A0A3Q0KMG2_SCHMA Loading...

Putative high voltage-activated calcium channel beta subunit 1

AlphaFold DB , UniProt , Accession A0A3Q0KMG2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 799 aa.

						>A0A3Q0KMG2_SCHMA|A0A3Q0KMG2
SSRRSSESTSSVDSEVILEAERLELERLALKELELAVSKPVAFSVRTNISFDGALYGLDAPSPTRVVSFGIKDFLHIKKRFNQDWWIGRVVRIGSPIGFIPSPSKLEVINNIILSAITTAANTNVVHFANEIQNPTTKPAPVGGFGSADTTLERGGNRGLLLSSDVDHRGPTLSANRQRQSESPPVHKNWKDVDAYDEDDLRDTPQTVEVPGQPTTKKPQPVGPGVKKRPFSKKNEFVPPYEIVPCMRPVVFVGPALKGYEVTDMMQKAIFDAMKKHFDGRIIVSRVSTNISLAKRVGELLHLDKKNILEKGRSRQLVSLIEVQQDLERIFHLGSKMQLLLLDCDTINHPNQITKTCLAPIVIYIKITSIRVLNRLIKNRGKLQKKNAGVQTAAAEKLLQCSPESFDYVIDQNNLSTATEALSHFLEGYWAATHPPLIVSKAERLLGSFSAPVPETKEVDSDRPLVPMTPGHPGLSVVTKSALSAGFTSQEISELTGARATGWLTENGGQVENELGLTGVHHAGSVGSEFHNTHFGGRKLKTDHNNSPDGLNTTHYSDDENEGSRPNYPRNGRLHMGAASAAAIAAVAAGLTPKVHSLHPSLFQGENKRNGSVIRDINGNTTHESPGLTMGLGLGIANGVAATISAALFPSHNSTNHHQHHSAENYHQPTSRIPPPTIAAAAVASVVSPPLKDLGIHQVEGSDGTQVYQSRSARQAKQREEQLARVKQEVEAKALALQATAGGRRRRRDKERRQRNPDGYWDSHDERYHAHGTNDLSQHSHQWNGPPVRSMARACPPDD
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	S	40.7	Very low	52	Low	176 Å²	176	137.8 Å²	137.8	100%	1.231	77%	0.772	S	S	*	*				0	163.2	0	-53.7	0	0	0	0	110.6
2	S	47.5	Very low	53.2	Low	118 Å²	118	132.6 Å²	132.6	83%	0.825	75%	0.745	S	S	*	*			trans	67.7	96.9	178.9	-160.3	0	0	0	0	117
3	R	50.2	Low	54.7	Low	252 Å²	252	130.2 Å²	130.2	95%	0.951	73%	0.73	S	S	*	*			trans	161.4	78.3	146.9	-91.5	175.4	-174.4	-152.7	1.3	110.4
4	R	50.6	Low	56.4	Low	251 Å²	251	125.8 Å²	125.8	95%	0.947	71%	0.712	S	S	*	*			trans	-159.4	64.3	169.5	-159.8	180	-170.1	-130.2	-1.3	113
5	S	49	Very low	58.3	Low	112 Å²	112	126.7 Å²	126.7	78%	0.783	71%	0.708	S	S	*	*			trans	-170.7	83.9	176.9	52.8	0	0	0	0	111
6	S	54.7	Low	60.1	Low	103 Å²	103	124.7 Å²	124.7	72%	0.72	70%	0.699	S	S	*	*			trans	-156	18.9	-179.9	61.9	0	0	0	0	115.4
7	E	53	Low	61.8	Low	178 Å²	178	123.2 Å²	123.2	83%	0.832	69%	0.688	S	S	*	*	S	Bend	trans	-119.1	3.1	-178.3	-75.2	169.9	112	0	0	113.2
8	S	53.1	Low	63.1	Low	87 Å²	87	122.7 Å²	122.7	61%	0.608	68%	0.683	S	S	*	*	S	Bend	trans	-104.2	3.8	-173.1	60	0	0	0	0	115
9	T	54.5	Low	64.5	Low	95 Å²	95	120.5 Å²	120.5	58%	0.583	67%	0.667	S	S	*	*	S	Bend	trans	-92.5	-44.1	-177.6	53.4	0	0	0	0	112.6	S11 V12	T9-S11 VanDerWaalsContact C-N 3.33Å; T9-S11 PolarHBondContact O-N 3.08Å; T9-V12 WeakPolarHBondContact O-CB 3.43Å; T9-V12 PolarHBondContact O-N 2.93Å
10	S	57.2	Low	65.7	Low	74 Å²	74	117.3 Å²	117.3	52%	0.517	66%	0.657	S	S	.	*	H	α-helix	trans	-70.9	-20.2	-172.5	51.3	0	0	0	0	115.3	S14	S10-S14 PolarHBondContact O-N 3.46Å; S10-S14 PolarHBondContact O-OG 3.34Å
11	S	61.3	Low	66.9	Low	70 Å²	70	117.7 Å²	117.7	49%	0.49	65%	0.653	S	S	.	*	H	α-helix	trans	-72.7	-34.1	172.7	69	0	0	0	0	111.8	T9 S14 E15	T9-S11 VanDerWaalsContact C-N 3.33Å; T9-S11 PolarHBondContact O-N 3.08Å; S11-S14 WeakPolarHBondContact O-CB 3.41Å; S11-S14 PolarHBondContact O-N 3.2Å; S11-E15 PolarHBondContact O-N 3.05Å
12	V	66.3	Low	69.2	Low	75 Å²	75	115.6 Å²	115.6	46%	0.455	62%	0.619	S	S	.	*	H	α-helix	trans	-66.1	-45.4	179.2	-175.4	0	0	0	0	110.2	T9 S14 E15 V16	T9-V12 WeakPolarHBondContact O-CB 3.43Å; T9-V12 PolarHBondContact O-N 2.93Å; V12-S14 PolarHBondContact O-N 2.93Å; V12-E15 PolarHBondContact O-N 3.31Å; V12-V16 HydrophobicContact CG1-CG2 4.45Å; V12-V16 WeakPolarHBondContact O-CG2 3.47Å; V12-V16 PolarHBondContact O-N 3.09Å
13	D	72.7	Confident	71.2	Confident	102 Å²	102	114.6 Å²	114.6	55%	0.545	60%	0.604	S	S	.	*	H	α-helix	trans	-57.8	-38.7	175.6	-59.6	-40	0	0	0	111.6	I17	D13-I17 WeakPolarHBondContact O-CD1 3.41Å; D13-I17 VanDerWaalsContact O-CG1 3.28Å; D13-I17 WeakPolarHBondContact O-CG1 3.43Å; D13-I17 PolarHBondContact O-N 3.32Å
14	S	78.8	Confident	73.2	Confident	68 Å²	68	106.6 Å²	106.6	48%	0.476	58%	0.577	S	S	.	*	H	α-helix	trans	-70.1	-41.6	179.3	-55.7	0	0	0	0	112.6	S10 S11 V12 I17 L18	S10-S14 PolarHBondContact O-N 3.46Å; S10-S14 PolarHBondContact O-OG 3.34Å; S11-S14 WeakPolarHBondContact O-CB 3.41Å; S11-S14 PolarHBondContact O-N 3.2Å; V12-S14 PolarHBondContact O-N 2.93Å; S14-I17 PolarHBondContact O-N 3.02Å; S14-L18 WeakPolarHBondContact O-CG 3.38Å; S14-L18 PolarHBondContact O-N 3.37Å; S14-L18 VanDerWaalsContact O-N 3.16Å
15	E	84.7	Confident	75.2	Confident	139 Å²	139	98.8 Å²	98.8	65%	0.65	55%	0.554	S	S	*	*	H	α-helix	trans	-67.4	-39.8	178.4	-172.7	169.7	-164.5	0	0	111.7	S11 V12 I17 L18 E19	S11-E15 PolarHBondContact O-N 3.05Å; V12-E15 PolarHBondContact O-N 3.31Å; E15-I17 PolarHBondContact O-N 2.88Å; E15-L18 PolarHBondContact O-N 2.83Å; E15-E19 PolarHBondContact O-N 3.09Å
16	V	87.4	Confident	77.3	Confident	95 Å²	95	95.5 Å²	95.5	58%	0.576	53%	0.526	S	S	*	.	H	α-helix	trans	-63.4	-39	175.2	170.6	0	0	0	0	112	V12 A20	V12-V16 HydrophobicContact CG1-CG2 4.45Å; V12-V16 WeakPolarHBondContact O-CG2 3.47Å; V12-V16 PolarHBondContact O-N 3.09Å; V16-A20 WeakPolarHBondContact O-CB 3.33Å; V16-A20 PolarHBondContact O-N 2.91Å
17	I	88.5	Confident	79.2	Confident	100 Å²	100	96.6 Å²	96.6	51%	0.513	51%	0.514	S	S	.	.	H	α-helix	trans	-65	-46.4	175.8	-69.8	164.5	0	0	0	110.8	D13 S14 E15 E19 A20 E21	D13-I17 WeakPolarHBondContact O-CD1 3.41Å; D13-I17 VanDerWaalsContact O-CG1 3.28Å; D13-I17 WeakPolarHBondContact O-CG1 3.43Å; D13-I17 PolarHBondContact O-N 3.32Å; S14-I17 PolarHBondContact O-N 3.02Å; E15-I17 PolarHBondContact O-N 2.88Å; I17-E19 PolarHBondContact O-N 3.24Å; I17-A20 WeakPolarHBondContact O-CB 3.38Å; I17-A20 PolarHBondContact O-N 3.37Å; I17-E21 WeakPolarHBondContact O-CG 3.48Å; I17-E21 PolarHBondContact O-N 2.84Å
18	L	86.5	Confident	81.2	Confident	114 Å²	114	92 Å²	92	60%	0.597	50%	0.495	S	S	*	.	H	α-helix	trans	-63.8	-40.2	-179.2	-70.8	169.4	0	0	0	112.7	S14 E15 E21 R22	S14-L18 WeakPolarHBondContact O-CG 3.38Å; S14-L18 PolarHBondContact O-N 3.37Å; S14-L18 VanDerWaalsContact O-N 3.16Å; E15-L18 PolarHBondContact O-N 2.83Å; L18-E21 PolarHBondContact O-N 3.02Å; L18-R22 WeakPolarHBondContact O-CB 3.24Å; L18-R22 PolarHBondContact O-N 3.41Å
19	E	88.1	Confident	83.2	Confident	81 Å²	81	87.9 Å²	87.9	38%	0.379	47%	0.466	S	S	.	.	H	α-helix	trans	-70.9	-32.5	175.3	-170.5	65.2	-171.6	0	0	111.6	E15 I17 R22 L23	E15-E19 PolarHBondContact O-N 3.09Å; I17-E19 PolarHBondContact O-N 3.24Å; E19-R22 VanDerWaalsContact CD-NH1 3.35Å; E19-R22 PolarHBondContact O-N 3.35Å; E19-R22 IonicContact OE1-CZ 2.64Å; E19-R22 IonicContact OE1-NH1 3.41Å; E19-R22 PolarHBondContact OE1-NH1 3.15Å; E19-R22 WeakPolarHBondContact OE2-CD 3.4Å; E19-R22 IonicContact OE2-CZ 2.73Å; E19-R22 IonicContact OE2-NE 3.37Å; E19-R22 IonicContact OE2-NH1 2.68Å; E19-R22 PolarHBondContact OE2-NH1 3.3Å; E19-L23 HydrophobicContact CG-CD1 4.27Å; E19-L23 WeakPolarHBondContact O-CB 3.31Å; E19-L23 VanDerWaalsContact O-CG 3.25Å; E19-L23 WeakPolarHBondContact O-CG 3.4Å; E19-L23 PolarHBondContact O-N 3.05Å
20	A	89.9	Confident	85.1	Confident	55 Å²	55	86.6 Å²	86.6	46%	0.455	46%	0.455	S	S	.	.	H	α-helix	trans	-65.9	-42.7	172.6	0	0	0	0	0	112.5	V16 I17 R22 L23 E24	V16-A20 WeakPolarHBondContact O-CB 3.33Å; V16-A20 PolarHBondContact O-N 2.91Å; I17-A20 WeakPolarHBondContact O-CB 3.38Å; I17-A20 PolarHBondContact O-N 3.37Å; A20-R22 VanDerWaalsContact C-N 3.33Å; A20-L23 PolarHBondContact O-N 3.25Å; A20-E24 PolarHBondContact O-N 3.34Å
21	E	90.2	Very high	86.9	Confident	126 Å²	126	88.6 Å²	88.6	59%	0.589	46%	0.455	S	S	*	.	H	α-helix	trans	-61	-42.1	172.8	-73	-177	168.1	0	0	111.6	I17 L18 E24 L25	I17-E21 WeakPolarHBondContact O-CG 3.48Å; I17-E21 PolarHBondContact O-N 2.84Å; L18-E21 PolarHBondContact O-N 3.02Å; E21-E24 PolarHBondContact O-N 3.26Å; E21-L25 WeakPolarHBondContact O-CB 3.15Å; E21-L25 PolarHBondContact O-N 3.42Å
