²	69	71.1 Å²	71.1	30%	0.303	35%	0.348	S	S	.	.	H	α-helix	trans	-65.2	-37.8	177.4	-66.5	-58.3	0	0	0	112.3	N768 E769 F775 T776 C819 P823	N768-F772 HydrophobicContact CB-CE2 4.25Å; N768-F772 WeakPolarHBondContact O-CD2 3.18Å; E769-F772 PolarHBondContact O-N 3.35Å; F772-F775 PolarHBondContact O-N 3.47Å; F772-T776 WeakPolarHBondContact O-CB 3.41Å; F772-T776 PolarHBondContact O-N 3.49Å; F772-T776 PolarHBondContact O-OG1 2.56Å; F772-C819 WeakPolarHBondContact CB-O 3.5Å; F772-C819 WeakPolarHBondContact CD1-O 3.38Å; F772-P823 HydrophobicContact CD1-CB 4.4Å; F772-P823 HydrophobicContact CD1-CG 3.8Å; F772-P823 HydrophobicContact CE1-CB 3.89Å; F772-P823 HydrophobicContact CE1-CG 3.55Å; F772-P823 HydrophobicContact CE2-CB 4.01Å; F772-P823 HydrophobicContact CE2-CG 4.44Å; F772-P823 HydrophobicContact CG-CG 4.37Å; F772-P823 HydrophobicContact CZ-CB 3.67Å; F772-P823 HydrophobicContact CZ-CG 3.9Å
773	I	88.1	Confident	80.8	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-65.6	-42.8	174	-61.5	163.9	0	0	0	110.9	T663 I666 E769 A770 K771 F775 T776 M777 M820	T663-I773 HydrophobicContact CG2-CB 4.31Å; T663-I773 HydrophobicContact CG2-CD1 4.25Å; T663-I773 HydrophobicContact CG2-CG2 3.27Å; I666-I773 HydrophobicContact CD1-CD1 3.83Å; E769-I773 HydrophobicContact CG-CD1 4.07Å; E769-I773 WeakPolarHBondContact O-CG1 3.3Å; E769-I773 PolarHBondContact O-N 2.78Å; A770-I773 PolarHBondContact O-N 2.66Å; K771-I773 VanDerWaalsContact C-N 3.35Å; I773-F775 PolarHBondContact O-N 3.07Å; I773-T776 PolarHBondContact O-N 2.84Å; I773-M777 HydrophobicContact CG2-CG 4.37Å; I773-M777 WeakPolarHBondContact O-CG 3.4Å; I773-M777 PolarHBondContact O-N 3.43Å; I773-M820 HydrophobicContact CD1-CE 4.49Å; I773-M820 HydrophobicContact CG1-CE 4.12Å
774	G	87.6	Confident	81.7	Confident	5 Å²	5	64.9 Å²	64.9	5%	0.052	32%	0.318	C	S	.	.	H	α-helix	trans	-56.7	-48.9	173.9	0	0	0	0	0	112.7	A770 K771 T776 M777 Y778	A770-G774 PolarHBondContact O-N 2.79Å; K771-G774 PolarHBondContact O-N 3.37Å; G774-T776 PolarHBondContact O-N 2.68Å; G774-M777 PolarHBondContact O-N 3.12Å; G774-Y778 WeakPolarHBondContact O-CD2 3.39Å; G774-Y778 PolarHBondContact O-N 3.07Å
775	F	89.6	Confident	83	Confident	122 Å²	122	67.3 Å²	67.3	54%	0.535	33%	0.326	S	S	.	.	H	α-helix	trans	-60.1	-45.5	177	-172.1	-111.5	0	0	0	112.1	K771 F772 I773 M777 Y778 T779 C819	K771-F775 PolarHBondContact O-N 3Å; F772-F775 PolarHBondContact O-N 3.47Å; I773-F775 PolarHBondContact O-N 3.07Å; F775-M777 VanDerWaalsContact C-N 3.32Å; F775-M777 PolarHBondContact O-N 3.3Å; F775-Y778 PolarHBondContact O-N 3.37Å; F775-T779 PolarHBondContact O-N 2.83Å; F775-T779 PolarHBondContact O-OG1 3.3Å; F775-T779 VanDerWaalsContact O-OG1 3.09Å; F775-C819 HydrophobicContact CD1-CB 3.75Å; F775-C819 WeakPolarHBondContact CD1-SG 3.42Å; F775-C819 HydrophobicContact CE1-CB 4.32Å; F775-C819 WeakPolarHBondContact CE1-SG 3.46Å
776	T	91.4	Very high	84.6	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-56	-45.9	176	-52.5	0	0	0	0	111.5	L659 F772 I773 G774 T780 V815 V816 C819	L659-T776 HydrophobicContact CD1-CG2 4.47Å; F772-T776 WeakPolarHBondContact O-CB 3.41Å; F772-T776 PolarHBondContact O-N 3.49Å; F772-T776 PolarHBondContact O-OG1 2.56Å; I773-T776 PolarHBondContact O-N 2.84Å; G774-T776 PolarHBondContact O-N 2.68Å; T776-T780 VanDerWaalsContact O-CB 3.27Å; T776-T780 WeakPolarHBondContact O-CB 3.47Å; T776-T780 PolarHBondContact O-N 2.76Å; T776-T780 PolarHBondContact O-OG1 3.23Å; T776-V815 HydrophobicContact CG2-CG1 4.08Å; T776-V816 HydrophobicContact CG2-CG2 4.12Å; T776-C819 WeakPolarHBondContact OG1-CB 3.44Å
777	M	90.7	Very high	86.2	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-69.6	-41.8	-179.6	-69.2	-50.7	-49	0	0	112.9	Y656 L659 V750 C753 A757 I773 G774 F775 T780 C781	Y656-M777 HydrophobicContact CD1-CE 4.49Å; Y656-M777 HydrophobicContact CD1-SD 4.49Å; L659-M777 HydrophobicContact CD1-SD 4.14Å; V750-M777 HydrophobicContact CB-CE 4.4Å; V750-M777 HydrophobicContact CG1-CE 3.92Å; C753-M777 HydrophobicContact CB-CE 3.29Å; C753-M777 HydrophobicContact CB-CG 4.23Å; C753-M777 HydrophobicContact CB-SD 3.61Å; A757-M777 HydrophobicContact CB-CG 4.31Å; I773-M777 HydrophobicContact CG2-CG 4.37Å; I773-M777 WeakPolarHBondContact O-CG 3.4Å; I773-M777 PolarHBondContact O-N 3.43Å; G774-M777 PolarHBondContact O-N 3.12Å; F775-M777 VanDerWaalsContact C-N 3.32Å; F775-M777 PolarHBondContact O-N 3.3Å; M777-T780 WeakPolarHBondContact O-CB 3.36Å; M777-T780 PolarHBondContact O-N 3.06Å; M777-C781 PolarHBondContact O-N 3.33Å; M777-C781 PolarHBondContact O-SG 2.8Å; M777-C781 VanDerWaalsContact O-SG 3.32Å
778	Y	91.1	Very high	87.4	Confident	99 Å²	99	52.8 Å²	52.8	39%	0.388	27%	0.265	S	S	.	.	H	α-helix	trans	-64.6	-45	178.9	-60	-37.1	0	0	0	112.2	T754 G774 F775 T780 C781 I782	T754-Y778 HydrophobicContact CG2-CD1 4.41Å; T754-Y778 HydrophobicContact CG2-CE1 4.24Å; G774-Y778 WeakPolarHBondContact O-CD2 3.39Å; G774-Y778 PolarHBondContact O-N 3.07Å; F775-Y778 PolarHBondContact O-N 3.37Å; Y778-T780 VanDerWaalsContact C-N 3.31Å; Y778-T780 PolarHBondContact O-N 3.38Å; Y778-C781 PolarHBondContact O-N 3.02Å; Y778-I782 WeakPolarHBondContact O-CG1 3.36Å; Y778-I782 PolarHBondContact O-N 3.09Å
779	T	91.8	Very high	88.4	Confident	37 Å²	37	51.4 Å²	51.4	23%	0.227	26%	0.261	C	S	.	.	H	α-helix	trans	-64.3	-38.5	176.5	-53.7	0	0	0	0	111.4	F775 C781 I782 I783 V815	F775-T779 PolarHBondContact O-N 2.83Å; F775-T779 PolarHBondContact O-OG1 3.3Å; F775-T779 VanDerWaalsContact O-OG1 3.09Å; T779-C781 PolarHBondContact O-N 3.41Å; T779-I782 PolarHBondContact O-N 3.26Å; T779-I783 HydrophobicContact CG2-CD1 4.27Å; T779-I783 WeakPolarHBondContact O-CG1 3.45Å; T779-I783 PolarHBondContact O-N 3.3Å; T779-I783 VanDerWaalsContact O-N 3.15Å; T779-V815 HydrophobicContact CG2-CG1 4.05Å; T779-V815 HydrophobicContact CG2-CG2 3.72Å
780	T	90.6	Very high	88.9	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-59	-47	173.8	-65	0	0	0	0	111.7	Y656 T776 M777 Y778 I782 I783 W784	Y656-T780 HydrophobicContact CE1-CG2 3.7Å; Y656-T780 WeakPolarHBondContact OH-CG2 3.47Å; T776-T780 VanDerWaalsContact O-CB 3.27Å; T776-T780 WeakPolarHBondContact O-CB 3.47Å; T776-T780 PolarHBondContact O-N 2.76Å; T776-T780 PolarHBondContact O-OG1 3.23Å; M777-T780 WeakPolarHBondContact O-CB 3.36Å; M777-T780 PolarHBondContact O-N 3.06Å; Y778-T780 VanDerWaalsContact C-N 3.31Å; Y778-T780 PolarHBondContact O-N 3.38Å; T780-I782 VanDerWaalsContact C-N 3.29Å; T780-I782 PolarHBondContact O-N 2.85Å; T780-I783 PolarHBondContact O-N 3.18Å; T780-W784 VanDerWaalsContact O-CD1 3.26Å; T780-W784 PolarHBondContact O-N 3.31Å
781	C	90.9	Very high	89.1	Confident	33 Å²	33	53.2 Å²	53.2	22%	0.223	27%	0.27	C	S	.	.	H	α-helix	trans	-59.3	-39.5	178.3	-70	0	0	0	0	112.4	T754 M777 Y778 T779 W784 L785	T754-C781 PolarHBondContact OG1-SG 3.42Å; T754-C781 VanDerWaalsContact OG1-SG 3.4Å; M777-C781 PolarHBondContact O-N 3.33Å; M777-C781 PolarHBondContact O-SG 2.8Å; M777-C781 VanDerWaalsContact O-SG 3.32Å; Y778-C781 PolarHBondContact O-N 3.02Å; T779-C781 PolarHBondContact O-N 3.41Å; C781-W784 PolarHBondContact O-N 3.07Å; C781-L785 WeakPolarHBondContact O-CB 3.2Å; C781-L785 VanDerWaalsContact O-CG 3.24Å; C781-L785 WeakPolarHBondContact O-CG 3.09Å; C781-L785 PolarHBondContact O-N 3.41Å
782	I	92.2	Very high	89.2	Confident	119 Å²	119	51.7 Å²	51.7	61%	0.61	26%	0.261	S	S	*	.	H	α-helix	trans	-63.2	-45.7	177.7	-65.7	168.6	0	0	0	110.9	Y778 T779 T780 W784 L785 A786	Y778-I782 WeakPolarHBondContact O-CG1 3.36Å; Y778-I782 PolarHBondContact O-N 3.09Å; T779-I782 PolarHBondContact O-N 3.26Å; T780-I782 VanDerWaalsContact C-N 3.29Å; T780-I782 PolarHBondContact O-N 2.85Å; I782-W784 PolarHBondContact O-N 3.48Å; I782-L785 PolarHBondContact O-N 3.08Å; I782-A786 WeakPolarHBondContact O-CB 3.15Å; I782-A786 PolarHBondContact O-N 2.81Å
783	I	91.1	Very high	89.2	Confident	22 Å²	22	54 Å²	54	11%	0.113	28%	0.281	C	S	.	.	H	α-helix	trans	-61.1	-45.8	179.2	-67.1	164	0	0	0	110.9	T779 T780 A786 F787 L811 V815	T779-I783 HydrophobicContact CG2-CD1 4.27Å; T779-I783 WeakPolarHBondContact O-CG1 3.45Å; T779-I783 PolarHBondContact O-N 3.3Å; T779-I783 VanDerWaalsContact O-N 3.15Å; T780-I783 PolarHBondContact O-N 3.18Å; I783-A786 PolarHBondContact O-N 3.49Å; I783-F787 WeakPolarHBondContact O-CB 3.16Å; I783-F787 PolarHBondContact O-N 3.31Å; I783-L811 HydrophobicContact CD1-CD2 3.74Å; I783-L811 HydrophobicContact CD1-CG 3.76Å; I783-L811 HydrophobicContact CG1-CD2 3.83Å; I783-L811 HydrophobicContact CG1-CG 4.41Å; I783-L811 HydrophobicContact CG2-CD2 4.23Å; I783-V815 HydrophobicContact CD1-CG2 3.48Å; I783-V815 VanDerWaalsContact CD1-CG2 3.48Å
784	W	87.4	Confident	89.1	Confident	32 Å²	32	55 Å²	55	12%	0.121	29%	0.286	C	S	.	.	H	α-helix	trans	-68.3	-37.5	-179.3	-82.2	103.6	0	0	0	113.3	F652 Y656 L743 T780 C781 I782 A786 F787 L788	F652-W784 AromaticContact CD1-CZ2 3.8Å; F652-W784 HydrophobicContact CD1-CZ2 3.8Å; F652-W784 AromaticContact CD2-CH2 3.74Å; F652-W784 HydrophobicContact CD2-CH2 3.74Å; F652-W784 AromaticContact CD2-CZ2 3.6Å; F652-W784 HydrophobicContact CD2-CZ2 3.6Å; F652-W784 HydrophobicContact CE1-CH2 4.42Å; F652-W784 AromaticContact CE1-CZ2 3.59Å; F652-W784 HydrophobicContact CE1-CZ2 3.59Å; F652-W784 AromaticContact CE2-CH2 3.39Å; F652-W784 HydrophobicContact CE2-CH2 3.39Å; F652-W784 AromaticContact CE2-CZ2 3.38Å; F652-W784 HydrophobicContact CE2-CZ2 3.38Å; F652-W784 HydrophobicContact CG-CH2 4.39Å; F652-W784 AromaticContact CG-CZ2 3.8Å; F652-W784 HydrophobicContact CG-CZ2 3.8Å; F652-W784 AromaticContact CZ-CH2 3.77Å; F652-W784 HydrophobicContact CZ-CH2 3.77Å; F652-W784 AromaticContact CZ-CZ2 3.36Å; F652-W784 HydrophobicContact CZ-CZ2 3.36Å; Y656-W784 PolarHBondContact OH-NE1 2.59Å; Y656-W784 VanDerWaalsContact OH-NE1 3.08Å; L743-W784 HydrophobicContact CD1-CH2 4.02Å; L743-W784 HydrophobicContact CD1-CZ3 3.84Å; L743-W784 HydrophobicContact CD2-CH2 4.25Å; T780-W784 VanDerWaalsContact O-CD1 3.26Å; T780-W784 PolarHBondContact O-N 3.31Å; C781-W784 PolarHBondContact O-N 3.07Å; I782-W784 PolarHBondContact O-N 3.48Å; W784-A786 VanDerWaalsContact C-N 3.3Å; W784-A786 PolarHBondContact O-N 3.4Å; W784-F787 AromaticContact CE3-CD1 3.88Å; W784-F787 HydrophobicContact CE3-CD1 3.88Å; W784-F787 AromaticContact CZ3-CD1 3.83Å; W784-F787 HydrophobicContact CZ3-CD1 3.83Å; W784-F787 HydrophobicContact CZ3-CE1 4.01Å; W784-F787 PolarHBondContact O-N 2.79Å; W784-L788 PolarHBondContact O-N 2.87Å
785	L	88.8	Confident	88.8	Confident	128 Å²	128	57.3 Å²	57.3	67%	0.67	30%	0.302	S	S	*	.	H	α-helix	trans	-65.5	-34.2	174.2	-73.9	172.9	0	0	0	112.1	C781 I782 P789	C781-L785 WeakPolarHBondContact O-CB 3.2Å; C781-L785 VanDerWaalsContact O-CG 3.24Å; C781-L785 WeakPolarHBondContact O-CG 3.09Å; C781-L785 PolarHBondContact O-N 3.41Å; I782-L785 PolarHBondContact O-N 3.08Å; L785-P789 WeakPolarHBondContact O-CD 3.04Å
786	A	90.5	Very high	88.2	Confident	46 Å²	46	57 Å²	57	38%	0.38	32%	0.315	S	S	.	.	H	α-helix	trans	-76.4	-35.2	175.2	0	0	0	0	0	112.9	I782 I783 W784 P789 I790	I782-A786 WeakPolarHBondContact O-CB 3.15Å; I782-A786 PolarHBondContact O-N 2.81Å; I783-A786 PolarHBondContact O-N 3.49Å; W784-A786 VanDerWaalsContact C-N 3.3Å; W784-A786 PolarHBondContact O-N 3.4Å; A786-P789 VanDerWaalsContact O-CD 3.28Å; A786-P789 WeakPolarHBondContact O-CD 3.31Å; A786-P789 WeakPolarHBondContact O-CG 3.31Å; A786-I790 VanDerWaalsContact O-CD1 3.29Å; A786-I790 WeakPolarHBondContact O-CD1 3.43Å; A786-I790 VanDerWaalsContact O-CG1 3.22Å; A786-I790 WeakPolarHBondContact O-CG1 3.46Å
787	F	88.9	Confident	87.8	Confident	12 Å²	12	60 Å²	60	5%	0.053	33%	0.331	C	S	.	.	H	α-helix	trans	-62.2	-45.3	-178.3	166.9	-107.5	0	0	0	113.1	L740 I783 W784 I790 F791 M805 S808	L740-F787 HydrophobicContact CD2-CE1 4.24Å; I783-F787 WeakPolarHBondContact O-CB 3.16Å; I783-F787 PolarHBondContact O-N 3.31Å; W784-F787 AromaticContact CE3-CD1 3.88Å; W784-F787 HydrophobicContact CE3-CD1 3.88Å; W784-F787 AromaticContact CZ3-CD1 3.83Å; W784-F787 HydrophobicContact CZ3-CD1 3.83Å; W784-F787 HydrophobicContact CZ3-CE1 4.01Å; W784-F787 PolarHBondContact O-N 2.79Å; F787-I790 PolarHBondContact O-N 2.82Å; F787-F791 HydrophobicContact CE2-CB 4.08Å; F787-F791 HydrophobicContact CE2-CD2 4.03Å; F787-F791 HydrophobicContact CE2-CG 4.39Å; F787-F791 HydrophobicContact CZ-CB 4.09Å; F787-F791 AromaticContact CZ-CD2 3.86Å; F787-F791 HydrophobicContact CZ-CD2 3.86Å; F787-F791 HydrophobicContact CZ-CG 4.1Å; F787-F791 WeakPolarHBondContact O-CB 3.46Å; F787-F791 PolarHBondContact O-N 3.4Å; F787-M805 HydrophobicContact CE2-CB 4.24Å; F787-M805 HydrophobicContact CE2-CG 4.35Å; F787-M805 HydrophobicContact CZ-CG 4.39Å; F787-S808 WeakPolarHBondContact CD2-OG 3.31Å
788	L	85.3	Confident	87.5	Confident	76 Å²	76	61.1 Å²	61.1	40%	0.398	34%	0.335	S	S	.	.	H	α-helix	trans	-54.5	-53	-176.1	-70.1	174.5	0	0	0	113.9	L740 W784 F791 Y792	L740-L788 HydrophobicContact CD2-CD2 3.92Å; W784-L788 PolarHBondContact O-N 2.87Å; L788-F791 PolarHBondContact O-N 2.01Å; L788-Y792 WeakPolarHBondContact O-CD2 3.05Å; L788-Y792 PolarHBondContact O-N 3.43Å