22	R	88.7	Confident	88.4	Confident	133 Å²	133	87.6 Å²	87.6	50%	0.502	44%	0.442	S	S	.	.	H	α-helix	trans	-62.7	-44.8	176.3	-174.8	-164.8	-177.1	-164.4	-1	112.5	L18 E19 A20 L25 E26	L18-R22 WeakPolarHBondContact O-CB 3.24Å; L18-R22 PolarHBondContact O-N 3.41Å; E19-R22 VanDerWaalsContact CD-NH1 3.35Å; E19-R22 PolarHBondContact O-N 3.35Å; E19-R22 IonicContact OE1-CZ 2.64Å; E19-R22 IonicContact OE1-NH1 3.41Å; E19-R22 PolarHBondContact OE1-NH1 3.15Å; E19-R22 WeakPolarHBondContact OE2-CD 3.4Å; E19-R22 IonicContact OE2-CZ 2.73Å; E19-R22 IonicContact OE2-NE 3.37Å; E19-R22 IonicContact OE2-NH1 2.68Å; E19-R22 PolarHBondContact OE2-NH1 3.3Å; A20-R22 VanDerWaalsContact C-N 3.33Å; R22-L25 PolarHBondContact O-N 3.25Å; R22-E26 PolarHBondContact O-N 2.88Å
23	L	91	Very high	89.8	Confident	97 Å²	97	84.6 Å²	84.6	51%	0.508	42%	0.423	S	S	.	.	H	α-helix	trans	-66.4	-38.5	178.5	-73.4	168.3	0	0	0	112.1	E19 A20 E26 R27	E19-L23 HydrophobicContact CG-CD1 4.27Å; E19-L23 WeakPolarHBondContact O-CB 3.31Å; E19-L23 VanDerWaalsContact O-CG 3.25Å; E19-L23 WeakPolarHBondContact O-CG 3.4Å; E19-L23 PolarHBondContact O-N 3.05Å; A20-L23 PolarHBondContact O-N 3.25Å; L23-E26 PolarHBondContact O-N 3.49Å; L23-R27 WeakPolarHBondContact O-CB 3.23Å; L23-R27 PolarHBondContact O-N 3.24Å
24	E	92.1	Very high	90.7	Very high	83 Å²	83	86.6 Å²	86.6	39%	0.388	43%	0.429	S	S	.	.	H	α-helix	trans	-66.7	-39.8	172.9	174.5	58	-166.9	0	0	111.7	A20 E21 R27 L28	A20-E24 PolarHBondContact O-N 3.34Å; E21-E24 PolarHBondContact O-N 3.26Å; E24-R27 VanDerWaalsContact CD-NH2 3.31Å; E24-R27 WeakPolarHBondContact O-CB 3.41Å; E24-R27 PolarHBondContact O-N 3.23Å; E24-R27 IonicContact OE1-CZ 3.18Å; E24-R27 IonicContact OE1-NE 2.86Å; E24-R27 IonicContact OE1-NH2 2.68Å; E24-R27 PolarHBondContact OE1-NH2 3.01Å; E24-R27 IonicContact OE2-CZ 3.59Å; E24-R27 IonicContact OE2-NE 3.73Å; E24-R27 PolarHBondContact OE2-NE 3.14Å; E24-R27 IonicContact OE2-NH2 2.66Å; E24-R27 PolarHBondContact OE2-NH2 3.3Å; E24-L28 HydrophobicContact CG-CD1 4.25Å; E24-L28 WeakPolarHBondContact O-CG 3.35Å; E24-L28 PolarHBondContact O-N 3.13Å
25	L	91.3	Very high	91.4	Very high	88 Å²	88	87.3 Å²	87.3	46%	0.461	43%	0.428	S	S	.	.	H	α-helix	trans	-61.8	-43.6	173.6	-172.3	152.9	0	0	0	111.5	E21 R22 L28 A29 P61	E21-L25 WeakPolarHBondContact O-CB 3.15Å; E21-L25 PolarHBondContact O-N 3.42Å; R22-L25 PolarHBondContact O-N 3.25Å; L25-L28 PolarHBondContact O-N 3.27Å; L25-A29 VanDerWaalsContact O-CB 3.22Å; L25-A29 WeakPolarHBondContact O-CB 3.37Å; L25-A29 PolarHBondContact O-N 2.93Å; L25-P61 HydrophobicContact CD2-CB 3.82Å
26	E	94.1	Very high	91.8	Very high	43 Å²	43	80.7 Å²	80.7	20%	0.201	40%	0.397	C	S	.	.	H	α-helix	trans	-64.6	-40.6	174.6	178.5	157.6	-139.4	0	0	112	R22 L23 L28 A29 L30 P61 S62	R22-E26 PolarHBondContact O-N 2.88Å; L23-E26 PolarHBondContact O-N 3.49Å; E26-L28 VanDerWaalsContact C-N 3.32Å; E26-L28 PolarHBondContact O-N 3.02Å; E26-A29 WeakPolarHBondContact O-CB 3.46Å; E26-A29 PolarHBondContact O-N 3.32Å; E26-L30 HydrophobicContact CG-CD1 3.96Å; E26-L30 HydrophobicContact CG-CG 4.28Å; E26-L30 WeakPolarHBondContact O-CB 3.42Å; E26-L30 VanDerWaalsContact O-CG 3.29Å; E26-L30 WeakPolarHBondContact O-CG 3.44Å; E26-L30 PolarHBondContact O-N 3.35Å; E26-P61 VanDerWaalsContact CA-O 3.25Å; E26-P61 WeakPolarHBondContact CA-O 3.2Å; E26-S62 WeakPolarHBondContact OE1-CA 3.46Å; E26-S62 WeakPolarHBondContact OE1-CB 3.45Å; E26-S62 PolarHBondContact OE1-OG 3.13Å
27	R	94.2	Very high	92	Very high	125 Å²	125	79.2 Å²	79.2	47%	0.472	39%	0.388	S	S	.	.	H	α-helix	trans	-60.7	-40.4	175.3	-165.1	-163.8	64	67.5	2.4	112.2	L23 E24 K31	L23-R27 WeakPolarHBondContact O-CB 3.23Å; L23-R27 PolarHBondContact O-N 3.24Å; E24-R27 VanDerWaalsContact CD-NH2 3.31Å; E24-R27 WeakPolarHBondContact O-CB 3.41Å; E24-R27 PolarHBondContact O-N 3.23Å; E24-R27 IonicContact OE1-CZ 3.18Å; E24-R27 IonicContact OE1-NE 2.86Å; E24-R27 IonicContact OE1-NH2 2.68Å; E24-R27 PolarHBondContact OE1-NH2 3.01Å; E24-R27 IonicContact OE2-CZ 3.59Å; E24-R27 IonicContact OE2-NE 3.73Å; E24-R27 PolarHBondContact OE2-NE 3.14Å; E24-R27 IonicContact OE2-NH2 2.66Å; E24-R27 PolarHBondContact OE2-NH2 3.3Å; R27-K31 PolarHBondContact O-N 3.46Å
28	L	94.1	Very high	92.1	Very high	82 Å²	82	79 Å²	79	43%	0.429	40%	0.395	S	S	.	.	H	α-helix	trans	-70.9	-40.4	174.8	-70.1	170.1	0	0	0	112	E24 L25 E26 K31 E32	E24-L28 HydrophobicContact CG-CD1 4.25Å; E24-L28 WeakPolarHBondContact O-CG 3.35Å; E24-L28 PolarHBondContact O-N 3.13Å; L25-L28 PolarHBondContact O-N 3.27Å; E26-L28 VanDerWaalsContact C-N 3.32Å; E26-L28 PolarHBondContact O-N 3.02Å; L28-K31 PolarHBondContact O-N 2.96Å; L28-E32 PolarHBondContact O-N 2.93Å; L28-E32 VanDerWaalsContact O-N 3.1Å
29	A	95.2	Very high	92.4	Very high	0 Å²	0	76.2 Å²	76.2	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-60.5	-46.9	177.3	0	0	0	0	0	112.1	L25 E26 K31 E32 L33 P61 F81 F99	L25-A29 VanDerWaalsContact O-CB 3.22Å; L25-A29 WeakPolarHBondContact O-CB 3.37Å; L25-A29 PolarHBondContact O-N 2.93Å; E26-A29 WeakPolarHBondContact O-CB 3.46Å; E26-A29 PolarHBondContact O-N 3.32Å; A29-K31 VanDerWaalsContact C-N 3.32Å; A29-K31 PolarHBondContact O-N 3.29Å; A29-E32 PolarHBondContact O-N 2.99Å; A29-L33 PolarHBondContact O-N 3.46Å; A29-P61 HydrophobicContact CB-CB 3.53Å; A29-P61 WeakPolarHBondContact CB-O 3.45Å; A29-F81 HydrophobicContact CB-CE2 4.22Å; A29-F81 HydrophobicContact CB-CZ 4.02Å; A29-F99 HydrophobicContact CB-CE2 4.03Å; A29-F99 HydrophobicContact CB-CZ 3.73Å
30	L	94.8	Very high	92.7	Very high	68 Å²	68	77.4 Å²	77.4	36%	0.356	39%	0.393	S	S	.	.	H	α-helix	trans	-60.1	-39.9	176.3	-71.5	168.9	0	0	0	112.1	E26 L33 E34 R65	E26-L30 HydrophobicContact CG-CD1 3.96Å; E26-L30 HydrophobicContact CG-CG 4.28Å; E26-L30 WeakPolarHBondContact O-CB 3.42Å; E26-L30 VanDerWaalsContact O-CG 3.29Å; E26-L30 WeakPolarHBondContact O-CG 3.44Å; E26-L30 PolarHBondContact O-N 3.35Å; L30-L33 PolarHBondContact O-N 3.21Å; L30-E34 PolarHBondContact O-N 3.4Å; L30-E34 VanDerWaalsContact O-N 3.08Å; L30-R65 HydrophobicContact CD2-CG 3.75Å
31	K	94.7	Very high	93	Very high	117 Å²	117	75.8 Å²	75.8	51%	0.509	38%	0.377	S	S	.	.	H	α-helix	trans	-64.9	-38.8	175.9	-172.1	-179.8	179.4	-177.6	0	112.5	R27 L28 A29 E34 L35	R27-K31 PolarHBondContact O-N 3.46Å; L28-K31 PolarHBondContact O-N 2.96Å; A29-K31 VanDerWaalsContact C-N 3.32Å; A29-K31 PolarHBondContact O-N 3.29Å; K31-E34 PolarHBondContact O-N 3.3Å; K31-L35 HydrophobicContact CG-CD1 4.19Å; K31-L35 WeakPolarHBondContact O-CB 3.28Å; K31-L35 VanDerWaalsContact O-CG 3.28Å; K31-L35 WeakPolarHBondContact O-CG 3.36Å; K31-L35 PolarHBondContact O-N 3.14Å
32	E	94.3	Very high	93.3	Very high	49 Å²	49	70.1 Å²	70.1	23%	0.229	35%	0.352	C	S	.	.	H	α-helix	trans	-70.3	-31.5	175.4	-90.2	-72.5	174.4	0	0	113.3	L28 A29 A36 K39 K79 F81 I87	L28-E32 PolarHBondContact O-N 2.93Å; L28-E32 VanDerWaalsContact O-N 3.1Å; A29-E32 PolarHBondContact O-N 2.99Å; E32-A36 VanDerWaalsContact O-CB 3.29Å; E32-A36 WeakPolarHBondContact O-CB 3.39Å; E32-A36 PolarHBondContact O-N 2.95Å; E32-K39 IonicContact OE2-NZ 2.71Å; E32-K39 PolarHBondContact OE2-NZ 3.24Å; E32-K39 VanDerWaalsContact OE2-NZ 3.12Å; E32-K79 IonicContact OE1-NZ 2.93Å; E32-K79 PolarHBondContact OE1-NZ 3.23Å; E32-K79 WeakPolarHBondContact OE2-CD 3.37Å; E32-K79 IonicContact OE2-NZ 3.9Å; E32-K79 PolarHBondContact OE2-NZ 2.78Å; E32-F81 HydrophobicContact CB-CD2 4.2Å; E32-F81 HydrophobicContact CB-CE2 4.23Å; E32-F81 HydrophobicContact CG-CE2 4.49Å; E32-I87 HydrophobicContact CB-CD1 4.04Å
33	L	94.9	Very high	93.7	Very high	11 Å²	11	63.9 Å²	63.9	6%	0.058	33%	0.329	C	S	.	.	H	α-helix	trans	-63.8	-46.7	170.7	-67.9	-179.7	0	0	0	111.7	A29 L30 A36 V37 R65 I87 I97 F99	A29-L33 PolarHBondContact O-N 3.46Å; L30-L33 PolarHBondContact O-N 3.21Å; L33-A36 WeakPolarHBondContact O-CB 3.47Å; L33-A36 PolarHBondContact O-N 3.48Å; L33-V37 PolarHBondContact O-N 3.21Å; L33-R65 HydrophobicContact CD1-CB 3.51Å; L33-R65 HydrophobicContact CD1-CG 3.71Å; L33-I87 HydrophobicContact CD2-CB 4.34Å; L33-I87 HydrophobicContact CD2-CD1 4.15Å; L33-I87 HydrophobicContact CD2-CG1 3.91Å; L33-I87 HydrophobicContact CD2-CG2 3.63Å; L33-I97 HydrophobicContact CD2-CG2 4.3Å; L33-F99 HydrophobicContact CD1-CD2 4.16Å; L33-F99 HydrophobicContact CD1-CE2 3.58Å; L33-F99 HydrophobicContact CD1-CZ 4.02Å; L33-F99 HydrophobicContact CD2-CD1 4.35Å; L33-F99 HydrophobicContact CD2-CD2 4.35Å; L33-F99 HydrophobicContact CD2-CE1 3.97Å; L33-F99 HydrophobicContact CD2-CE2 3.98Å; L33-F99 HydrophobicContact CD2-CZ 3.74Å; L33-F99 HydrophobicContact CG-CE1 4.41Å; L33-F99 HydrophobicContact CG-CE2 3.82Å; L33-F99 HydrophobicContact CG-CZ 3.7Å
34	E	92.3	Very high	94	Very high	144 Å²	144	59.3 Å²	59.3	67%	0.673	31%	0.305	S	S	*	.	H	α-helix	trans	-58.9	-50.1	175.9	-177.7	175.4	-139.1	0	0	111	L30 K31 A36 V37	L30-E34 PolarHBondContact O-N 3.4Å; L30-E34 VanDerWaalsContact O-N 3.08Å; K31-E34 PolarHBondContact O-N 3.3Å; E34-A36 PolarHBondContact O-N 3.4Å; E34-V37 WeakPolarHBondContact O-CB 3.31Å; E34-V37 WeakPolarHBondContact O-CG2 3.48Å; E34-V37 PolarHBondContact O-N 3.41Å; E34-V37 VanDerWaalsContact O-N 3.13Å
35	L	92.6	Very high	94.2	Very high	84 Å²	84	55.4 Å²	55.4	44%	0.44	29%	0.287	S	S	.	.	H	α-helix	trans	-64.3	-9.1	174.5	-68.6	173.3	0	0	0	113.9	K31 K39	K31-L35 HydrophobicContact CG-CD1 4.19Å; K31-L35 WeakPolarHBondContact O-CB 3.28Å; K31-L35 VanDerWaalsContact O-CG 3.28Å; K31-L35 WeakPolarHBondContact O-CG 3.36Å; K31-L35 PolarHBondContact O-N 3.14Å; L35-K39 WeakPolarHBondContact O-CD 3.16Å; L35-K39 WeakPolarHBondContact O-CE 3.5Å; L35-K39 WeakPolarHBondContact O-CG 3.35Å; L35-K39 PolarHBondContact O-NZ 3.38Å
36	A	93.6	Very high	94.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-95.7	-9.7	176.1	0	0	0	0	0	114.1	E32 L33 E34 K39 K78 I87 I97	E32-A36 VanDerWaalsContact O-CB 3.29Å; E32-A36 WeakPolarHBondContact O-CB 3.39Å; E32-A36 PolarHBondContact O-N 2.95Å; L33-A36 WeakPolarHBondContact O-CB 3.47Å; L33-A36 PolarHBondContact O-N 3.48Å; E34-A36 PolarHBondContact O-N 3.4Å; A36-K39 HydrophobicContact CB-CD 4.4Å; A36-K39 PolarHBondContact O-N 2.88Å; A36-K78 HydrophobicContact CB-CB 4.35Å; A36-I87 HydrophobicContact CB-CB 4.43Å; A36-I87 HydrophobicContact CB-CG2 3.49Å; A36-I87 VanDerWaalsContact CB-CG2 3.49Å; A36-I97 HydrophobicContact CB-CG2 4.48Å
37	V	92.2	Very high	94.5	Very high	63 Å²	63	50.8 Å²	50.8	38%	0.382	26%	0.261	S	S	.	.	H	α-helix	trans	-63.1	-43.2	177.9	-179.7	0	0	0	0	111.5	L33 E34 I97 L437	L33-V37 PolarHBondContact O-N 3.21Å; E34-V37 WeakPolarHBondContact O-CB 3.31Å; E34-V37 WeakPolarHBondContact O-CG2 3.48Å; E34-V37 PolarHBondContact O-N 3.41Å; E34-V37 VanDerWaalsContact O-N 3.13Å; V37-I97 HydrophobicContact CB-CD1 4.45Å; V37-I97 HydrophobicContact CG2-CD1 4.29Å; V37-L437 HydrophobicContact CG1-CD2 4Å
38	S	89.5	Confident	94.5	Very high	97 Å²	97	47 Å²	47	68%	0.678	25%	0.25	S	S	*	.	S	Bend	trans	-84.9	-12.7	-179.4	55.3	0	0	0	0	114.8
39	K	93.1	Very high	94.5	Very high	55 Å²	55	45.6 Å²	45.6	24%	0.239	24%	0.243	C	C	.	.	S	Bend	trans	-67.5	148	179.5	-69.5	175.9	-172	131.9	0	110.6	E32 L35 A36 K78	E32-K39 IonicContact OE2-NZ 2.71Å; E32-K39 PolarHBondContact OE2-NZ 3.24Å; E32-K39 VanDerWaalsContact OE2-NZ 3.12Å; L35-K39 WeakPolarHBondContact O-CD 3.16Å; L35-K39 WeakPolarHBondContact O-CE 3.5Å; L35-K39 WeakPolarHBondContact O-CG 3.35Å; L35-K39 PolarHBondContact O-NZ 3.38Å; A36-K39 HydrophobicContact CB-CD 4.4Å; A36-K39 PolarHBondContact O-N 2.88Å; K39-K78 WeakPolarHBondContact O-CD 3.41Å; K39-K78 PolarHBondContact O-NZ 3.17Å
40	P	94.1	Very high	94.4	Very high	105 Å²	105	49.1 Å²	49.1	68%	0.682	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-62.6	165.7	173.7	27.8	-35.3	0	0	0	111.7	A42 K78	P40-A42 PolarHBondContact O-N 3.13Å; P40-K78 WeakPolarHBondContact O-CD 3.4Å
41	V	96.7	Very high	94.5	Very high	21 Å²	21	46.5 Å²	46.5	13%	0.127	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-73.7	116.3	168	-179.4	0	0	0	0	107.8	F43 H76 C246 M337	V41-F43 WeakPolarHBondContact CG1-O 3.46Å; V41-H76 HydrophobicContact CG1-CB 3.98Å; V41-H76 HydrophobicContact CG2-CB 4.16Å; V41-C246 HydrophobicContact CG1-CB 4.31Å; V41-M337 HydrophobicContact CB-SD 4.26Å; V41-M337 HydrophobicContact CG2-CE 4.24Å; V41-M337 HydrophobicContact CG2-SD 4.04Å
42	A	96.3	Very high	94.5	Very high	8 Å²	8	43.6 Å²	43.6	7%	0.066	24%	0.243	C	C	.	.			trans	-68.7	-51.2	179.1	0	0	0	0	0	110.2	P40 I77 S481 A485	P40-A42 PolarHBondContact O-N 3.13Å; A42-I77 WeakPolarHBondContact CB-O 3.32Å; A42-I77 PolarHBondContact N-O 3.48Å; A42-S481 WeakPolarHBondContact CA-OG 3.28Å; A42-S481 WeakPolarHBondContact O-CB 3.42Å; A42-S481 PolarHBondContact O-OG 3.13Å; A42-A485 HydrophobicContact CB-CB 3.52Å
43	F	96.8	Very high	94.4	Very high	1 Å²	1	41.5 Å²	41.5	0%	0.004	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	176	173.6	60.6	-87.9	0	0	0	110.7	V41 V45 I77 W86 V478 A482 F487 L495	V41-F43 WeakPolarHBondContact CG1-O 3.46Å; F43-V45 HydrophobicContact CD2-CG1 4.01Å; F43-V45 HydrophobicContact CE2-CG1 3.91Å; F43-I77 HydrophobicContact CD1-CB 4.39Å; F43-I77 HydrophobicContact CD2-CB 4.27Å; F43-I77 HydrophobicContact CD2-CG1 4.09Å; F43-I77 HydrophobicContact CE1-CB 4.16Å; F43-I77 HydrophobicContact CE1-CG2 3.9Å; F43-I77 HydrophobicContact CE2-CB 4.03Å; F43-I77 HydrophobicContact CE2-CG1 3.68Å; F43-I77 HydrophobicContact CE2-CG2 4.33Å; F43-I77 HydrophobicContact CG-CB 4.44Å; F43-I77 HydrophobicContact CZ-CB 3.98Å; F43-I77 HydrophobicContact CZ-CG1 4.01Å; F43-I77 HydrophobicContact CZ-CG2 3.79Å; F43-I77 PolarHBondContact O-N 3.29Å; F43-W86 HydrophobicContact CE2-CZ3 4.21Å; F43-W86 HydrophobicContact CZ-CH2 4.4Å; F43-W86 HydrophobicContact CZ-CZ3 4.18Å; F43-V478 HydrophobicContact CB-CB 4.43Å; F43-V478 HydrophobicContact CB-CG1 3.76Å; F43-V478 HydrophobicContact CB-CG2 3.99Å; F43-V478 HydrophobicContact CD1-CG1 4.29Å; F43-V478 HydrophobicContact CG-CG1 3.99Å; F43-A482 HydrophobicContact CD1-CB 3.8Å; F43-A482 HydrophobicContact CE1-CB 3.92Å; F43-F487 HydrophobicContact CE1-CD1 4.21Å; F43-F487 HydrophobicContact CE1-CD2 4.02Å; F43-F487 AromaticContact CE1-CE1 3.93Å; F43-F487 HydrophobicContact CE1-CE1 3.93Å; F43-F487 AromaticContact CE1-CE2 3.73Å; F43-F487 HydrophobicContact CE1-CE2 3.73Å; F43-F487 HydrophobicContact CE1-CG 4.26Å; F43-F487 AromaticContact CE1-CZ 3.71Å; F43-F487 HydrophobicContact CE1-CZ 3.71Å; F43-F487 HydrophobicContact CZ-CD1 4.33Å; F43-F487 AromaticContact CZ-CE1 3.85Å; F43-F487 HydrophobicContact CZ-CE1 3.85Å; F43-F487 HydrophobicContact CZ-CE2 4.4Å; F43-F487 AromaticContact CZ-CZ 3.91Å; F43-F487 HydrophobicContact CZ-CZ 3.91Å; F43-L495 HydrophobicContact CD2-CD1 4.47Å; F43-L495 HydrophobicContact CE2-CD1 3.67Å; F43-L495 HydrophobicContact CZ-CD1 3.98Å
44	S	97.3	Very high	94.2	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.014	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	146.9	178.9	-176.4	0	0	0	0	110.8	L75 V244	S44-L75 WeakPolarHBondContact CA-O 3.48Å; S44-L75 PolarHBondContact OG-O 3.16Å; S44-V244 PolarHBondContact O-N 3.25Å; S44-V244 VanDerWaalsContact O-N 3.12Å
45	V	96.7	Very high	94.1	Very high	0 Å²	0	43 Å²	43	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	147.9	174.4	-64.1	0	0	0	0	111.7	F43 F74 L75 Y241 E242 I243 L495	F43-V45 HydrophobicContact CD2-CG1 4.01Å; F43-V45 HydrophobicContact CE2-CG1 3.91Å; V45-F74 WeakPolarHBondContact O-CA 3.49Å; V45-L75 HydrophobicContact CG2-CB 3.85Å; V45-L75 HydrophobicContact CG2-CD1 4.2Å; V45-L75 HydrophobicContact CG2-CG 4.33Å; V45-L75 PolarHBondContact N-O 2.97Å; V45-L75 PolarHBondContact O-N 3.04Å; V45-Y241 HydrophobicContact CB-CG 4.43Å; V45-Y241 HydrophobicContact CG2-CD1 4.1Å; V45-Y241 HydrophobicContact CG2-CG 4.05Å; V45-E242 CarbonylContact C-O 3.59Å; V45-E242 WeakPolarHBondContact CA-O 3.26Å; V45-E242 WeakPolarHBondContact CB-O 3.32Å; V45-I243 HydrophobicContact CG1-CG1 4.5Å; V45-L495 HydrophobicContact CG1-CD2 4.19Å