789	P	88.6	Confident	87.3	Confident	72 Å²	72	59.6 Å²	59.6	47%	0.468	33%	0.329	S	S	.	.	H	α-helix	trans	-66.3	-38.1	178.2	24.3	-33.2	0	0	0	112.7	L785 A786 F791 Y792 V793	L785-P789 WeakPolarHBondContact O-CD 3.04Å; A786-P789 VanDerWaalsContact O-CD 3.28Å; A786-P789 WeakPolarHBondContact O-CD 3.31Å; A786-P789 WeakPolarHBondContact O-CG 3.31Å; P789-F791 VanDerWaalsContact C-N 3.31Å; P789-F791 PolarHBondContact O-N 2.67Å; P789-Y792 PolarHBondContact O-N 2.77Å; P789-V793 VanDerWaalsContact O-CG2 3.32Å; P789-V793 WeakPolarHBondContact O-CG2 3.2Å; P789-V793 PolarHBondContact O-N 3.24Å; P789-V793 VanDerWaalsContact O-N 3.08Å
790	I	89.8	Confident	87.2	Confident	78 Å²	78	59.7 Å²	59.7	40%	0.4	33%	0.329	S	S	.	.	H	α-helix	trans	-64.6	-39.1	179.8	-58.6	168.3	0	0	0	110.5	A786 F787 Y792 V793 T794 T804	A786-I790 VanDerWaalsContact O-CD1 3.29Å; A786-I790 WeakPolarHBondContact O-CD1 3.43Å; A786-I790 VanDerWaalsContact O-CG1 3.22Å; A786-I790 WeakPolarHBondContact O-CG1 3.46Å; F787-I790 PolarHBondContact O-N 2.82Å; I790-Y792 VanDerWaalsContact C-N 3.34Å; I790-Y792 PolarHBondContact O-N 3.09Å; I790-V793 PolarHBondContact O-N 3.15Å; I790-T794 HydrophobicContact CG2-CG2 4.2Å; I790-T794 WeakPolarHBondContact O-CB 3.42Å; I790-T794 WeakPolarHBondContact O-CG2 3.46Å; I790-T794 PolarHBondContact O-N 2.95Å; I790-T794 PolarHBondContact O-OG1 3.21Å; I790-T804 HydrophobicContact CB-CG2 4.35Å; I790-T804 HydrophobicContact CG2-CG2 3.49Å; I790-T804 VanDerWaalsContact CG2-CG2 3.49Å
791	F	86	Confident	87.1	Confident	3 Å²	3	60.4 Å²	60.4	1%	0.013	33%	0.332	C	S	.	.	H	α-helix	trans	-61.6	-39.2	178.9	-177.3	-93.7	0	0	0	113	M739 L740 F787 L788 P789 T794 Q801	M739-F791 HydrophobicContact CE-CD2 4.32Å; M739-F791 HydrophobicContact CE-CE1 4.2Å; M739-F791 HydrophobicContact CE-CE2 3.25Å; M739-F791 HydrophobicContact CE-CZ 3.18Å; L740-F791 HydrophobicContact CD1-CD1 3.78Å; L740-F791 HydrophobicContact CD1-CE1 3.92Å; L740-F791 HydrophobicContact CD2-CD1 4Å; L740-F791 HydrophobicContact CD2-CE1 4.3Å; L740-F791 HydrophobicContact CD2-CG 4.49Å; L740-F791 HydrophobicContact CG-CD1 4.07Å; L740-F791 HydrophobicContact CG-CE1 4Å; F787-F791 HydrophobicContact CE2-CB 4.08Å; F787-F791 HydrophobicContact CE2-CD2 4.03Å; F787-F791 HydrophobicContact CE2-CG 4.39Å; F787-F791 HydrophobicContact CZ-CB 4.09Å; F787-F791 AromaticContact CZ-CD2 3.86Å; F787-F791 HydrophobicContact CZ-CD2 3.86Å; F787-F791 HydrophobicContact CZ-CG 4.1Å; F787-F791 WeakPolarHBondContact O-CB 3.46Å; F787-F791 PolarHBondContact O-N 3.4Å; L788-F791 PolarHBondContact O-N 2.01Å; P789-F791 VanDerWaalsContact C-N 3.31Å; P789-F791 PolarHBondContact O-N 2.67Å; F791-T794 PolarHBondContact O-OG1 3.15Å; F791-Q801 HydrophobicContact CD2-CG 4.03Å; F791-Q801 HydrophobicContact CE2-CG 3.65Å; F791-Q801 HydrophobicContact CZ-CG 4.16Å; F791-Q801 VanDerWaalsContact CZ-NE2 3.25Å
792	Y	85.5	Confident	87	Confident	131 Å²	131	59.8 Å²	59.8	51%	0.514	33%	0.328	S	S	.	.	H	α-helix	trans	-74.9	-41.3	177.2	-82	-71.4	0	0	0	112.8	L740 L788 P789 I790 T794 S795	L740-Y792 HydrophobicContact CD1-CD2 4.24Å; L740-Y792 HydrophobicContact CD1-CE1 4.06Å; L740-Y792 HydrophobicContact CD1-CE2 3.36Å; L740-Y792 WeakPolarHBondContact CD1-OH 3.42Å; L788-Y792 WeakPolarHBondContact O-CD2 3.05Å; L788-Y792 PolarHBondContact O-N 3.43Å; P789-Y792 PolarHBondContact O-N 2.77Å; I790-Y792 VanDerWaalsContact C-N 3.34Å; I790-Y792 PolarHBondContact O-N 3.09Å; Y792-T794 PolarHBondContact O-N 3.32Å; Y792-S795 VanDerWaalsContact O-CB 3.31Å; Y792-S795 WeakPolarHBondContact O-CB 3.41Å; Y792-S795 PolarHBondContact O-N 3.23Å; Y792-S795 PolarHBondContact O-OG 2.67Å
793	V	87.1	Confident	86.9	Confident	119 Å²	119	54.8 Å²	54.8	72%	0.721	30%	0.303	S	S	*	.	H	α-helix	trans	-61.9	-34.3	179.1	169.8	0	0	0	0	111.5	P789 I790 S795	P789-V793 VanDerWaalsContact O-CG2 3.32Å; P789-V793 WeakPolarHBondContact O-CG2 3.2Å; P789-V793 PolarHBondContact O-N 3.24Å; P789-V793 VanDerWaalsContact O-N 3.08Å; I790-V793 PolarHBondContact O-N 3.15Å; V793-S795 VanDerWaalsContact C-N 3.32Å; V793-S795 PolarHBondContact O-N 3.18Å
794	T	86.4	Confident	86.8	Confident	20 Å²	20	55 Å²	55	12%	0.123	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-86.1	2.5	-178.5	54.6	0	0	0	0	114.1	I790 F791 Y792 S796 D797 V800	I790-T794 HydrophobicContact CG2-CG2 4.2Å; I790-T794 WeakPolarHBondContact O-CB 3.42Å; I790-T794 WeakPolarHBondContact O-CG2 3.46Å; I790-T794 PolarHBondContact O-N 2.95Å; I790-T794 PolarHBondContact O-OG1 3.21Å; F791-T794 PolarHBondContact O-OG1 3.15Å; Y792-T794 PolarHBondContact O-N 3.32Å; T794-S796 PolarHBondContact O-N 3.2Å; T794-S796 VanDerWaalsContact O-N 3.11Å; T794-D797 CarbonylContact O-C 3.46Å; T794-D797 PolarHBondContact O-N 3.07Å; T794-D797 VanDerWaalsContact O-N 3.13Å; T794-V800 HydrophobicContact CG2-CG1 3.61Å
795	S	80.6	Confident	86.9	Confident	55 Å²	55	53.8 Å²	53.8	39%	0.385	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-62.7	-18.2	-177.1	60.2	0	0	0	0	115.2	Y792 V793 D797	Y792-S795 VanDerWaalsContact O-CB 3.31Å; Y792-S795 WeakPolarHBondContact O-CB 3.41Å; Y792-S795 PolarHBondContact O-N 3.23Å; Y792-S795 PolarHBondContact O-OG 2.67Å; V793-S795 VanDerWaalsContact C-N 3.32Å; V793-S795 PolarHBondContact O-N 3.18Å; S795-D797 VanDerWaalsContact C-N 3.34Å
796	S	77.4	Confident	87.1	Confident	115 Å²	115	47.8 Å²	47.8	80%	0.804	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-69.6	-29.2	175.5	55	0	0	0	0	113.3	T794	T794-S796 PolarHBondContact O-N 3.2Å; T794-S796 VanDerWaalsContact O-N 3.11Å
797	D	83.7	Confident	87.2	Confident	63 Å²	63	48.8 Å²	48.8	34%	0.337	27%	0.268	S	S	.	.			trans	-124.2	110.5	179.6	-169.1	-28.7	0	0	0	110.7	T794 S795 R799 V800 Q801	T794-D797 CarbonylContact O-C 3.46Å; T794-D797 PolarHBondContact O-N 3.07Å; T794-D797 VanDerWaalsContact O-N 3.13Å; S795-D797 VanDerWaalsContact C-N 3.34Å; D797-R799 PolarHBondContact O-N 2.91Å; D797-R799 WeakPolarHBondContact OD1-CB 3.02Å; D797-R799 PolarHBondContact OD1-N 3.46Å; D797-V800 HydrophobicContact CB-CB 4.24Å; D797-V800 HydrophobicContact CB-CG2 3.98Å; D797-V800 PolarHBondContact O-N 3.12Å; D797-Q801 WeakPolarHBondContact O-CB 3.5Å; D797-Q801 PolarHBondContact O-N 3.17Å
798	Y	83.2	Confident	87.3	Confident	23 Å²	23	49.2 Å²	49.2	9%	0.09	27%	0.272	C	S	.	.	H	α-helix	trans	-62.6	-28.2	-177.7	77.9	-85.8	0	0	0	113.2	D568 I570 I729 T802	D568-Y798 PolarHBondContact OD2-OH 2.87Å; I570-Y798 HydrophobicContact CD1-CE2 4.48Å; I570-Y798 HydrophobicContact CG1-CD2 4.36Å; I570-Y798 HydrophobicContact CG1-CE2 3.83Å; I729-Y798 HydrophobicContact CD1-CD1 4.23Å; I729-Y798 HydrophobicContact CD1-CE1 4.01Å; I729-Y798 HydrophobicContact CG1-CE1 4.33Å; I729-Y798 HydrophobicContact CG2-CD1 3.87Å; I729-Y798 HydrophobicContact CG2-CE1 3.64Å; I729-Y798 HydrophobicContact CG2-CE2 4.36Å; I729-Y798 HydrophobicContact CG2-CG 4.32Å; Y798-T802 VanDerWaalsContact O-CB 3.31Å; Y798-T802 WeakPolarHBondContact O-CB 3.26Å; Y798-T802 PolarHBondContact O-N 3.27Å; Y798-T802 VanDerWaalsContact O-N 3.08Å; Y798-T802 PolarHBondContact O-OG1 2.66Å