46	R	95.9	Very high	93.9	Very high	35 Å²	35	43.6 Å²	43.6	13%	0.132	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	138.6	162	177.1	172.4	68	-162.6	-1.9	109.2	D73 F74 Y241 E242 V244	R46-D73 CarbonylContact C-O 3.49Å; R46-D73 WeakPolarHBondContact CA-O 3.26Å; R46-F74 HydrophobicContact CB-CD1 4.43Å; R46-F74 HydrophobicContact CB-CE1 4.24Å; R46-Y241 WeakPolarHBondContact O-CA 3.34Å; R46-E242 IonicContact CZ-OE1 3.94Å; R46-E242 IonicContact CZ-OE2 2.72Å; R46-E242 PolarHBondContact N-O 3.09Å; R46-E242 IonicContact NE-OE2 3.25Å; R46-E242 PolarHBondContact NE-OE2 2.91Å; R46-E242 IonicContact NH2-OE1 3.17Å; R46-E242 PolarHBondContact NH2-OE1 2.9Å; R46-E242 IonicContact NH2-OE2 3.12Å; R46-E242 PolarHBondContact NH2-OE2 3.44Å; R46-E242 PolarHBondContact O-N 2.77Å; R46-V244 HydrophobicContact CB-CG1 3.76Å
47	T	95.9	Very high	93.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	138.2	176.8	66.7	0	0	0	0	111.3	I49 F69 G70 K72 D73 L75 Y241	T47-I49 WeakPolarHBondContact CB-O 3.36Å; T47-F69 HydrophobicContact CG2-CD2 3.51Å; T47-F69 HydrophobicContact CG2-CE2 3.72Å; T47-F69 HydrophobicContact CG2-CG 4.07Å; T47-F69 HydrophobicContact CG2-CZ 4.43Å; T47-G70 PolarHBondContact OG1-O 3.23Å; T47-K72 VanDerWaalsContact O-CA 3.27Å; T47-K72 WeakPolarHBondContact O-CA 3.41Å; T47-K72 PolarHBondContact O-N 2.97Å; T47-K72 PolarHBondContact OG1-N 3.37Å; T47-K72 VanDerWaalsContact OG1-N 3.11Å; T47-D73 HydrophobicContact CG2-CB 4.3Å; T47-D73 PolarHBondContact N-O 3.39Å; T47-D73 PolarHBondContact OG1-N 3.43Å; T47-D73 PolarHBondContact OG1-O 3.33Å; T47-L75 HydrophobicContact CG2-CD1 3.72Å; T47-L75 HydrophobicContact CG2-CD2 4.46Å; T47-L75 HydrophobicContact CG2-CG 3.87Å; T47-Y241 HydrophobicContact CG2-CD1 4.2Å; T47-Y241 HydrophobicContact CG2-CE1 4.11Å
48	N	93.4	Very high	93.6	Very high	44 Å²	44	46.5 Å²	46.5	24%	0.235	27%	0.267	C	S	.	.	S	Bend	trans	-105.9	-8.9	171.3	-68.9	-44.5	0	0	0	112.7	V238 P239 P240	N48-V238 HydrophobicContact CB-CG1 3.74Å; N48-P239 WeakPolarHBondContact CB-O 3.46Å; N48-P239 PolarHBondContact ND2-O 3.43Å; N48-P240 PolarHBondContact N-O 3.17Å
49	I	93.3	Very high	93.7	Very high	53 Å²	53	46.2 Å²	46.2	27%	0.272	26%	0.258	S	S	.	.	S	Bend	trans	-125.5	162.1	172.1	66.7	169.3	0	0	0	110.1	T47 F69 L106 P240	T47-I49 WeakPolarHBondContact CB-O 3.36Å; I49-F69 WeakPolarHBondContact O-CE2 3.49Å; I49-L106 HydrophobicContact CD1-CB 4.49Å; I49-L106 HydrophobicContact CD1-CD1 4.03Å; I49-L106 HydrophobicContact CD1-CD2 4.01Å; I49-L106 HydrophobicContact CD1-CG 4.4Å; I49-P240 HydrophobicContact CD1-CB 3.91Å; I49-P240 HydrophobicContact CG1-CB 4.04Å
50	S	94.7	Very high	93.7	Very high	75 Å²	75	44 Å²	44	52%	0.524	25%	0.249	S	C	.	.			trans	-91.2	150.6	164.1	51.3	0	0	0	0	110.7	F69	S50-F69 CarbonylContact C-O 3.45Å; S50-F69 VanDerWaalsContact CA-O 3.29Å; S50-F69 WeakPolarHBondContact CA-O 3.27Å
51	F	96	Very high	93.7	Very high	12 Å²	12	39.3 Å²	39.3	5%	0.053	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-140	137.3	174.2	171.1	-102.3	0	0	0	109.5	V66 V67 S68 F69 W85 P101 L106 I109	F51-V66 HydrophobicContact CE1-CG1 3.7Å; F51-V66 HydrophobicContact CZ-CG1 4.08Å; F51-V67 WeakPolarHBondContact CD1-O 3.4Å; F51-S68 CarbonylContact O-C 3.22Å; F51-S68 VanDerWaalsContact O-CA 3.3Å; F51-S68 WeakPolarHBondContact O-CA 3.25Å; F51-F69 HydrophobicContact CB-CD1 4.2Å; F51-F69 HydrophobicContact CB-CD2 4.03Å; F51-F69 HydrophobicContact CB-CE1 3.71Å; F51-F69 HydrophobicContact CB-CE2 3.52Å; F51-F69 HydrophobicContact CB-CG 4.36Å; F51-F69 HydrophobicContact CB-CZ 3.35Å; F51-F69 HydrophobicContact CD1-CD1 4.23Å; F51-F69 AromaticContact CD1-CE1 3.8Å; F51-F69 HydrophobicContact CD1-CE1 3.8Å; F51-F69 HydrophobicContact CD1-CZ 4.26Å; F51-F69 HydrophobicContact CG-CE1 4.09Å; F51-F69 HydrophobicContact CG-CZ 4.07Å; F51-F69 PolarHBondContact N-O 3.11Å; F51-F69 PolarHBondContact O-N 3.37Å; F51-W85 HydrophobicContact CZ-CH2 4.16Å; F51-W85 HydrophobicContact CZ-CZ3 4.33Å; F51-P101 HydrophobicContact CD1-CG 3.91Å; F51-P101 HydrophobicContact CD2-CG 4.01Å; F51-P101 HydrophobicContact CE1-CG 3.78Å; F51-P101 HydrophobicContact CE2-CG 3.89Å; F51-P101 HydrophobicContact CG-CG 4.03Å; F51-P101 HydrophobicContact CZ-CB 4.42Å; F51-P101 HydrophobicContact CZ-CG 3.78Å; F51-L106 HydrophobicContact CD2-CD2 3.85Å; F51-L106 HydrophobicContact CE2-CD2 4.42Å; F51-L106 HydrophobicContact CG-CD2 4.4Å; F51-I109 HydrophobicContact CE2-CD1 4.03Å
52	D	94.5	Very high	93.6	Very high	57 Å²	57	38.3 Å²	38.3	31%	0.305	21%	0.213	S	C	.	.			trans	-117.4	112	173	-172.4	13.4	0	0	0	111.1	A54 L55 Y56 S68	D52-A54 PolarHBondContact O-N 3.46Å; D52-A54 PolarHBondContact OD1-N 3.2Å; D52-A54 VanDerWaalsContact OD1-N 3.14Å; D52-L55 HydrophobicContact CB-CB 4.47Å; D52-L55 HydrophobicContact CB-CD1 4.37Å; D52-L55 PolarHBondContact O-N 3.29Å; D52-Y56 WeakPolarHBondContact O-CD2 3.47Å; D52-Y56 PolarHBondContact O-N 2.88Å; D52-S68 WeakPolarHBondContact OD1-CB 3.23Å; D52-S68 PolarHBondContact OD1-OG 2.84Å
53	G	92.7	Very high	93.3	Very high	4 Å²	4	40 Å²	40	4%	0.041	22%	0.224	C	C	.	.	H	α-helix	trans	-63.8	-24.9	177.2	0	0	0	0	0	113.8	L55 G57 V66 S68	G53-L55 VanDerWaalsContact C-N 3.31Å; G53-L55 PolarHBondContact O-N 2.9Å; G53-G57 WeakPolarHBondContact O-CA 3.37Å; G53-G57 PolarHBondContact O-N 3.38Å; G53-V66 VanDerWaalsContact CA-CG1 3.46Å; G53-S68 PolarHBondContact N-OG 2.89Å
54	A	91.1	Very high	93.1	Very high	73 Å²	73	44.7 Å²	44.7	60%	0.603	25%	0.252	S	S	*	.	H	α-helix	trans	-70	-29	176.4	0	0	0	0	0	112.8	D52	D52-A54 PolarHBondContact O-N 3.46Å; D52-A54 PolarHBondContact OD1-N 3.2Å; D52-A54 VanDerWaalsContact OD1-N 3.14Å
55	L	89.6	Confident	93	Very high	113 Å²	113	50.7 Å²	50.7	59%	0.592	27%	0.274	S	S	*	.	H	α-helix	trans	-98	-35.6	-180	-65.3	175.2	0	0	0	112.9	D52 G53	D52-L55 HydrophobicContact CB-CB 4.47Å; D52-L55 HydrophobicContact CB-CD1 4.37Å; D52-L55 PolarHBondContact O-N 3.29Å; G53-L55 VanDerWaalsContact C-N 3.31Å; G53-L55 PolarHBondContact O-N 2.9Å
56	Y	89.6	Confident	93	Very high	97 Å²	97	51.9 Å²	51.9	38%	0.38	28%	0.282	S	S	.	.	H	α-helix	trans	-124.1	12.5	-168.6	-53.4	-69.9	0	0	0	113.9	D52 I109 I113	D52-Y56 WeakPolarHBondContact O-CD2 3.47Å; D52-Y56 PolarHBondContact O-N 2.88Å; Y56-I109 HydrophobicContact CD1-CG2 4.01Å; Y56-I109 HydrophobicContact CG-CG2 4.21Å; Y56-I113 HydrophobicContact CD1-CD1 4.13Å; Y56-I113 HydrophobicContact CE1-CD1 3.54Å; Y56-I113 HydrophobicContact CE1-CG1 3.9Å
57	G	88.4	Confident	93	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.28	C	S	.	.			trans	-115.7	15.7	179.3	0	0	0	0	0	114.9	G53 D59 A60	G53-G57 WeakPolarHBondContact O-CA 3.37Å; G53-G57 PolarHBondContact O-N 3.38Å; G57-D59 PolarHBondContact O-N 2.84Å; G57-A60 WeakPolarHBondContact O-CB 3.49Å; G57-A60 PolarHBondContact O-N 3.4Å
58	L	90.1	Very high	93.1	Very high	125 Å²	125	53.6 Å²	53.6	65%	0.654	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-19.4	-178.9	-61.7	178.6	0	0	0	113.5
59	D	91.4	Very high	93.3	Very high	91 Å²	91	52 Å²	52	49%	0.487	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	13.2	174	73.8	-32.4	0	0	0	113.1	G57 K105	G57-D59 PolarHBondContact O-N 2.84Å; D59-K105 VanDerWaalsContact OD2-CE 3.23Å; D59-K105 WeakPolarHBondContact OD2-CE 3.31Å; D59-K105 IonicContact OD2-NZ 3.84Å; D59-K105 PolarHBondContact OD2-NZ 3.39Å
60	A	93.8	Very high	93.5	Very high	8 Å²	8	50.9 Å²	50.9	7%	0.066	29%	0.291	C	S	.	.	S	Bend	trans	-73.2	156.1	175	0	0	0	0	0	111.9	G57 S62 P63 V66 W85	G57-A60 WeakPolarHBondContact O-CB 3.49Å; G57-A60 PolarHBondContact O-N 3.4Å; A60-S62 PolarHBondContact O-N 3.31Å; A60-P63 WeakPolarHBondContact O-CD 3.44Å; A60-V66 HydrophobicContact CB-CG2 3.29Å; A60-W85 HydrophobicContact CB-CD2 4.29Å; A60-W85 HydrophobicContact CB-CE3 4.44Å; A60-W85 HydrophobicContact CB-CH2 3.81Å; A60-W85 HydrophobicContact CB-CZ2 3.6Å; A60-W85 HydrophobicContact CB-CZ3 4.22Å