799	R	87.9	Confident	87.6	Confident	68 Å²	68	45.8 Å²	45.8	26%	0.257	26%	0.255	S	S	.	.	H	α-helix	trans	-69.8	-48	179.1	-58.2	-177.9	175.7	176.9	-3.9	109.6	D568 I570 W576 D797 T803	D568-R799 VanDerWaalsContact CG-NH2 3.3Å; D568-R799 IonicContact OD1-NH2 2.73Å; D568-R799 PolarHBondContact OD1-NH2 3.02Å; D568-R799 IonicContact OD2-CZ 2.89Å; D568-R799 IonicContact OD2-NH2 3.27Å; D568-R799 PolarHBondContact OD2-NH2 2.88Å; I570-R799 HydrophobicContact CG1-CG 4.15Å; W576-R799 HydrophobicContact CG-CB 4.23Å; D797-R799 PolarHBondContact O-N 2.91Å; D797-R799 WeakPolarHBondContact OD1-CB 3.02Å; D797-R799 PolarHBondContact OD1-N 3.46Å; R799-T803 VanDerWaalsContact O-CB 3.32Å; R799-T803 WeakPolarHBondContact O-CB 3.38Å; R799-T803 PolarHBondContact O-N 3.16Å; R799-T803 VanDerWaalsContact O-N 3.1Å; R799-T803 PolarHBondContact O-OG1 3.17Å
800	V	88.7	Confident	87.9	Confident	38 Å²	38	42.4 Å²	42.4	23%	0.23	23%	0.232	C	C	.	.	H	α-helix	trans	-67	-43.7	178.6	-175.2	0	0	0	0	111.1	W576 T794 D797 T803 T804	W576-V800 HydrophobicContact CH2-CG2 3.98Å; W576-V800 HydrophobicContact CZ3-CG2 3.99Å; T794-V800 HydrophobicContact CG2-CG1 3.61Å; D797-V800 HydrophobicContact CB-CB 4.24Å; D797-V800 HydrophobicContact CB-CG2 3.98Å; D797-V800 PolarHBondContact O-N 3.12Å; V800-T803 PolarHBondContact O-N 2.69Å; V800-T804 WeakPolarHBondContact O-CB 3.35Å; V800-T804 PolarHBondContact O-N 3.23Å; V800-T804 PolarHBondContact O-OG1 3.5Å
801	Q	88.3	Confident	88	Confident	15 Å²	15	42.5 Å²	42.5	7%	0.07	23%	0.233	C	C	.	.	H	α-helix	trans	-59.1	-49.6	178.7	-169.1	-175.6	32.8	0	0	112.2	F791 D797 T804 M805	F791-Q801 HydrophobicContact CD2-CG 4.03Å; F791-Q801 HydrophobicContact CE2-CG 3.65Å; F791-Q801 HydrophobicContact CZ-CG 4.16Å; F791-Q801 VanDerWaalsContact CZ-NE2 3.25Å; D797-Q801 WeakPolarHBondContact O-CB 3.5Å; D797-Q801 PolarHBondContact O-N 3.17Å; Q801-T804 PolarHBondContact O-N 3.28Å; Q801-M805 PolarHBondContact O-N 3.26Å; Q801-M805 VanDerWaalsContact O-N 3.15Å
802	T	88.7	Confident	88.3	Confident	21 Å²	21	42.5 Å²	42.5	13%	0.129	23%	0.234	C	C	.	.	H	α-helix	trans	-66.1	-42.2	-178.9	-55.6	0	0	0	0	111.4	I570 F632 Y798 M805 C806	I570-T802 HydrophobicContact CD1-CG2 4.14Å; F632-T802 HydrophobicContact CB-CG2 4.24Å; Y798-T802 VanDerWaalsContact O-CB 3.31Å; Y798-T802 WeakPolarHBondContact O-CB 3.26Å; Y798-T802 PolarHBondContact O-N 3.27Å; Y798-T802 VanDerWaalsContact O-N 3.08Å; Y798-T802 PolarHBondContact O-OG1 2.66Å; T802-M805 PolarHBondContact O-N 3.43Å; T802-C806 PolarHBondContact O-N 2.85Å; T802-C806 VanDerWaalsContact O-N 3.12Å; T802-C806 PolarHBondContact O-SG 2.94Å
803	T	90.7	Very high	88.7	Confident	14 Å²	14	36.3 Å²	36.3	9%	0.086	21%	0.21	C	C	.	.	H	α-helix	trans	-60.3	-48.5	177.7	-58.8	0	0	0	0	111.2	W576 P580 R799 V800 M805 C806 I807	W576-T803 WeakPolarHBondContact O-CG2 3.31Å; W576-T803 PolarHBondContact O-OG1 3.08Å; P580-T803 HydrophobicContact CG-CG2 3.69Å; R799-T803 VanDerWaalsContact O-CB 3.32Å; R799-T803 WeakPolarHBondContact O-CB 3.38Å; R799-T803 PolarHBondContact O-N 3.16Å; R799-T803 VanDerWaalsContact O-N 3.1Å; R799-T803 PolarHBondContact O-OG1 3.17Å; V800-T803 PolarHBondContact O-N 2.69Å; T803-M805 VanDerWaalsContact C-N 3.33Å; T803-M805 PolarHBondContact O-N 3.04Å; T803-C806 PolarHBondContact O-N 3.21Å; T803-I807 HydrophobicContact CG2-CD1 3.99Å; T803-I807 WeakPolarHBondContact O-CG1 3.5Å; T803-I807 PolarHBondContact O-N 3.38Å; T803-I807 VanDerWaalsContact O-N 3.1Å
804	T	89.6	Confident	89.1	Confident	26 Å²	26	33.4 Å²	33.4	16%	0.16	19%	0.188	C	C	.	.	H	α-helix	trans	-58	-46.5	179	-57.7	0	0	0	0	111.1	I790 V800 Q801 C806 I807 S808	I790-T804 HydrophobicContact CB-CG2 4.35Å; I790-T804 HydrophobicContact CG2-CG2 3.49Å; I790-T804 VanDerWaalsContact CG2-CG2 3.49Å; V800-T804 WeakPolarHBondContact O-CB 3.35Å; V800-T804 PolarHBondContact O-N 3.23Å; V800-T804 PolarHBondContact O-OG1 3.5Å; Q801-T804 PolarHBondContact O-N 3.28Å; T804-C806 PolarHBondContact O-N 3.12Å; T804-I807 PolarHBondContact O-N 3.35Å; T804-S808 PolarHBondContact O-N 3.17Å; T804-S808 PolarHBondContact O-OG 3.07Å; T804-S808 VanDerWaalsContact O-OG 3.14Å
805	M	89.5	Confident	89.5	Confident	7 Å²	7	33.1 Å²	33.1	3%	0.034	19%	0.186	C	C	.	.	H	α-helix	trans	-59.7	-44.4	178.4	-178.9	176.1	57.1	0	0	112.3	F632 L648 M739 F787 Q801 T802 T803 I807 S808 V809	F632-M805 HydrophobicContact CB-CE 4.4Å; F632-M805 HydrophobicContact CD1-CE 3.12Å; F632-M805 HydrophobicContact CD1-SD 4.46Å; F632-M805 HydrophobicContact CD2-CE 3.91Å; F632-M805 HydrophobicContact CE1-CE 3.1Å; F632-M805 HydrophobicContact CE1-SD 3.94Å; F632-M805 HydrophobicContact CE2-CE 3.89Å; F632-M805 HydrophobicContact CE2-SD 4.22Å; F632-M805 HydrophobicContact CG-CE 3.56Å; F632-M805 HydrophobicContact CZ-CE 3.51Å; F632-M805 HydrophobicContact CZ-SD 3.81Å; L648-M805 HydrophobicContact CD2-SD 4.32Å; M739-M805 HydrophobicContact CE-CE 4.27Å; M739-M805 HydrophobicContact CE-SD 3.34Å; M739-M805 WeakPolarHBondContact CE-SD 3.5Å; M739-M805 HydrophobicContact SD-CE 4.3Å; M739-M805 HydrophobicContact SD-SD 3.69Å; M739-M805 VanDerWaalsContact SD-SD 3.69Å; F787-M805 HydrophobicContact CE2-CB 4.24Å; F787-M805 HydrophobicContact CE2-CG 4.35Å; F787-M805 HydrophobicContact CZ-CG 4.39Å; Q801-M805 PolarHBondContact O-N 3.26Å; Q801-M805 VanDerWaalsContact O-N 3.15Å; T802-M805 PolarHBondContact O-N 3.43Å; T803-M805 VanDerWaalsContact C-N 3.33Å; T803-M805 PolarHBondContact O-N 3.04Å; M805-I807 VanDerWaalsContact C-N 3.32Å; M805-I807 PolarHBondContact O-N 3.32Å; M805-S808 PolarHBondContact O-N 2.98Å; M805-V809 HydrophobicContact CG-CG2 4.39Å; M805-V809 VanDerWaalsContact O-CG2 3.22Å; M805-V809 WeakPolarHBondContact O-CG2 3.47Å; M805-V809 PolarHBondContact O-N 2.87Å
806	C	92.3	Very high	90	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.007	17%	0.168	C	C	.	.	H	α-helix	trans	-62	-40.3	178.5	-64.1	0	0	0	0	112.4	P580 T629 F632 T802 T803 T804 S810	P580-C806 HydrophobicContact CB-CB 3.67Å; P580-C806 HydrophobicContact CG-CB 4.15Å; T629-C806 HydrophobicContact CG2-CB 3.94Å; F632-C806 VanDerWaalsContact CB-SG 3.56Å; T802-C806 PolarHBondContact O-N 2.85Å; T802-C806 VanDerWaalsContact O-N 3.12Å; T802-C806 PolarHBondContact O-SG 2.94Å; T803-C806 PolarHBondContact O-N 3.21Å; T804-C806 PolarHBondContact O-N 3.12Å; C806-S810 WeakPolarHBondContact O-CB 3.46Å; C806-S810 PolarHBondContact O-N 2.77Å; C806-S810 PolarHBondContact O-OG 3.45Å