61	P	94	Very high	93.5	Very high	7 Å²	7	52.3 Å²	52.3	5%	0.045	29%	0.291	C	S	.	.	S	Bend	trans	-58.6	-22.8	179.5	-25.4	35	0	0	0	114.5	L25 E26 A29 F81 W85 F99	L25-P61 HydrophobicContact CD2-CB 3.82Å; E26-P61 VanDerWaalsContact CA-O 3.25Å; E26-P61 WeakPolarHBondContact CA-O 3.2Å; A29-P61 HydrophobicContact CB-CB 3.53Å; A29-P61 WeakPolarHBondContact CB-O 3.45Å; P61-F81 HydrophobicContact CB-CD1 4.19Å; P61-F81 HydrophobicContact CB-CE1 3.56Å; P61-F81 HydrophobicContact CB-CZ 3.89Å; P61-F81 HydrophobicContact CG-CD1 3.58Å; P61-F81 HydrophobicContact CG-CE1 3.33Å; P61-F81 HydrophobicContact CG-CZ 4.17Å; P61-W85 HydrophobicContact CG-CB 4.35Å; P61-W85 HydrophobicContact CG-CG 4.18Å; P61-F99 HydrophobicContact CB-CD2 4.5Å; P61-F99 HydrophobicContact CB-CE1 4.24Å; P61-F99 HydrophobicContact CB-CE2 4.03Å; P61-F99 HydrophobicContact CB-CZ 3.92Å; P61-F99 HydrophobicContact CG-CD1 4.3Å; P61-F99 HydrophobicContact CG-CE1 4.2Å; P61-F99 HydrophobicContact CG-CZ 4.37Å
62	S	93.6	Very high	93.4	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.32	C	S	.	.	S	Bend	trans	-144.6	107.1	161.2	174.2	0	0	0	0	107.8	E26 A60 T64 R65	E26-S62 WeakPolarHBondContact OE1-CA 3.46Å; E26-S62 WeakPolarHBondContact OE1-CB 3.45Å; E26-S62 PolarHBondContact OE1-OG 3.13Å; A60-S62 PolarHBondContact O-N 3.31Å; S62-T64 PolarHBondContact O-N 2.75Å; S62-T64 VanDerWaalsContact O-N 3.15Å; S62-T64 PolarHBondContact OG-OG1 2.99Å; S62-R65 PolarHBondContact O-N 3.06Å
63	P	91.1	Very high	93.6	Very high	44 Å²	44	58.8 Å²	58.8	29%	0.286	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-60	-25.1	-179	-27.2	37.1	0	0	0	113.3	A60 R65	A60-P63 WeakPolarHBondContact O-CD 3.44Å; P63-R65 PolarHBondContact O-N 2.89Å
64	T	91.7	Very high	93.8	Very high	98 Å²	98	60.3 Å²	60.3	60%	0.601	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-79.2	1.3	177.3	72.3	0	0	0	0	114.4	S62	S62-T64 PolarHBondContact O-N 2.75Å; S62-T64 VanDerWaalsContact O-N 3.15Å; S62-T64 PolarHBondContact OG-OG1 2.99Å
65	R	94.8	Very high	94.2	Very high	129 Å²	129	56.8 Å²	56.8	49%	0.487	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-131.8	23.1	-174.8	-64.7	-66.5	-175.5	-111.1	4.9	113.7	L30 L33 S62 P63 G98 F99	L30-R65 HydrophobicContact CD2-CG 3.75Å; L33-R65 HydrophobicContact CD1-CB 3.51Å; L33-R65 HydrophobicContact CD1-CG 3.71Å; S62-R65 PolarHBondContact O-N 3.06Å; P63-R65 PolarHBondContact O-N 2.89Å; R65-G98 CarbonylContact O-C 3.56Å; R65-G98 WeakPolarHBondContact O-CA 3.34Å; R65-F99 HydrophobicContact CB-CD2 4.24Å; R65-F99 HydrophobicContact CB-CE2 4.47Å; R65-F99 PolarHBondContact O-N 2.88Å
66	V	97.1	Very high	94.6	Very high	25 Å²	25	51.5 Å²	51.5	15%	0.152	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-83.6	141.5	177	-168.8	0	0	0	0	111.1	F51 G53 A60 W85	F51-V66 HydrophobicContact CE1-CG1 3.7Å; F51-V66 HydrophobicContact CZ-CG1 4.08Å; G53-V66 VanDerWaalsContact CA-CG1 3.46Å; A60-V66 HydrophobicContact CB-CG2 3.29Å; V66-W85 HydrophobicContact CG1-CH2 4.21Å; V66-W85 HydrophobicContact CG1-CZ3 3.91Å
67	V	97.2	Very high	95	Very high	15 Å²	15	46.9 Å²	46.9	9%	0.091	25%	0.25	C	S	.	.			trans	-96.5	106.8	-178.1	-179.1	0	0	0	0	110.4	F51 V90 F99 I100	F51-V67 WeakPolarHBondContact CD1-O 3.4Å; V67-V90 HydrophobicContact CG1-CG2 3.6Å; V67-F99 PolarHBondContact N-O 2.87Å; V67-I100 HydrophobicContact CB-CG1 3.83Å; V67-I100 HydrophobicContact CG1-CG1 4.22Å; V67-I100 HydrophobicContact CG2-CG1 4.04Å
68	S	96.9	Very high	95.4	Very high	56 Å²	56	48.1 Å²	48.1	39%	0.392	26%	0.256	S	S	.	.			trans	-75.4	145.2	166.5	-50.8	0	0	0	0	111.2	F51 D52 G53	F51-S68 CarbonylContact O-C 3.22Å; F51-S68 VanDerWaalsContact O-CA 3.3Å; F51-S68 WeakPolarHBondContact O-CA 3.25Å; D52-S68 WeakPolarHBondContact OD1-CB 3.23Å; D52-S68 PolarHBondContact OD1-OG 2.84Å; G53-S68 PolarHBondContact N-OG 2.89Å
69	F	97.6	Very high	95.7	Very high	11 Å²	11	44.6 Å²	44.6	5%	0.048	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-149.7	150.8	179.9	55.3	-104.1	0	0	0	113	T47 I49 S50 F51 D73 L75 V90 I100 P101 Y241	T47-F69 HydrophobicContact CG2-CD2 3.51Å; T47-F69 HydrophobicContact CG2-CE2 3.72Å; T47-F69 HydrophobicContact CG2-CG 4.07Å; T47-F69 HydrophobicContact CG2-CZ 4.43Å; I49-F69 WeakPolarHBondContact O-CE2 3.49Å; S50-F69 CarbonylContact C-O 3.45Å; S50-F69 VanDerWaalsContact CA-O 3.29Å; S50-F69 WeakPolarHBondContact CA-O 3.27Å; F51-F69 HydrophobicContact CB-CD1 4.2Å; F51-F69 HydrophobicContact CB-CD2 4.03Å; F51-F69 HydrophobicContact CB-CE1 3.71Å; F51-F69 HydrophobicContact CB-CE2 3.52Å; F51-F69 HydrophobicContact CB-CG 4.36Å; F51-F69 HydrophobicContact CB-CZ 3.35Å; F51-F69 HydrophobicContact CD1-CD1 4.23Å; F51-F69 AromaticContact CD1-CE1 3.8Å; F51-F69 HydrophobicContact CD1-CE1 3.8Å; F51-F69 HydrophobicContact CD1-CZ 4.26Å; F51-F69 HydrophobicContact CG-CE1 4.09Å; F51-F69 HydrophobicContact CG-CZ 4.07Å; F51-F69 PolarHBondContact N-O 3.11Å; F51-F69 PolarHBondContact O-N 3.37Å; F69-D73 HydrophobicContact CB-CB 4.19Å; F69-L75 HydrophobicContact CB-CD2 4.12Å; F69-L75 HydrophobicContact CD1-CD1 3.93Å; F69-L75 HydrophobicContact CD1-CD2 4.2Å; F69-L75 HydrophobicContact CE1-CD1 3.95Å; F69-L75 HydrophobicContact CG-CD1 4.37Å; F69-L75 HydrophobicContact CG-CD2 4.32Å; F69-L75 HydrophobicContact CZ-CD1 4.41Å; F69-V90 HydrophobicContact CB-CG2 4.4Å; F69-I100 HydrophobicContact CE1-CG2 4.4Å; F69-P101 HydrophobicContact CE1-CG 4.48Å; F69-Y241 HydrophobicContact CE1-CE1 4.34Å; F69-Y241 HydrophobicContact CE2-CE1 4.11Å; F69-Y241 AromaticContact CZ-CE1 3.65Å; F69-Y241 HydrophobicContact CZ-CE1 3.65Å; F69-Y241 AromaticContact CZ-CZ 3.95Å; F69-Y241 WeakPolarHBondContact CZ-OH 3.14Å
70	G	97.2	Very high	95.9	Very high	29 Å²	29	42.8 Å²	42.8	30%	0.299	22%	0.221	S	C	.	.			trans	-85.1	-176.6	173.7	0	0	0	0	0	113.7	T47 D73	T47-G70 PolarHBondContact OG1-O 3.23Å; G70-D73 PolarHBondContact N-OD2 3.44Å
71	I	95	Very high	96	Very high	104 Å²	104	45.1 Å²	45.1	53%	0.533	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	135.4	172.4	-58.1	164.3	0	0	0	109	D73	I71-D73 VanDerWaalsContact C-N 3.25Å
72	K	94.5	Very high	96.1	Very high	151 Å²	151	47.9 Å²	47.9	66%	0.657	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.7	12.3	-170.9	-52.3	166.8	-170.1	167.1	0	115.3	T47	T47-K72 VanDerWaalsContact O-CA 3.27Å; T47-K72 WeakPolarHBondContact O-CA 3.41Å; T47-K72 PolarHBondContact O-N 2.97Å; T47-K72 PolarHBondContact OG1-N 3.37Å; T47-K72 VanDerWaalsContact OG1-N 3.11Å
73	D	97.5	Very high	96.1	Very high	55 Å²	55	51.4 Å²	51.4	29%	0.294	26%	0.261	S	S	.	.			trans	-64.6	156.6	167.2	-91.9	-11.7	0	0	0	110.4	R46 T47 F69 G70 I71	R46-D73 CarbonylContact C-O 3.49Å; R46-D73 WeakPolarHBondContact CA-O 3.26Å; T47-D73 HydrophobicContact CG2-CB 4.3Å; T47-D73 PolarHBondContact N-O 3.39Å; T47-D73 PolarHBondContact OG1-N 3.43Å; T47-D73 PolarHBondContact OG1-O 3.33Å; F69-D73 HydrophobicContact CB-CB 4.19Å; G70-D73 PolarHBondContact N-OD2 3.44Å; I71-D73 VanDerWaalsContact C-N 3.25Å
74	F	98.2	Very high	96.3	Very high	35 Å²	35	51.8 Å²	51.8	15%	0.154	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	129.2	177.9	-67.5	-89.9	0	0	0	109.6	V45 R46 V90 V91 V244 R248 A359	V45-F74 WeakPolarHBondContact O-CA 3.49Å; R46-F74 HydrophobicContact CB-CD1 4.43Å; R46-F74 HydrophobicContact CB-CE1 4.24Å; F74-V90 WeakPolarHBondContact O-CA 3.31Å; F74-V91 HydrophobicContact CB-CB 3.98Å; F74-V91 HydrophobicContact CB-CG2 3.95Å; F74-V91 WeakPolarHBondContact O-CG2 3.44Å; F74-V91 PolarHBondContact O-N 2.97Å; F74-V244 HydrophobicContact CD1-CG2 4.05Å; F74-V244 HydrophobicContact CE1-CG2 4.26Å; F74-R248 HydrophobicContact CD1-CG 4.29Å; F74-R248 HydrophobicContact CE1-CG 3.94Å; F74-R248 HydrophobicContact CZ-CG 4.26Å; F74-A359 HydrophobicContact CE1-CB 3.63Å; F74-A359 HydrophobicContact CZ-CB 3.89Å