807	I	92.5	Very high	90.8	Very high	67 Å²	67	25.7 Å²	25.7	34%	0.344	13%	0.133	S	C	.	.	H	α-helix	trans	-65.7	-46.6	177.5	-66.2	169.8	0	0	0	110.5	P580 I583 T803 T804 M805 V809 S810 L811	P580-I807 HydrophobicContact CB-CG1 4.48Å; P580-I807 HydrophobicContact CG-CD1 4.48Å; P580-I807 HydrophobicContact CG-CG1 4.11Å; I583-I807 HydrophobicContact CD1-CG1 4.32Å; T803-I807 HydrophobicContact CG2-CD1 3.99Å; T803-I807 WeakPolarHBondContact O-CG1 3.5Å; T803-I807 PolarHBondContact O-N 3.38Å; T803-I807 VanDerWaalsContact O-N 3.1Å; T804-I807 PolarHBondContact O-N 3.35Å; M805-I807 VanDerWaalsContact C-N 3.32Å; M805-I807 PolarHBondContact O-N 3.32Å; I807-V809 PolarHBondContact O-N 2.86Å; I807-S810 PolarHBondContact O-N 3.23Å; I807-L811 WeakPolarHBondContact O-CB 3.12Å; I807-L811 PolarHBondContact O-N 3.41Å
808	S	91.3	Very high	91.2	Very high	21 Å²	21	24.8 Å²	24.8	15%	0.147	14%	0.138	C	C	.	.	H	α-helix	trans	-63.6	-40.1	179.8	-59.5	0	0	0	0	113	F787 T804 M805 S812	F787-S808 WeakPolarHBondContact CD2-OG 3.31Å; T804-S808 PolarHBondContact O-N 3.17Å; T804-S808 PolarHBondContact O-OG 3.07Å; T804-S808 VanDerWaalsContact O-OG 3.14Å; M805-S808 PolarHBondContact O-N 2.98Å; S808-S812 PolarHBondContact O-N 3.07Å; S808-S812 PolarHBondContact O-OG 2.95Å
809	V	91.9	Very high	91.5	Very high	5 Å²	5	24.4 Å²	24.4	3%	0.03	14%	0.139	C	C	.	.	H	α-helix	trans	-64.1	-46.4	175.3	174.6	0	0	0	0	110.7	C625 M628 L648 F652 M805 I807 L811 S812 G813	C625-V809 HydrophobicContact CB-CG1 4.04Å; C625-V809 WeakPolarHBondContact O-CG1 3.16Å; M628-V809 HydrophobicContact CB-CG1 4.38Å; L648-V809 HydrophobicContact CD1-CG2 3.67Å; F652-V809 HydrophobicContact CE2-CG2 4.09Å; F652-V809 HydrophobicContact CZ-CB 4.14Å; F652-V809 HydrophobicContact CZ-CG1 3.97Å; F652-V809 HydrophobicContact CZ-CG2 3.81Å; M805-V809 HydrophobicContact CG-CG2 4.39Å; M805-V809 VanDerWaalsContact O-CG2 3.22Å; M805-V809 WeakPolarHBondContact O-CG2 3.47Å; M805-V809 PolarHBondContact O-N 2.87Å; I807-V809 PolarHBondContact O-N 2.86Å; V809-L811 PolarHBondContact O-N 3.14Å; V809-S812 WeakPolarHBondContact O-CB 3.41Å; V809-S812 PolarHBondContact O-N 3.14Å; V809-G813 PolarHBondContact O-N 3.47Å
810	S	94.1	Very high	91.5	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-64.1	-41.2	179	-61.1	0	0	0	0	112.2	Y626 T629 C806 I807 S812 G813 F814	Y626-S810 WeakPolarHBondContact CE1-O 3.43Å; T629-S810 PolarHBondContact OG1-OG 3.15Å; C806-S810 WeakPolarHBondContact O-CB 3.46Å; C806-S810 PolarHBondContact O-N 2.77Å; C806-S810 PolarHBondContact O-OG 3.45Å; I807-S810 PolarHBondContact O-N 3.23Å; S810-S812 VanDerWaalsContact C-N 3.29Å; S810-S812 PolarHBondContact O-N 2.99Å; S810-G813 PolarHBondContact O-N 3.04Å; S810-G813 VanDerWaalsContact O-N 3.13Å; S810-F814 VanDerWaalsContact O-CD2 3.27Å; S810-F814 WeakPolarHBondContact O-CD2 3.44Å; S810-F814 PolarHBondContact O-N 2.9Å; S810-F814 VanDerWaalsContact O-N 3.1Å
811	L	93.4	Very high	91.7	Very high	80 Å²	80	19.4 Å²	19.4	42%	0.419	12%	0.116	S	C	.	.	H	α-helix	trans	-61	-39	177.7	-173.9	65.6	0	0	0	111.8	I783 I807 V809 G813 F814 V815	I783-L811 HydrophobicContact CD1-CD2 3.74Å; I783-L811 HydrophobicContact CD1-CG 3.76Å; I783-L811 HydrophobicContact CG1-CD2 3.83Å; I783-L811 HydrophobicContact CG1-CG 4.41Å; I783-L811 HydrophobicContact CG2-CD2 4.23Å; I807-L811 WeakPolarHBondContact O-CB 3.12Å; I807-L811 PolarHBondContact O-N 3.41Å; V809-L811 PolarHBondContact O-N 3.14Å; L811-G813 VanDerWaalsContact C-N 3.29Å; L811-G813 PolarHBondContact O-N 3.35Å; L811-F814 PolarHBondContact O-N 2.76Å; L811-F814 VanDerWaalsContact O-N 3.13Å; L811-V815 WeakPolarHBondContact O-CG2 3.5Å; L811-V815 PolarHBondContact O-N 2.61Å
812	S	92.1	Very high	91.7	Very high	4 Å²	4	21.1 Å²	21.1	3%	0.028	13%	0.132	C	C	.	.	H	α-helix	trans	-61	-37.9	175.7	-60.5	0	0	0	0	112.2	S808 V809 S810 V816	S808-S812 PolarHBondContact O-N 3.07Å; S808-S812 PolarHBondContact O-OG 2.95Å; V809-S812 WeakPolarHBondContact O-CB 3.41Å; V809-S812 PolarHBondContact O-N 3.14Å; S810-S812 VanDerWaalsContact C-N 3.29Å; S810-S812 PolarHBondContact O-N 2.99Å; S812-V816 PolarHBondContact O-N 3.14Å
813	G	93.2	Very high	91.6	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.01	14%	0.135	C	C	.	.	H	α-helix	trans	-64	-43.4	171.7	0	0	0	0	0	112.9	V809 S810 L811 V815 V816 L817	V809-G813 PolarHBondContact O-N 3.47Å; S810-G813 PolarHBondContact O-N 3.04Å; S810-G813 VanDerWaalsContact O-N 3.13Å; L811-G813 VanDerWaalsContact C-N 3.29Å; L811-G813 PolarHBondContact O-N 3.35Å; G813-V815 VanDerWaalsContact C-N 3.33Å; G813-V815 PolarHBondContact O-N 2.91Å; G813-V816 PolarHBondContact O-N 3.48Å; G813-L817 PolarHBondContact O-N 3.47Å; G813-L817 VanDerWaalsContact O-N 3.08Å
814	F	94.9	Very high	91.5	Very high	58 Å²	58	21.5 Å²	21.5	25%	0.254	13%	0.134	S	C	.	.	H	α-helix	trans	-63.6	-36.5	178.2	-83.5	-70.5	0	0	0	112.9	I583 V586 G587 Y626 S810 L811 V816 L817 G818	I583-F814 HydrophobicContact CG2-CD2 4.37Å; I583-F814 HydrophobicContact CG2-CE2 3.67Å; I583-F814 WeakPolarHBondContact O-CE2 3.32Å; I583-F814 WeakPolarHBondContact O-CZ 3.36Å; V586-F814 HydrophobicContact CB-CZ 4.29Å; V586-F814 HydrophobicContact CG1-CE1 4.28Å; V586-F814 HydrophobicContact CG1-CZ 4.05Å; G587-F814 VanDerWaalsContact CA-CZ 3.46Å; Y626-F814 AromaticContact CE1-CD2 3.85Å; Y626-F814 HydrophobicContact CE1-CD2 3.85Å; Y626-F814 AromaticContact CE1-CE2 3.66Å; Y626-F814 HydrophobicContact CE1-CE2 3.66Å; Y626-F814 HydrophobicContact CE1-CZ 4.28Å; Y626-F814 WeakPolarHBondContact OH-CA 3.28Å; Y626-F814 WeakPolarHBondContact OH-CD1 3.5Å; Y626-F814 WeakPolarHBondContact OH-CD2 3.47Å; Y626-F814 VanDerWaalsContact OH-CG 3.28Å; Y626-F814 WeakPolarHBondContact OH-CG 3.43Å; Y626-F814 PolarHBondContact OH-N 2.98Å; Y626-F814 VanDerWaalsContact OH-N 3.1Å; S810-F814 VanDerWaalsContact O-CD2 3.27Å; S810-F814 WeakPolarHBondContact O-CD2 3.44Å; S810-F814 PolarHBondContact O-N 2.9Å; S810-F814 VanDerWaalsContact O-N 3.1Å; L811-F814 PolarHBondContact O-N 2.76Å; L811-F814 VanDerWaalsContact O-N 3.13Å; F814-V816 VanDerWaalsContact C-N 3.32Å; F814-V816 PolarHBondContact O-N 3.4Å; F814-L817 PolarHBondContact O-N 3.48Å; F814-G818 PolarHBondContact O-N 2.9Å
815	V	94.9	Very high	91.4	Very high	13 Å²	13	21.6 Å²	21.6	8%	0.079	13%	0.134	C	C	.	.	H	α-helix	trans	-60	-44.3	175.1	169.9	0	0	0	0	110.9	T776 T779 I783 L811 G813 C819	T776-V815 HydrophobicContact CG2-CG1 4.08Å; T779-V815 HydrophobicContact CG2-CG1 4.05Å; T779-V815 HydrophobicContact CG2-CG2 3.72Å; I783-V815 HydrophobicContact CD1-CG2 3.48Å; I783-V815 VanDerWaalsContact CD1-CG2 3.48Å; L811-V815 WeakPolarHBondContact O-CG2 3.5Å; L811-V815 PolarHBondContact O-N 2.61Å; G813-V815 VanDerWaalsContact C-N 3.33Å; G813-V815 PolarHBondContact O-N 2.91Å; V815-C819 WeakPolarHBondContact O-CB 3.25Å; V815-C819 PolarHBondContact O-N 2.86Å; V815-C819 PolarHBondContact O-SG 2.96Å