75	L	98.5	Very high	96.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	123.8	-178.8	-51.4	179.2	0	0	0	110.3	S44 V45 T47 F69 I77 R89 V90 I100 Y241	S44-L75 WeakPolarHBondContact CA-O 3.48Å; S44-L75 PolarHBondContact OG-O 3.16Å; V45-L75 HydrophobicContact CG2-CB 3.85Å; V45-L75 HydrophobicContact CG2-CD1 4.2Å; V45-L75 HydrophobicContact CG2-CG 4.33Å; V45-L75 PolarHBondContact N-O 2.97Å; V45-L75 PolarHBondContact O-N 3.04Å; T47-L75 HydrophobicContact CG2-CD1 3.72Å; T47-L75 HydrophobicContact CG2-CD2 4.46Å; T47-L75 HydrophobicContact CG2-CG 3.87Å; F69-L75 HydrophobicContact CB-CD2 4.12Å; F69-L75 HydrophobicContact CD1-CD1 3.93Å; F69-L75 HydrophobicContact CD1-CD2 4.2Å; F69-L75 HydrophobicContact CE1-CD1 3.95Å; F69-L75 HydrophobicContact CG-CD1 4.37Å; F69-L75 HydrophobicContact CG-CD2 4.32Å; F69-L75 HydrophobicContact CZ-CD1 4.41Å; L75-I77 HydrophobicContact CB-CD1 4.12Å; L75-R89 CarbonylContact C-O 3.59Å; L75-R89 WeakPolarHBondContact CA-O 3.38Å; L75-V90 HydrophobicContact CD2-CB 4.35Å; L75-V90 HydrophobicContact CD2-CG2 3.84Å; L75-I100 HydrophobicContact CB-CD1 4.29Å; L75-I100 HydrophobicContact CD1-CD1 4.29Å; L75-I100 HydrophobicContact CD1-CG2 3.96Å; L75-Y241 HydrophobicContact CD1-CE1 3.87Å
76	H	98.3	Very high	96.7	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.009	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	116.6	168.7	-81.5	178.2	0	0	0	109.6	V41 G88 R89 V91 C246	V41-H76 HydrophobicContact CG1-CB 3.98Å; V41-H76 HydrophobicContact CG2-CB 4.16Å; H76-G88 CarbonylContact O-C 3.44Å; H76-G88 WeakPolarHBondContact O-CA 3.47Å; H76-R89 HydrophobicContact CB-CG 4.2Å; H76-R89 PolarHBondContact N-O 2.88Å; H76-R89 PolarHBondContact O-N 3.03Å; H76-V91 HydrophobicContact CB-CG2 4.29Å; H76-V91 WeakPolarHBondContact CD2-CG2 3.32Å; H76-C246 PolarHBondContact NE2-O 2.95Å
77	I	98.1	Very high	96.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	134.2	180	-51	-53.2	0	0	0	109.5	A42 F43 L75 W86 I100 F487	A42-I77 WeakPolarHBondContact CB-O 3.32Å; A42-I77 PolarHBondContact N-O 3.48Å; F43-I77 HydrophobicContact CD1-CB 4.39Å; F43-I77 HydrophobicContact CD2-CB 4.27Å; F43-I77 HydrophobicContact CD2-CG1 4.09Å; F43-I77 HydrophobicContact CE1-CB 4.16Å; F43-I77 HydrophobicContact CE1-CG2 3.9Å; F43-I77 HydrophobicContact CE2-CB 4.03Å; F43-I77 HydrophobicContact CE2-CG1 3.68Å; F43-I77 HydrophobicContact CE2-CG2 4.33Å; F43-I77 HydrophobicContact CG-CB 4.44Å; F43-I77 HydrophobicContact CZ-CB 3.98Å; F43-I77 HydrophobicContact CZ-CG1 4.01Å; F43-I77 HydrophobicContact CZ-CG2 3.79Å; F43-I77 PolarHBondContact O-N 3.29Å; L75-I77 HydrophobicContact CB-CD1 4.12Å; I77-W86 HydrophobicContact CD1-CE3 3.99Å; I77-W86 HydrophobicContact CG1-CE3 4.21Å; I77-W86 HydrophobicContact CG2-CB 4.36Å; I77-W86 HydrophobicContact CG2-CE3 4.39Å; I77-I100 HydrophobicContact CD1-CD1 3.7Å; I77-I100 HydrophobicContact CD1-CG2 4.45Å; I77-F487 HydrophobicContact CG2-CE1 4.48Å; I77-F487 HydrophobicContact CG2-CE2 4.08Å; I77-F487 HydrophobicContact CG2-CZ 3.52Å
78	K	97	Very high	96.7	Very high	26 Å²	26	39.4 Å²	39.4	11%	0.113	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-43	-175.3	-66.6	-67.6	-164.7	172.6	0	113	A36 K39 P40 I87 I97	A36-K78 HydrophobicContact CB-CB 4.35Å; K39-K78 WeakPolarHBondContact O-CD 3.41Å; K39-K78 PolarHBondContact O-NZ 3.17Å; P40-K78 WeakPolarHBondContact O-CD 3.4Å; K78-I87 WeakPolarHBondContact CB-O 3.39Å; K78-I87 PolarHBondContact N-O 3.18Å; K78-I97 HydrophobicContact CG-CD1 4.39Å
79	K	96.1	Very high	96.8	Very high	50 Å²	50	36.9 Å²	36.9	22%	0.217	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	154.2	-175.6	-158.3	-154.8	176.4	-171.6	0	109.9	E32 I87 A485	E32-K79 IonicContact OE1-NZ 2.93Å; E32-K79 PolarHBondContact OE1-NZ 3.23Å; E32-K79 WeakPolarHBondContact OE2-CD 3.37Å; E32-K79 IonicContact OE2-NZ 3.9Å; E32-K79 PolarHBondContact OE2-NZ 2.78Å; K79-I87 HydrophobicContact CB-CB 4.43Å; K79-I87 PolarHBondContact N-O 3.14Å; K79-I87 PolarHBondContact O-N 2.7Å; K79-A485 WeakPolarHBondContact CG-O 3.4Å
80	R	96.5	Very high	96.8	Very high	54 Å²	54	37 Å²	37	20%	0.204	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	136.7	157.7	-172.8	-170.3	-173.2	-158.3	6.1	108.9	N82 A485 G486 F487 E491	R80-N82 WeakPolarHBondContact CG-O 3.49Å; R80-A485 PolarHBondContact N-O 3.33Å; R80-G486 WeakPolarHBondContact CD-O 3.24Å; R80-G486 PolarHBondContact NH1-O 2.98Å; R80-F487 HydrophobicContact CB-CD1 4.17Å; R80-F487 HydrophobicContact CB-CD2 3.99Å; R80-F487 HydrophobicContact CB-CE1 4.03Å; R80-F487 HydrophobicContact CB-CE2 3.87Å; R80-F487 HydrophobicContact CB-CG 4.14Å; R80-F487 HydrophobicContact CB-CZ 3.87Å; R80-F487 HydrophobicContact CG-CD1 4.49Å; R80-F487 HydrophobicContact CG-CE1 4.46Å; R80-E491 IonicContact CZ-OE1 2.86Å; R80-E491 IonicContact CZ-OE2 3.17Å; R80-E491 VanDerWaalsContact NE-CD 3.33Å; R80-E491 IonicContact NE-OE1 3.12Å; R80-E491 PolarHBondContact NE-OE1 2.7Å; R80-E491 IonicContact NE-OE2 2.8Å; R80-E491 PolarHBondContact NE-OE2 3.17Å; R80-E491 IonicContact NH1-OE2 3.36Å; R80-E491 IonicContact NH2-OE1 2.75Å; R80-E491 PolarHBondContact NH2-OE1 3.11Å; R80-E491 VanDerWaalsContact NH2-OE1 3.09Å; R80-E491 IonicContact NH2-OE2 3.23Å; R80-E491 PolarHBondContact NH2-OE2 3.35Å
81	F	96	Very high	96.8	Very high	57 Å²	57	36.7 Å²	36.7	25%	0.25	17%	0.174	C	C	.	.			trans	-92.7	-53.9	167.1	-179	-98.5	0	0	0	109.8	A29 E32 P61 W85 I87 F99	A29-F81 HydrophobicContact CB-CE2 4.22Å; A29-F81 HydrophobicContact CB-CZ 4.02Å; E32-F81 HydrophobicContact CB-CD2 4.2Å; E32-F81 HydrophobicContact CB-CE2 4.23Å; E32-F81 HydrophobicContact CG-CE2 4.49Å; P61-F81 HydrophobicContact CB-CD1 4.19Å; P61-F81 HydrophobicContact CB-CE1 3.56Å; P61-F81 HydrophobicContact CB-CZ 3.89Å; P61-F81 HydrophobicContact CG-CD1 3.58Å; P61-F81 HydrophobicContact CG-CE1 3.33Å; P61-F81 HydrophobicContact CG-CZ 4.17Å; F81-W85 WeakPolarHBondContact CA-O 3.18Å; F81-W85 WeakPolarHBondContact CB-O 3.11Å; F81-W85 PolarHBondContact N-O 2.74Å; F81-I87 HydrophobicContact CB-CD1 4.19Å; F81-I87 HydrophobicContact CB-CG1 4.08Å; F81-I87 HydrophobicContact CD2-CD1 4.2Å; F81-F99 HydrophobicContact CB-CD1 4.46Å; F81-F99 HydrophobicContact CB-CE1 4.01Å; F81-F99 HydrophobicContact CD1-CE1 4.21Å; F81-F99 AromaticContact CD2-CE1 3.92Å; F81-F99 HydrophobicContact CD2-CE1 3.92Å; F81-F99 HydrophobicContact CD2-CZ 4.41Å; F81-F99 HydrophobicContact CE2-CE1 4.44Å; F81-F99 AromaticContact CG-CE1 3.78Å; F81-F99 HydrophobicContact CG-CE1 3.78Å
82	N	94.4	Very high	96.8	Very high	65 Å²	65	38.8 Å²	38.8	35%	0.348	18%	0.175	S	C	.	.	S	Bend	trans	-149.9	-165	170.5	64.5	17	0	0	0	110.1	R80 D84 W85	R80-N82 WeakPolarHBondContact CG-O 3.49Å; N82-D84 VanDerWaalsContact C-N 3.3Å; N82-D84 PolarHBondContact O-N 3.36Å; N82-D84 PolarHBondContact OD1-N 2.79Å; N82-W85 PolarHBondContact N-O 3Å; N82-W85 PolarHBondContact OD1-N 2.7Å
83	Q	93.9	Very high	96.7	Very high	73 Å²	73	36.8 Å²	36.8	34%	0.341	17%	0.171	S	C	.	.	S	Bend	trans	-64.4	-31.4	179.2	-172	62.2	38.1	0	0	113.5	S102 E491	Q83-S102 WeakPolarHBondContact O-CB 3.44Å; Q83-S102 PolarHBondContact O-OG 3.47Å; Q83-E491 PolarHBondContact OE1-OE1 3.18Å
84	D	95.2	Very high	96.4	Very high	53 Å²	53	37.7 Å²	37.7	28%	0.283	19%	0.193	S	C	.	.	S	Bend	trans	-90.8	-29.7	-175.5	-81.8	15.1	0	0	0	112.6	N82 P101 S102 K105	N82-D84 VanDerWaalsContact C-N 3.3Å; N82-D84 PolarHBondContact O-N 3.36Å; N82-D84 PolarHBondContact OD1-N 2.79Å; D84-P101 CarbonylContact O-C 3.49Å; D84-P101 WeakPolarHBondContact O-CA 3.17Å; D84-S102 PolarHBondContact O-N 2.96Å; D84-S102 PolarHBondContact O-OG 2.88Å; D84-K105 HydrophobicContact CB-CB 4.22Å; D84-K105 HydrophobicContact CB-CD 3.95Å; D84-K105 HydrophobicContact CB-CG 4.18Å; D84-K105 VanDerWaalsContact O-CB 3.23Å; D84-K105 WeakPolarHBondContact O-CB 3.46Å; D84-K105 WeakPolarHBondContact OD2-CD 3.28Å; D84-K105 WeakPolarHBondContact OD2-CE 3.1Å; D84-K105 IonicContact OD2-NZ 2.57Å; D84-K105 PolarHBondContact OD2-NZ 3.5Å