816	V	92.5	Very high	91.2	Very high	3 Å²	3	25 Å²	25	2%	0.018	15%	0.153	C	C	.	.	H	α-helix	trans	-63.7	-44.9	177.1	177.8	0	0	0	0	111	L618 V622 T776 S812 G813 F814 M820 F821	L618-V816 HydrophobicContact CD1-CG1 3.94Å; L618-V816 HydrophobicContact CD2-CG1 3.92Å; L618-V816 HydrophobicContact CG-CG1 3.91Å; V622-V816 HydrophobicContact CG2-CB 3.87Å; V622-V816 HydrophobicContact CG2-CG1 3.7Å; V622-V816 HydrophobicContact CG2-CG2 4.47Å; T776-V816 HydrophobicContact CG2-CG2 4.12Å; S812-V816 PolarHBondContact O-N 3.14Å; G813-V816 PolarHBondContact O-N 3.48Å; F814-V816 VanDerWaalsContact C-N 3.32Å; F814-V816 PolarHBondContact O-N 3.4Å; V816-M820 WeakPolarHBondContact O-CB 3.26Å; V816-M820 PolarHBondContact O-N 3.39Å; V816-M820 VanDerWaalsContact O-N 3.11Å; V816-F821 HydrophobicContact CG1-CD2 4.23Å; V816-F821 HydrophobicContact CG1-CE2 3.99Å
817	L	92.9	Very high	90.8	Very high	12 Å²	12	27 Å²	27	6%	0.063	16%	0.163	C	C	.	.	I	π-helix	trans	-62.7	-51.6	177.5	-68.7	176.7	0	0	0	112.2	C590 V594 L619 V622 Y626 G813 F814 F821 A822	C590-L817 HydrophobicContact CB-CD1 4.1Å; V594-L817 HydrophobicContact CG2-CD2 4.31Å; L619-L817 HydrophobicContact CD2-CD2 4.04Å; V622-L817 HydrophobicContact CG1-CD1 4.12Å; V622-L817 HydrophobicContact CG1-CD2 4.1Å; V622-L817 HydrophobicContact CG1-CG 3.92Å; Y626-L817 HydrophobicContact CE2-CD1 4.06Å; Y626-L817 WeakPolarHBondContact OH-CD1 3.34Å; G813-L817 PolarHBondContact O-N 3.47Å; G813-L817 VanDerWaalsContact O-N 3.08Å; F814-L817 PolarHBondContact O-N 3.48Å; L817-F821 HydrophobicContact CD2-CD2 4.44Å; L817-F821 CarbonylContact O-C 3.53Å; L817-F821 WeakPolarHBondContact O-CA 3.25Å; L817-F821 WeakPolarHBondContact O-CB 3.03Å; L817-F821 PolarHBondContact O-N 2.02Å; L817-F821 VanDerWaalsContact O-N 3.09Å; L817-A822 PolarHBondContact O-N 2.81Å
818	G	91.8	Very high	90.5	Very high	43 Å²	43	24.4 Å²	24.4	44%	0.443	15%	0.15	S	C	.	.	I	π-helix	trans	-69.6	-44.8	-174.8	0	0	0	0	0	113.1	F814 A822	F814-G818 PolarHBondContact O-N 2.9Å; G818-A822 WeakPolarHBondContact O-CB 3.05Å
819	C	90.5	Very high	90.1	Very high	16 Å²	16	27.8 Å²	27.8	11%	0.108	16%	0.164	C	C	.	.	I	π-helix	trans	-82.6	-34.3	-173.6	-57.4	0	0	0	0	112.6	F772 F775 T776 V815	F772-C819 WeakPolarHBondContact CB-O 3.5Å; F772-C819 WeakPolarHBondContact CD1-O 3.38Å; F775-C819 HydrophobicContact CD1-CB 3.75Å; F775-C819 WeakPolarHBondContact CD1-SG 3.42Å; F775-C819 HydrophobicContact CE1-CB 4.32Å; F775-C819 WeakPolarHBondContact CE1-SG 3.46Å; T776-C819 WeakPolarHBondContact OG1-CB 3.44Å; V815-C819 WeakPolarHBondContact O-CB 3.25Å; V815-C819 PolarHBondContact O-N 2.86Å; V815-C819 PolarHBondContact O-SG 2.96Å
820	M	88.7	Confident	89.7	Confident	1 Å²	1	35 Å²	35	1%	0.005	20%	0.195	C	C	.	.	I	π-helix	trans	-104.5	-40.9	-172.1	-163.1	-173.8	-173.8	0	0	113.6	L618 L659 K662 I773 V816	L618-M820 HydrophobicContact CD2-CE 4.03Å; L618-M820 HydrophobicContact CD2-SD 3.26Å; L618-M820 WeakPolarHBondContact CD2-SD 3.39Å; L659-M820 HydrophobicContact CD2-CE 3.87Å; L659-M820 HydrophobicContact CD2-SD 3.52Å; L659-M820 VanDerWaalsContact CD2-SD 3.52Å; K662-M820 HydrophobicContact CD-CE 3.56Å; I773-M820 HydrophobicContact CD1-CE 4.49Å; I773-M820 HydrophobicContact CG1-CE 4.12Å; V816-M820 WeakPolarHBondContact O-CB 3.26Å; V816-M820 PolarHBondContact O-N 3.39Å; V816-M820 VanDerWaalsContact O-N 3.11Å
821	F	91.1	Very high	89	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.209	C	C	.	.	I	π-helix	trans	-97.9	-35.9	-173	-72.6	-78.6	0	0	0	113.5	V594 F598 C615 L618 L619 V816 L817 K824 V825	V594-F821 HydrophobicContact CG1-CB 3.93Å; V594-F821 HydrophobicContact CG1-CD1 3.85Å; V594-F821 HydrophobicContact CG1-CG 4.01Å; F598-F821 HydrophobicContact CE1-CD1 4.08Å; F598-F821 AromaticContact CE1-CE1 3.93Å; F598-F821 HydrophobicContact CE1-CE1 3.93Å; F598-F821 HydrophobicContact CE2-CD1 4Å; F598-F821 AromaticContact CZ-CD1 3.57Å; F598-F821 HydrophobicContact CZ-CD1 3.57Å; F598-F821 AromaticContact CZ-CE1 3.92Å; F598-F821 HydrophobicContact CZ-CE1 3.92Å; C615-F821 HydrophobicContact CB-CE1 4.19Å; C615-F821 HydrophobicContact CB-CZ 4.41Å; L618-F821 HydrophobicContact CB-CZ 4.48Å; L618-F821 HydrophobicContact CD2-CE2 3.73Å; L618-F821 HydrophobicContact CD2-CZ 3.94Å; L618-F821 HydrophobicContact CG-CE2 4.02Å; L618-F821 HydrophobicContact CG-CZ 4.28Å; L619-F821 HydrophobicContact CD1-CE1 3.97Å; L619-F821 HydrophobicContact CD1-CZ 4.1Å; L619-F821 HydrophobicContact CD2-CD1 4.42Å; L619-F821 HydrophobicContact CD2-CD2 4.09Å; L619-F821 HydrophobicContact CD2-CE1 4.18Å; L619-F821 HydrophobicContact CD2-CE2 3.82Å; L619-F821 HydrophobicContact CD2-CG 4.37Å; L619-F821 HydrophobicContact CD2-CZ 3.87Å; L619-F821 HydrophobicContact CG-CE1 4Å; L619-F821 HydrophobicContact CG-CE2 4.04Å; L619-F821 HydrophobicContact CG-CZ 3.63Å; V816-F821 HydrophobicContact CG1-CD2 4.23Å; V816-F821 HydrophobicContact CG1-CE2 3.99Å; L817-F821 HydrophobicContact CD2-CD2 4.44Å; L817-F821 CarbonylContact O-C 3.53Å; L817-F821 WeakPolarHBondContact O-CA 3.25Å; L817-F821 WeakPolarHBondContact O-CB 3.03Å; L817-F821 PolarHBondContact O-N 2.02Å; L817-F821 VanDerWaalsContact O-N 3.09Å; F821-K824 WeakPolarHBondContact O-CB 3.36Å; F821-K824 PolarHBondContact O-N 3.35Å; F821-V825 WeakPolarHBondContact O-CG2 3.31Å; F821-V825 PolarHBondContact O-N 2.99Å
822	A	89.5	Confident	88.1	Confident	50 Å²	50	37.8 Å²	37.8	41%	0.413	21%	0.213	S	C	.	.	H	α-helix	trans	-57.7	-43	-179.5	0	0	0	0	0	113.5	L817 G818 K824 V825 N826	L817-A822 PolarHBondContact O-N 2.81Å; G818-A822 WeakPolarHBondContact O-CB 3.05Å; A822-K824 VanDerWaalsContact C-N 3.27Å; A822-K824 PolarHBondContact O-N 3.18Å; A822-V825 PolarHBondContact O-N 2.98Å; A822-N826 WeakPolarHBondContact O-CB 3.21Å; A822-N826 PolarHBondContact O-N 3.26Å
823	P	86.9	Confident	87	Confident	29 Å²	29	43.9 Å²	43.9	19%	0.188	24%	0.241	C	C	.	.	H	α-helix	trans	-61.6	-35.5	174.6	-22.5	33.9	0	0	0	112.7	F772 I827	F772-P823 HydrophobicContact CD1-CB 4.4Å; F772-P823 HydrophobicContact CD1-CG 3.8Å; F772-P823 HydrophobicContact CE1-CB 3.89Å; F772-P823 HydrophobicContact CE1-CG 3.55Å; F772-P823 HydrophobicContact CE2-CB 4.01Å; F772-P823 HydrophobicContact CE2-CG 4.44Å; F772-P823 HydrophobicContact CG-CG 4.37Å; F772-P823 HydrophobicContact CZ-CB 3.67Å; F772-P823 HydrophobicContact CZ-CG 3.9Å; P823-I827 VanDerWaalsContact O-CG1 3.29Å; P823-I827 WeakPolarHBondContact O-CG1 3.38Å; P823-I827 PolarHBondContact O-N 3.22Å; P823-I827 VanDerWaalsContact O-N 3.15Å