85	W	96.9	Very high	96.1	Very high	5 Å²	5	37.3 Å²	37.3	2%	0.019	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	131.8	-168.1	-62.6	100.6	0	0	0	112.7	F51 A60 P61 V66 F81 N82 F99 P101 K105	F51-W85 HydrophobicContact CZ-CH2 4.16Å; F51-W85 HydrophobicContact CZ-CZ3 4.33Å; A60-W85 HydrophobicContact CB-CD2 4.29Å; A60-W85 HydrophobicContact CB-CE3 4.44Å; A60-W85 HydrophobicContact CB-CH2 3.81Å; A60-W85 HydrophobicContact CB-CZ2 3.6Å; A60-W85 HydrophobicContact CB-CZ3 4.22Å; P61-W85 HydrophobicContact CG-CB 4.35Å; P61-W85 HydrophobicContact CG-CG 4.18Å; V66-W85 HydrophobicContact CG1-CH2 4.21Å; V66-W85 HydrophobicContact CG1-CZ3 3.91Å; F81-W85 WeakPolarHBondContact CA-O 3.18Å; F81-W85 WeakPolarHBondContact CB-O 3.11Å; F81-W85 PolarHBondContact N-O 2.74Å; N82-W85 PolarHBondContact N-O 3Å; N82-W85 PolarHBondContact OD1-N 2.7Å; W85-F99 HydrophobicContact CB-CD1 4.21Å; W85-F99 HydrophobicContact CD2-CB 4.45Å; W85-F99 HydrophobicContact CE3-CB 3.83Å; W85-F99 HydrophobicContact CZ3-CB 4.38Å; W85-P101 HydrophobicContact CE3-CB 4.18Å; W85-P101 HydrophobicContact CH2-CB 4.26Å; W85-P101 HydrophobicContact CZ3-CB 3.82Å; W85-P101 HydrophobicContact CZ3-CG 4.33Å; W85-K105 HydrophobicContact CZ2-CG 4.43Å
86	W	98	Very high	95.8	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.008	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	159.4	172.4	-54.4	-13.9	0	0	0	109.5	F43 I77 F99 I100 P103 Y241 F487 L495	F43-W86 HydrophobicContact CE2-CZ3 4.21Å; F43-W86 HydrophobicContact CZ-CH2 4.4Å; F43-W86 HydrophobicContact CZ-CZ3 4.18Å; I77-W86 HydrophobicContact CD1-CE3 3.99Å; I77-W86 HydrophobicContact CG1-CE3 4.21Å; I77-W86 HydrophobicContact CG2-CB 4.36Å; I77-W86 HydrophobicContact CG2-CE3 4.39Å; W86-F99 CarbonylContact O-C 3.44Å; W86-F99 WeakPolarHBondContact O-CA 3.16Å; W86-I100 HydrophobicContact CB-CB 4.48Å; W86-I100 PolarHBondContact N-O 3.24Å; W86-I100 PolarHBondContact O-N 2.89Å; W86-P103 VanDerWaalsContact CH2-CD 3.42Å; W86-P103 HydrophobicContact CH2-CG 3.97Å; W86-P103 HydrophobicContact CZ2-CG 4.18Å; W86-Y241 HydrophobicContact CE3-CE2 4.32Å; W86-Y241 HydrophobicContact CH2-CD2 4.01Å; W86-Y241 HydrophobicContact CH2-CE2 4.24Å; W86-Y241 AromaticContact CZ3-CD2 3.75Å; W86-Y241 HydrophobicContact CZ3-CD2 3.75Å; W86-Y241 AromaticContact CZ3-CE2 3.77Å; W86-Y241 HydrophobicContact CZ3-CE2 3.77Å; W86-F487 HydrophobicContact CB-CZ 4.42Å; W86-F487 AromaticContact CD1-CE1 3.7Å; W86-F487 AromaticContact CD2-CE1 3.78Å; W86-F487 HydrophobicContact CD2-CE1 3.78Å; W86-F487 HydrophobicContact CD2-CZ 4.25Å; W86-F487 AromaticContact CE2-CE1 3.59Å; W86-F487 HydrophobicContact CE3-CE1 4.47Å; W86-F487 AromaticContact CG-CE1 3.84Å; W86-F487 HydrophobicContact CG-CE1 3.84Å; W86-F487 HydrophobicContact CG-CZ 4.06Å; W86-F487 HydrophobicContact CZ2-CE1 4.09Å; W86-F487 AromaticContact NE1-CE1 3.57Å; W86-L495 HydrophobicContact CH2-CD1 3.94Å; W86-L495 HydrophobicContact CH2-CD2 4Å; W86-L495 HydrophobicContact CH2-CG 4.14Å
87	I	98.2	Very high	95.7	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	128.4	172.9	-60.4	173	0	0	0	108.6	E32 L33 A36 K78 K79 F81 I97 G98 F99	E32-I87 HydrophobicContact CB-CD1 4.04Å; L33-I87 HydrophobicContact CD2-CB 4.34Å; L33-I87 HydrophobicContact CD2-CD1 4.15Å; L33-I87 HydrophobicContact CD2-CG1 3.91Å; L33-I87 HydrophobicContact CD2-CG2 3.63Å; A36-I87 HydrophobicContact CB-CB 4.43Å; A36-I87 HydrophobicContact CB-CG2 3.49Å; A36-I87 VanDerWaalsContact CB-CG2 3.49Å; K78-I87 WeakPolarHBondContact CB-O 3.39Å; K78-I87 PolarHBondContact N-O 3.18Å; K79-I87 HydrophobicContact CB-CB 4.43Å; K79-I87 PolarHBondContact N-O 3.14Å; K79-I87 PolarHBondContact O-N 2.7Å; F81-I87 HydrophobicContact CB-CD1 4.19Å; F81-I87 HydrophobicContact CB-CG1 4.08Å; F81-I87 HydrophobicContact CD2-CD1 4.2Å; I87-I97 HydrophobicContact CG2-CG2 3.45Å; I87-I97 VanDerWaalsContact CG2-CG2 3.45Å; I87-G98 WeakPolarHBondContact CA-O 3.48Å; I87-F99 HydrophobicContact CD1-CE1 4.23Å; I87-F99 HydrophobicContact CG1-CD1 4.15Å; I87-F99 HydrophobicContact CG1-CE1 3.83Å
88	G	97.9	Very high	95.6	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.3	-163.9	-180	0	0	0	0	0	112.7	H76 I97 G98	H76-G88 CarbonylContact O-C 3.44Å; H76-G88 WeakPolarHBondContact O-CA 3.47Å; G88-I97 CarbonylContact O-C 3.6Å; G88-I97 VanDerWaalsContact O-CA 3.31Å; G88-I97 WeakPolarHBondContact O-CA 3.35Å; G88-G98 PolarHBondContact N-O 3.3Å; G88-G98 PolarHBondContact O-N 2.83Å
89	R	97.4	Very high	95.7	Very high	3 Å²	3	42.1 Å²	42.1	1%	0.011	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	155.6	179.1	62.9	-174.2	-61.6	-89.2	-4.4	112.3	L75 H76 R92 S95 P96 I97 A432	L75-R89 CarbonylContact C-O 3.59Å; L75-R89 WeakPolarHBondContact CA-O 3.38Å; H76-R89 HydrophobicContact CB-CG 4.2Å; H76-R89 PolarHBondContact N-O 2.88Å; H76-R89 PolarHBondContact O-N 3.03Å; R89-R92 PolarHBondContact NH2-O 2.91Å; R89-S95 PolarHBondContact NE-O 3.15Å; R89-S95 PolarHBondContact NH2-O 3.2Å; R89-P96 WeakPolarHBondContact CB-O 3.2Å; R89-I97 HydrophobicContact CB-CG1 3.96Å; R89-I97 HydrophobicContact CG-CG1 4.23Å; R89-A432 PolarHBondContact NH1-O 2.63Å
90	V	97.8	Very high	95.8	Very high	12 Å²	12	39.8 Å²	39.8	7%	0.073	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	138.9	163.1	-170.8	0	0	0	0	109.4	V67 F69 F74 L75 R92	V67-V90 HydrophobicContact CG1-CG2 3.6Å; F69-V90 HydrophobicContact CB-CG2 4.4Å; F74-V90 WeakPolarHBondContact O-CA 3.31Å; L75-V90 HydrophobicContact CD2-CB 4.35Å; L75-V90 HydrophobicContact CD2-CG2 3.84Å; V90-R92 HydrophobicContact CG1-CB 4.12Å; V90-R92 PolarHBondContact O-N 2.81Å
91	V	97.4	Very high	95.8	Very high	24 Å²	24	37.2 Å²	37.2	15%	0.145	21%	0.207	C	C	.	.	S	Bend	trans	-76.1	74.9	174.4	-175.9	0	0	0	0	109.6	F74 H76 Y429 A432 T433	F74-V91 HydrophobicContact CB-CB 3.98Å; F74-V91 HydrophobicContact CB-CG2 3.95Å; F74-V91 WeakPolarHBondContact O-CG2 3.44Å; F74-V91 PolarHBondContact O-N 2.97Å; H76-V91 HydrophobicContact CB-CG2 4.29Å; H76-V91 WeakPolarHBondContact CD2-CG2 3.32Å; V91-Y429 HydrophobicContact CG1-CE2 4.33Å; V91-A432 HydrophobicContact CG1-CB 4.32Å; V91-T433 HydrophobicContact CG1-CG2 3.45Å; V91-T433 VanDerWaalsContact CG1-CG2 3.45Å
92	R	94.7	Very high	95.8	Very high	148 Å²	148	34.5 Å²	34.5	56%	0.558	20%	0.196	S	C	*	.	S	Bend	trans	-146.5	146.2	-177.9	174.2	174.4	177.4	168.4	-1.2	109.6	R89 V90 G94 S95	R89-R92 PolarHBondContact NH2-O 2.91Å; V90-R92 HydrophobicContact CG1-CB 4.12Å; V90-R92 PolarHBondContact O-N 2.81Å; R92-G94 PolarHBondContact O-N 3.1Å; R92-S95 WeakPolarHBondContact CB-OG 3.3Å; R92-S95 PolarHBondContact O-N 3.26Å
93	I	92.5	Very high	95.8	Very high	109 Å²	109	32 Å²	32	56%	0.559	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	131.3	177.1	-56.4	176.8	0	0	0	109	S95 A431 A432	I93-S95 VanDerWaalsContact C-N 3.26Å; I93-S95 PolarHBondContact O-N 3.48Å; I93-A431 HydrophobicContact CD1-CB 4.11Å; I93-A431 HydrophobicContact CG1-CB 4.17Å; I93-A432 HydrophobicContact CG1-CB 4.08Å
94	G	90.6	Very high	95.8	Very high	74 Å²	74	29.4 Å²	29.4	76%	0.763	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.9	-10.9	178.9	0	0	0	0	0	116.1	R92 P96	R92-G94 PolarHBondContact O-N 3.1Å; G94-P96 WeakPolarHBondContact O-CD 3.11Å
95	S	92.7	Very high	95.7	Very high	26 Å²	26	27.5 Å²	27.5	18%	0.182	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-67	121.5	178	-71.6	0	0	0	0	111.4	R89 R92 I93	R89-S95 PolarHBondContact NE-O 3.15Å; R89-S95 PolarHBondContact NH2-O 3.2Å; R92-S95 WeakPolarHBondContact CB-OG 3.3Å; R92-S95 PolarHBondContact O-N 3.26Å; I93-S95 VanDerWaalsContact C-N 3.26Å; I93-S95 PolarHBondContact O-N 3.48Å
96	P	92.8	Very high	95.6	Very high	102 Å²	102	27.5 Å²	27.5	66%	0.662	16%	0.162	S	C	*	.	P	Polyproline II helix	trans	-73.3	173.4	-179.3	32.3	-36.6	0	0	0	112	R89 G94	R89-P96 WeakPolarHBondContact CB-O 3.2Å; G94-P96 WeakPolarHBondContact O-CD 3.11Å
97	I	95	Very high	95.2	Very high	26 Å²	26	30.3 Å²	30.3	13%	0.133	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-85.8	141.6	167.6	-73.3	165.4	0	0	0	109.4	L33 A36 V37 K78 I87 G88 R89	L33-I97 HydrophobicContact CD2-CG2 4.3Å; A36-I97 HydrophobicContact CB-CG2 4.48Å; V37-I97 HydrophobicContact CB-CD1 4.45Å; V37-I97 HydrophobicContact CG2-CD1 4.29Å; K78-I97 HydrophobicContact CG-CD1 4.39Å; I87-I97 HydrophobicContact CG2-CG2 3.45Å; I87-I97 VanDerWaalsContact CG2-CG2 3.45Å; G88-I97 CarbonylContact O-C 3.6Å; G88-I97 VanDerWaalsContact O-CA 3.31Å; G88-I97 WeakPolarHBondContact O-CA 3.35Å; R89-I97 HydrophobicContact CB-CG1 3.96Å; R89-I97 HydrophobicContact CG-CG1 4.23Å