824	K	87.3	Confident	85.7	Confident	14 Å²	14	50.2 Å²	50.2	6%	0.061	27%	0.269	C	S	.	.	H	α-helix	trans	-73	-43.6	-179.9	-63.4	-176.5	-177.8	-167.1	0	111.8	F598 S610 E769 F821 A822 N826 I827 I828	F598-K824 HydrophobicContact CZ-CB 4.11Å; F598-K824 HydrophobicContact CZ-CD 4.24Å; S610-K824 VanDerWaalsContact CB-NZ 3.28Å; S610-K824 PolarHBondContact OG-NZ 2.75Å; E769-K824 IonicContact OE1-NZ 3.94Å; E769-K824 PolarHBondContact OE1-NZ 3.37Å; E769-K824 IonicContact OE2-NZ 3.66Å; F821-K824 WeakPolarHBondContact O-CB 3.36Å; F821-K824 PolarHBondContact O-N 3.35Å; A822-K824 VanDerWaalsContact C-N 3.27Å; A822-K824 PolarHBondContact O-N 3.18Å; K824-N826 VanDerWaalsContact C-N 3.32Å; K824-I827 PolarHBondContact O-N 2.94Å; K824-I828 VanDerWaalsContact O-CG1 3.27Å; K824-I828 WeakPolarHBondContact O-CG1 3.26Å; K824-I828 PolarHBondContact O-N 3.42Å
825	V	88.3	Confident	84.4	Confident	28 Å²	28	48.9 Å²	48.9	17%	0.17	26%	0.264	C	S	.	.	H	α-helix	trans	-63.3	-40.9	175.7	174.2	0	0	0	0	110.5	V594 V597 F598 F821 A822 I827 I828 M829	V594-V825 HydrophobicContact CG1-CG2 4.16Å; V594-V825 HydrophobicContact CG2-CG2 4.19Å; V597-V825 HydrophobicContact CG1-CG1 4.45Å; V597-V825 HydrophobicContact CG2-CG1 4.45Å; F598-V825 HydrophobicContact CD2-CG2 4.41Å; F598-V825 HydrophobicContact CE2-CG2 3.85Å; F821-V825 WeakPolarHBondContact O-CG2 3.31Å; F821-V825 PolarHBondContact O-N 2.99Å; A822-V825 PolarHBondContact O-N 2.98Å; V825-I827 PolarHBondContact O-N 3.14Å; V825-I828 PolarHBondContact O-N 2.81Å; V825-M829 HydrophobicContact CG1-CG 4.18Å; V825-M829 WeakPolarHBondContact O-CB 3.47Å; V825-M829 WeakPolarHBondContact O-CG 3.26Å; V825-M829 PolarHBondContact O-N 3.43Å
826	N	86.2	Confident	83.2	Confident	78 Å²	78	53.2 Å²	53.2	42%	0.417	29%	0.29	S	S	.	.	H	α-helix	trans	-59.7	-46.1	176.1	-172	-9.5	0	0	0	111.6	A822 K824 I828 M829 F830	A822-N826 WeakPolarHBondContact O-CB 3.21Å; A822-N826 PolarHBondContact O-N 3.26Å; K824-N826 VanDerWaalsContact C-N 3.32Å; N826-I828 PolarHBondContact O-N 3.33Å; N826-M829 PolarHBondContact O-N 3.01Å; N826-F830 PolarHBondContact O-N 3.36Å; N826-F830 WeakPolarHBondContact OD1-CD2 3.27Å
827	I	83.2	Confident	81.4	Confident	45 Å²	45	59 Å²	59	23%	0.231	33%	0.326	C	S	.	.	H	α-helix	trans	-61.7	-42.1	176.3	-66.7	164.9	0	0	0	111.6	L606 P823 K824 V825 Q831 K834	L606-I827 HydrophobicContact CD2-CB 4.15Å; L606-I827 HydrophobicContact CD2-CG2 3.91Å; P823-I827 VanDerWaalsContact O-CG1 3.29Å; P823-I827 WeakPolarHBondContact O-CG1 3.38Å; P823-I827 PolarHBondContact O-N 3.22Å; P823-I827 VanDerWaalsContact O-N 3.15Å; K824-I827 PolarHBondContact O-N 2.94Å; V825-I827 PolarHBondContact O-N 3.14Å; I827-Q831 CarbonylContact O-C 3.48Å; I827-Q831 PolarHBondContact O-N 3.12Å; I827-K834 HydrophobicContact CG2-CB 4.12Å
828	I	84.9	Confident	79.1	Confident	11 Å²	11	63.3 Å²	63.3	6%	0.056	36%	0.357	C	S	.	.	H	α-helix	trans	-66	-42.1	-179.6	-67.2	165.6	0	0	0	111.7	V597 F598 H601 L606 V607 K824 V825 N826	V597-I828 HydrophobicContact CG1-CB 4.47Å; V597-I828 HydrophobicContact CG1-CG2 3.92Å; F598-I828 HydrophobicContact CE2-CD1 4.32Å; H601-I828 HydrophobicContact CB-CG2 4.03Å; L606-I828 HydrophobicContact CD2-CD1 4.23Å; L606-I828 HydrophobicContact CD2-CG1 3.82Å; V607-I828 HydrophobicContact CG2-CD1 3.78Å; K824-I828 VanDerWaalsContact O-CG1 3.27Å; K824-I828 WeakPolarHBondContact O-CG1 3.26Å; K824-I828 PolarHBondContact O-N 3.42Å; V825-I828 PolarHBondContact O-N 2.81Å; N826-I828 PolarHBondContact O-N 3.33Å
829	M	83.5	Confident	76.5	Confident	92 Å²	92	69.3 Å²	69.3	45%	0.453	37%	0.373	S	S	.	.	H	α-helix	trans	-88	-41.1	-172.4	-68.4	-63.5	-64.6	0	0	113.7	V597 V825 N826	V597-M829 HydrophobicContact CG1-CG 4.49Å; V597-M829 HydrophobicContact CG1-SD 4.39Å; V597-M829 HydrophobicContact CG2-SD 4.36Å; V825-M829 HydrophobicContact CG1-CG 4.18Å; V825-M829 WeakPolarHBondContact O-CB 3.47Å; V825-M829 WeakPolarHBondContact O-CG 3.26Å; V825-M829 PolarHBondContact O-N 3.43Å; N826-M829 PolarHBondContact O-N 3.01Å
830	F	83.5	Confident	73.7	Confident	156 Å²	156	77 Å²	77	68%	0.684	41%	0.407	S	S	*	.	H	α-helix	trans	-113.6	-14	-168.9	-59.1	-74.9	0	0	0	113.9	N826 P832	N826-F830 PolarHBondContact O-N 3.36Å; N826-F830 WeakPolarHBondContact OD1-CD2 3.27Å; F830-P832 VanDerWaalsContact C-CD 3.48Å
831	Q	79.9	Confident	71	Confident	60 Å²	60	84.2 Å²	84.2	28%	0.28	45%	0.445	S	S	.	.			trans	-132.8	56.8	-179.2	-56.8	-175.8	5.6	0	0	113.2	I827 Q833 K834	I827-Q831 CarbonylContact O-C 3.48Å; I827-Q831 PolarHBondContact O-N 3.12Å; Q831-Q833 VanDerWaalsContact C-OE1 3.25Å; Q831-Q833 PolarHBondContact O-N 2.82Å; Q831-Q833 VanDerWaalsContact O-N 3.07Å; Q831-K834 HydrophobicContact CB-CD 4.46Å; Q831-K834 PolarHBondContact O-N 3.22Å; Q831-K834 VanDerWaalsContact OE1-CE 3.28Å
832	P	74.4	Confident	68.1	Low	80 Å²	80	92 Å²	92	52%	0.519	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-58.3	-25.4	-177.7	23.9	-33.6	0	0	0	113.6	F830 K834 N835	F830-P832 VanDerWaalsContact C-CD 3.48Å; P832-K834 PolarHBondContact O-N 3.47Å; P832-K834 VanDerWaalsContact O-N 3.17Å; P832-N835 VanDerWaalsContact O-CB 3.3Å; P832-N835 WeakPolarHBondContact O-CB 3.39Å; P832-N835 PolarHBondContact O-N 3.04Å
833	Q	68.3	Low	65.5	Low	132 Å²	132	96.2 Å²	96.2	62%	0.617	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-60.2	-21.7	174.6	66.1	-80.6	9.6	0	0	114	Q831	Q831-Q833 VanDerWaalsContact C-OE1 3.25Å; Q831-Q833 PolarHBondContact O-N 2.82Å; Q831-Q833 VanDerWaalsContact O-N 3.07Å
834	K	66.4	Low	62.9	Low	134 Å²	134	102.4 Å²	102.4	58%	0.583	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-90.6	1.8	176.1	-66.2	-175.5	-177.8	168.3	0	113.4	I827 Q831 P832	I827-K834 HydrophobicContact CG2-CB 4.12Å; Q831-K834 HydrophobicContact CB-CD 4.46Å; Q831-K834 PolarHBondContact O-N 3.22Å; Q831-K834 VanDerWaalsContact OE1-CE 3.28Å; P832-K834 PolarHBondContact O-N 3.47Å; P832-K834 VanDerWaalsContact O-N 3.17Å
835	N	67.9	Low	60.2	Low	30 Å²	30	112.3 Å²	112.3	16%	0.16	57%	0.57	C	S	.	*			trans	-102.3	55.1	-175.2	-167.8	20.8	0	0	0	112.5	T604 P605 L606 P832	T604-N835 WeakPolarHBondContact CB-ND2 3.41Å; T604-N835 VanDerWaalsContact CG2-ND2 3.33Å; T604-N835 WeakPolarHBondContact CG2-ND2 3.26Å; P605-N835 WeakPolarHBondContact CD-OD1 3.4Å; P605-N835 WeakPolarHBondContact CG-O 3.43Å; P605-N835 WeakPolarHBondContact CG-OD1 3.3Å; L606-N835 WeakPolarHBondContact CB-OD1 3.47Å; L606-N835 PolarHBondContact N-OD1 3.45Å; P832-N835 VanDerWaalsContact O-CB 3.3Å; P832-N835 WeakPolarHBondContact O-CB 3.39Å; P832-N835 PolarHBondContact O-N 3.04Å
836	V	68.7	Low	57.6	Low	103 Å²	103	120.6 Å²	120.6	62%	0.624	60%	0.604	S	S	*	*	S	Bend	trans	-119.5	151.9	-179.4	-67.9	0	0	0	0	112	S838	V836-S838 PolarHBondContact O-N 3.06Å; V836-S838 VanDerWaalsContact O-N 3.16Å
837	T	55	Low	54.9	Low	126 Å²	126	122.5 Å²	122.5	77%	0.773	62%	0.623	S	S	*	*			trans	-75.5	92.9	172.7	37.2	0	0	0	0	110.7	P605 H839	P605-T837 HydrophobicContact CB-CG2 3.69Å; T837-H839 PolarHBondContact O-N 3.12Å
838	S	45.4	Very low	52.5	Low	101 Å²	101	127 Å²	127	71%	0.706	65%	0.652	S	S	*	*			trans	-88	103.3	168.3	48.1	0	0	0	0	110.6	V836	V836-S838 PolarHBondContact O-N 3.06Å; V836-S838 VanDerWaalsContact O-N 3.16Å
839	H	37.3	Very low	49.9	Very low	170 Å²	170	132.2 Å²	132.2	79%	0.787	69%	0.69	S	S	*	*			trans	-148.9	105.7	163.1	-101.8	-74.2	0	0	0	110.9	T837	T837-H839 PolarHBondContact O-N 3.12Å
840	H	30.8	Very low	47.3	Very low	178 Å²	178	131.7 Å²	131.7	82%	0.824	71%	0.709	S	S	*	*				-178.5	117.9	117.3	-112.7	-93.2	0	0	0	109.8	N842	H840-N842 PolarHBondContact O-N 3.45Å
841	L	32.6	Very low	44.7	Very low	151 Å²	151	129.4 Å²	129.4	79%	0.791	72%	0.718	S	S	*	*			trans	-69.7	109.6	164.1	-82.4	153.2	0	0	0	108.1	L843	L841-L843 HydrophobicContact CD2-CD1 4.26Å; L841-L843 PolarHBondContact O-N 3.24Å
842	N	30.4	Very low	42.3	Very low	165 Å²	165	130.6 Å²	130.6	88%	0.882	74%	0.739	S	S	*	*			trans	-77.3	99.9	158.3	-102.9	-20.4	0	0	0	107.4	H840	H840-N842 PolarHBondContact O-N 3.45Å
843	L	33.8	Very low	40.2	Very low	138 Å²	138	133 Å²	133	72%	0.723	75%	0.752	S	S	*	*			trans	-115.8	80.5	168.7	-98.8	157.4	0	0	0	108.2	L841	L841-L843 HydrophobicContact CD2-CD1 4.26Å; L841-L843 PolarHBondContact O-N 3.24Å
844	N	33.4	Very low	38.3	Very low	159 Å²	159	132.5 Å²	132.5	85%	0.85	76%	0.758	S	S	*	*			trans	-120.9	132.1	155.8	-101	-12.8	0	0	0	107.5
845	R	31	Very low	36.5	Very low	221 Å²	221	136.5 Å²	136.5	83%	0.834	77%	0.771	S	S	*	*			trans	82.1	95.2	-174.5	-62.4	-180	-175.5	153.7	2.4	115.2
846	F	32.1	Very low	34.7	Very low	203 Å²	203	139.4 Å²	139.4	89%	0.89	80%	0.799	S	S	*	*				-170.6	105.3	85.1	-92.1	-79.5	0	0	0	108.3
847	S	29.5	Very low	32.8	Very low	117 Å²	117	139.2 Å²	139.2	82%	0.818	80%	0.802	S	S	*	*			trans	-93.4	126.6	163.7	68.4	0	0	0	0	108.9
848	V	33.2	Very low	31.5	Very low	139 Å²	139	142 Å²	142	84%	0.842	81%	0.806	S	S	*	*			trans	-84.6	130.1	159.9	172.4	0	0	0	0	107.5
849	S	31.7	Very low	30.8	Very low	121 Å²	121	141 Å²	141	85%	0.846	80%	0.804	S	S	*	*			trans	-172.5	131.2	147.6	-80.8	0	0	0	0	112
850	G	28.9	Very low	30.3	Very low	82 Å²	82	138 Å²	138	85%	0.845	80%	0.802	S	S	*	*			trans	97.5	125.8	135.4	0	0	0	0	0	118.3
851	A	28.9	Very low	30.4	Very low	107 Å²	107	136.2 Å²	136.2	88%	0.884	80%	0.803	S	S	*	*			trans	-72	144.3	179.4	0	0	0	0	0	114.3
852	A	29.4	Very low	30.1	Very low	86 Å²	86	134.2 Å²	134.2	71%	0.711	80%	0.802	S	S	*	*				172.2	133.7	123	0	0	0	0	0	112.1
853	T	28.9	Very low	30	Very low	131 Å²	131	130 Å²	130	80%	0.804	79%	0.79	S	S	*	*			trans	71.5	128.4	149.8	47.8	0	0	0	0	122.5
854	T	29.6	Very low	29.6	Very low	121 Å²	121	131.7 Å²	131.7	74%	0.742	79%	0.794	S	S	*	*			trans	96.9	98.7	142.8	4.3	0	0	0	0	120.3
855	Y	28.8	Very low	29.2	Very low	218 Å²	218	133.4 Å²	133.4	86%	0.855	79%	0.794	S	S	*	*			trans	52	129.7	134.4	-78.9	-91.1	0	0	0	123
856	A	29.7	Very low	29	Very low	91 Å²	91	128.4 Å²	128.4	75%	0.752	79%	0.788	S	S	*	*			trans	69.7	142.4	146	0	0	0	0	0	116.5
857	S	28.4	Very low	29.4	Very low	98 Å²	98	123.3 Å²	123.3	69%	0.685	78%	0.775	S	S	*	*			cis	179.8	145.1	-4.3	42.8	0	0	0	0	106
858	H	28.6	Very low	29.4	Very low	186 Å²	186	124.5 Å²	124.5	86%	0.861	78%	0.778	S	S	*	*			trans	73.4	137.4	147.8	-88.2	-81	0	0	0	123.4
859	A	30.8	Very low	29.2	Very low	80 Å²	80	123.8 Å²	123.8	66%	0.661	77%	0.773	S	S	*	*			trans	79.6	100.5	149.7	0	0	0	0	0	117.3
860	S	26.4	Very low	28.9	Very low	105 Å²	105	124.3 Å²	124.3	73%	0.734	78%	0.775	S	S	*	*				60.7	115.2	70.4	78.5	0	0	0	0	113.6
861	V	32	Very low	29	Very low	142 Å²	142	128.2 Å²	128.2	86%	0.861	78%	0.777	S	S	*	*				-174.2	140.2	118	154.6	0	0	0	0	109.1
862	S	26.2	Very low	29	Very low	109 Å²	109	126.5 Å²	126.5	76%	0.762	77%	0.769	S	S	*	*			trans	-91.1	165.5	-168.3	-35	0	0	0	0	112.7
863	A	28.5	Very low	28.9	Very low	75 Å²	75	133.9 Å²	133.9	62%	0.62	78%	0.779	S	S	*	*				111.5	125.7	124.4	0	0	0	0	0	121.5
864	H	26.8	Very low	28.9	Very low	174 Å²	174	135.6 Å²	135.6	81%	0.806	78%	0.778	S	S	*	*			trans	75	131.5	142.9	-62.1	-53.1	0	0	0	117.3
865	F	24.8	Very low	28.8	Very low	196 Å²	196	137.1 Å²	137.1	86%	0.86	78%	0.78	S	S	*	*				-163.6	167.2	53.8	-156.8	-102.8	0	0	0	113
866	V	25.6	Very low	28.9	Very low	116 Å²	116	131.9 Å²	131.9	70%	0.703	77%	0.77	S	S	*	*			trans	-95.9	-172.4	-168.9	169.3	0	0	0	0	109.8
867	P	40.1	Very low	28.7	Very low	95 Å²	95	134.8 Å²	134.8	62%	0.617	77%	0.773	S	S	*	*			cis	-125.8	178.8	-26	24.5	-2.1	0	0	0	113.9
868	T	31	Very low	28.7	Very low	143 Å²	143	134.8 Å²	134.8	88%	0.877	77%	0.773	S	S	*	*				179.2	144.1	111.2	27.2	0	0	0	0	113.8
869	V	28.3	Very low	28.8	Very low	124 Å²	124	132.6 Å²	132.6	75%	0.752	77%	0.773	S	S	*	*			trans	-95.3	150.8	-174.5	172.6	0	0	0	0	109
870	C	26.3	Very low	28.9	Very low	132 Å²	132	135.1 Å²	135.1	89%	0.892	78%	0.78	S	S	*	*			trans	-169.6	120.9	130.4	-105.5	0	0	0	0	113.7
871	N	29.5	Very low	28.9	Very low	163 Å²	163	135.3 Å²	135.3	87%	0.872	78%	0.782	S	S	*	*			trans	-49.4	160.8	163.6	-92.7	-27.3	0	0	0	114.3
872	G	28.4	Very low	28.8	Very low	71 Å²	71	133.7 Å²	133.7	73%	0.732	78%	0.777	S	S	*	*				142.3	82.2	128	0	0	0	0	0	118.8
873	R	28.2	Very low	29	Very low	242 Å²	242	140.4 Å²	140.4	91%	0.913	80%	0.803	S	S	*	*				65.5	133	125.8	-126.8	174.8	-170.9	169.4	1.3	122.1
874	E	28.9	Very low	29	Very low	166 Å²	166	143.7 Å²	143.7	78%	0.776	81%	0.812	S	S	*	*			trans	-45.7	144	165.6	-66.2	164.1	138.7	0	0	115
875	I	27.6	Very low	29.1	Very low	154 Å²	154	142.1 Å²	142.1	79%	0.79	81%	0.812	S	S	*	*			trans	-123.9	112.6	150.5	-63	174	0	0	0	106.3
876	V	30.3	Very low	29.3	Very low	108 Å²	108	139.1 Å²	139.1	66%	0.655	81%	0.81	S	S	*	*			trans	-84.2	122.2	162.8	176.6	0	0	0	0	105.7
877	D	25.9	Very low	29.6	Very low	151 Å²	151	140.4 Å²	140.4	81%	0.807	82%	0.816	S	S	*	*			trans	-126.1	121.6	156.3	-104.9	-27.1	0	0	0	109.3
878	S	29.3	Very low	28.9	Very low	99 Å²	99	143.3 Å²	143.3	69%	0.692	83%	0.828	S	S	*	*			trans	-96.8	119	175.3	-48.6	0	0	0	0	106.5
879	T	30	Very low	28.8	Very low	140 Å²	140	143.3 Å²	143.3	86%	0.859	83%	0.825	S	S	*	*			trans	-140.6	113.8	153.3	33	0	0	0	0	109.6
880	T	31.7	Very low	28.8	Very low	132 Å²	132	144.6 Å²	144.6	81%	0.81	83%	0.83	S	S	*	*			trans	-44.6	142.8	161.2	42	0	0	0	0	113.4
881	S	27.8	Very low	29	Very low	109 Å²	109	145.6 Å²	145.6	76%	0.762	83%	0.826	S	S	*	*			trans	-167	112	132.3	-79.8	0	0	0	0	110.3
882	S	30.4	Very low	28.9	Very low	109 Å²	109	144.2 Å²	144.2	76%	0.762	82%	0.822	S	S	*	*			trans	25.7	104.3	135.7	50.4	0	0	0	0	118.4
883	L	28.9	Very low	29	Very low	249 Å²	249	150.8 Å²	150.8	100%	1.304	83%	0.83	S	S	*	*				-168.5	0	114.6	-103.9	158.2	0	0	0	110.1

Retrieved 883 of 883 residues in 314.4 ms (Link to these results)

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