98	G	97	Very high	94.9	Very high	2 Å²	2	33.7 Å²	33.7	2%	0.021	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.3	-169.5	-177.8	0	0	0	0	0	112.5	R65 I87 G88	R65-G98 CarbonylContact O-C 3.56Å; R65-G98 WeakPolarHBondContact O-CA 3.34Å; I87-G98 WeakPolarHBondContact CA-O 3.48Å; G88-G98 PolarHBondContact N-O 3.3Å; G88-G98 PolarHBondContact O-N 2.83Å
99	F	98.1	Very high	94.5	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	130	179.1	-66.1	-66.6	0	0	0	112.1	A29 L33 P61 R65 V67 F81 W85 W86 I87	A29-F99 HydrophobicContact CB-CE2 4.03Å; A29-F99 HydrophobicContact CB-CZ 3.73Å; L33-F99 HydrophobicContact CD1-CD2 4.16Å; L33-F99 HydrophobicContact CD1-CE2 3.58Å; L33-F99 HydrophobicContact CD1-CZ 4.02Å; L33-F99 HydrophobicContact CD2-CD1 4.35Å; L33-F99 HydrophobicContact CD2-CD2 4.35Å; L33-F99 HydrophobicContact CD2-CE1 3.97Å; L33-F99 HydrophobicContact CD2-CE2 3.98Å; L33-F99 HydrophobicContact CD2-CZ 3.74Å; L33-F99 HydrophobicContact CG-CE1 4.41Å; L33-F99 HydrophobicContact CG-CE2 3.82Å; L33-F99 HydrophobicContact CG-CZ 3.7Å; P61-F99 HydrophobicContact CB-CD2 4.5Å; P61-F99 HydrophobicContact CB-CE1 4.24Å; P61-F99 HydrophobicContact CB-CE2 4.03Å; P61-F99 HydrophobicContact CB-CZ 3.92Å; P61-F99 HydrophobicContact CG-CD1 4.3Å; P61-F99 HydrophobicContact CG-CE1 4.2Å; P61-F99 HydrophobicContact CG-CZ 4.37Å; R65-F99 HydrophobicContact CB-CD2 4.24Å; R65-F99 HydrophobicContact CB-CE2 4.47Å; R65-F99 PolarHBondContact O-N 2.88Å; V67-F99 PolarHBondContact N-O 2.87Å; F81-F99 HydrophobicContact CB-CD1 4.46Å; F81-F99 HydrophobicContact CB-CE1 4.01Å; F81-F99 HydrophobicContact CD1-CE1 4.21Å; F81-F99 AromaticContact CD2-CE1 3.92Å; F81-F99 HydrophobicContact CD2-CE1 3.92Å; F81-F99 HydrophobicContact CD2-CZ 4.41Å; F81-F99 HydrophobicContact CE2-CE1 4.44Å; F81-F99 AromaticContact CG-CE1 3.78Å; F81-F99 HydrophobicContact CG-CE1 3.78Å; W85-F99 HydrophobicContact CB-CD1 4.21Å; W85-F99 HydrophobicContact CD2-CB 4.45Å; W85-F99 HydrophobicContact CE3-CB 3.83Å; W85-F99 HydrophobicContact CZ3-CB 4.38Å; W86-F99 CarbonylContact O-C 3.44Å; W86-F99 WeakPolarHBondContact O-CA 3.16Å; I87-F99 HydrophobicContact CD1-CE1 4.23Å; I87-F99 HydrophobicContact CG1-CD1 4.15Å; I87-F99 HydrophobicContact CG1-CE1 3.83Å
100	I	98.3	Very high	94	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	129.7	176.8	-68	167.9	0	0	0	107.1	V67 F69 L75 I77 W86 Y241	V67-I100 HydrophobicContact CB-CG1 3.83Å; V67-I100 HydrophobicContact CG1-CG1 4.22Å; V67-I100 HydrophobicContact CG2-CG1 4.04Å; F69-I100 HydrophobicContact CE1-CG2 4.4Å; L75-I100 HydrophobicContact CB-CD1 4.29Å; L75-I100 HydrophobicContact CD1-CD1 4.29Å; L75-I100 HydrophobicContact CD1-CG2 3.96Å; I77-I100 HydrophobicContact CD1-CD1 3.7Å; I77-I100 HydrophobicContact CD1-CG2 4.45Å; W86-I100 HydrophobicContact CB-CB 4.48Å; W86-I100 PolarHBondContact N-O 3.24Å; W86-I100 PolarHBondContact O-N 2.89Å; I100-Y241 VanDerWaalsContact CG2-OH 3.32Å; I100-Y241 WeakPolarHBondContact CG2-OH 3.18Å
101	P	97.5	Very high	93.6	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	143.7	179.7	31	-36.5	0	0	0	111	F51 F69 D84 W85 K105 L106 Y241	F51-P101 HydrophobicContact CD1-CG 3.91Å; F51-P101 HydrophobicContact CD2-CG 4.01Å; F51-P101 HydrophobicContact CE1-CG 3.78Å; F51-P101 HydrophobicContact CE2-CG 3.89Å; F51-P101 HydrophobicContact CG-CG 4.03Å; F51-P101 HydrophobicContact CZ-CB 4.42Å; F51-P101 HydrophobicContact CZ-CG 3.78Å; F69-P101 HydrophobicContact CE1-CG 4.48Å; D84-P101 CarbonylContact O-C 3.49Å; D84-P101 WeakPolarHBondContact O-CA 3.17Å; W85-P101 HydrophobicContact CE3-CB 4.18Å; W85-P101 HydrophobicContact CH2-CB 4.26Å; W85-P101 HydrophobicContact CZ3-CB 3.82Å; W85-P101 HydrophobicContact CZ3-CG 4.33Å; P101-K105 HydrophobicContact CB-CB 4.02Å; P101-K105 HydrophobicContact CB-CG 3.82Å; P101-L106 HydrophobicContact CB-CD2 4.08Å; P101-L106 HydrophobicContact CB-CG 4.04Å; P101-L106 HydrophobicContact CG-CD1 4.29Å; P101-L106 HydrophobicContact CG-CD2 3.62Å; P101-L106 HydrophobicContact CG-CG 3.91Å; P101-Y241 VanDerWaalsContact O-CE2 3.31Å; P101-Y241 WeakPolarHBondContact O-CE2 3.45Å; P101-Y241 PolarHBondContact O-OH 3.35Å
102	S	96.5	Very high	93.1	Very high	1 Å²	1	46 Å²	46	1%	0.007	26%	0.26	C	S	.	.			trans	-71.8	163.5	173.1	76.1	0	0	0	0	111.8	Q83 D84 S104 K105 L106	Q83-S102 WeakPolarHBondContact O-CB 3.44Å; Q83-S102 PolarHBondContact O-OG 3.47Å; D84-S102 PolarHBondContact O-N 2.96Å; D84-S102 PolarHBondContact O-OG 2.88Å; S102-S104 PolarHBondContact O-N 3.42Å; S102-S104 PolarHBondContact OG-N 3.13Å; S102-K105 WeakPolarHBondContact O-CB 3.35Å; S102-K105 PolarHBondContact O-N 2.91Å; S102-K105 VanDerWaalsContact O-N 3.1Å; S102-K105 PolarHBondContact OG-N 2.69Å; S102-K105 VanDerWaalsContact OG-N 3.08Å; S102-L106 WeakPolarHBondContact O-CG 3.39Å; S102-L106 PolarHBondContact O-N 2.83Å
103	P	94.3	Very high	92.6	Very high	11 Å²	11	41.1 Å²	41.1	7%	0.071	24%	0.244	C	C	.	.	H	α-helix	trans	-52.4	-42.5	170.5	-27.8	35.4	0	0	0	112.5	W86 K105 L106 E107 P240 Y241 L495	W86-P103 VanDerWaalsContact CH2-CD 3.42Å; W86-P103 HydrophobicContact CH2-CG 3.97Å; W86-P103 HydrophobicContact CZ2-CG 4.18Å; P103-K105 PolarHBondContact O-N 2.93Å; P103-L106 PolarHBondContact O-N 3.45Å; P103-E107 WeakPolarHBondContact O-CG 3.32Å; P103-E107 PolarHBondContact O-N 3Å; P103-P240 HydrophobicContact CB-CG 4.05Å; P103-Y241 HydrophobicContact CG-CD2 3.93Å; P103-Y241 HydrophobicContact CG-CE2 4.38Å; P103-L495 HydrophobicContact CG-CD2 4.3Å
104	S	92	Very high	92.2	Very high	20 Å²	20	40.9 Å²	40.9	14%	0.14	24%	0.244	C	C	.	.	H	α-helix	trans	-62.6	-41.5	177	-29.6	0	0	0	0	111.6	S102 E107 V108	S102-S104 PolarHBondContact O-N 3.42Å; S102-S104 PolarHBondContact OG-N 3.13Å; S104-E107 WeakPolarHBondContact O-CB 3.37Å; S104-E107 PolarHBondContact O-N 3.38Å; S104-V108 WeakPolarHBondContact O-CG2 3.49Å; S104-V108 PolarHBondContact O-N 3.41Å; S104-V108 VanDerWaalsContact O-N 3.11Å
105	K	94.6	Very high	91.9	Very high	13 Å²	13	40.4 Å²	40.4	6%	0.057	23%	0.229	C	C	.	.	H	α-helix	trans	-65	-40.4	175.5	-173	52.7	155.6	-163.2	0	112.3	D59 D84 W85 P101 S102 P103 V108 I109	D59-K105 VanDerWaalsContact OD2-CE 3.23Å; D59-K105 WeakPolarHBondContact OD2-CE 3.31Å; D59-K105 IonicContact OD2-NZ 3.84Å; D59-K105 PolarHBondContact OD2-NZ 3.39Å; D84-K105 HydrophobicContact CB-CB 4.22Å; D84-K105 HydrophobicContact CB-CD 3.95Å; D84-K105 HydrophobicContact CB-CG 4.18Å; D84-K105 VanDerWaalsContact O-CB 3.23Å; D84-K105 WeakPolarHBondContact O-CB 3.46Å; D84-K105 WeakPolarHBondContact OD2-CD 3.28Å; D84-K105 WeakPolarHBondContact OD2-CE 3.1Å; D84-K105 IonicContact OD2-NZ 2.57Å; D84-K105 PolarHBondContact OD2-NZ 3.5Å; W85-K105 HydrophobicContact CZ2-CG 4.43Å; P101-K105 HydrophobicContact CB-CB 4.02Å; P101-K105 HydrophobicContact CB-CG 3.82Å; S102-K105 WeakPolarHBondContact O-CB 3.35Å; S102-K105 PolarHBondContact O-N 2.91Å; S102-K105 VanDerWaalsContact O-N 3.1Å; S102-K105 PolarHBondContact OG-N 2.69Å; S102-K105 VanDerWaalsContact OG-N 3.08Å; P103-K105 PolarHBondContact O-N 2.93Å; K105-V108 PolarHBondContact O-N 2.79Å; K105-I109 HydrophobicContact CD-CD1 4.28Å; K105-I109 HydrophobicContact CG-CD1 3.98Å; K105-I109 WeakPolarHBondContact O-CG1 3.33Å; K105-I109 PolarHBondContact O-N 3.5Å
106	L	93.9	Very high	91.5	Very high	4 Å²	4	41.9 Å²	41.9	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-66.5	-36.6	175.9	-69.7	169	0	0	0	112.1	I49 F51 P101 S102 P103 N110 P240 Y241	I49-L106 HydrophobicContact CD1-CB 4.49Å; I49-L106 HydrophobicContact CD1-CD1 4.03Å; I49-L106 HydrophobicContact CD1-CD2 4.01Å; I49-L106 HydrophobicContact CD1-CG 4.4Å; F51-L106 HydrophobicContact CD2-CD2 3.85Å; F51-L106 HydrophobicContact CE2-CD2 4.42Å; F51-L106 HydrophobicContact CG-CD2 4.4Å; P101-L106 HydrophobicContact CB-CD2 4.08Å; P101-L106 HydrophobicContact CB-CG 4.04Å; P101-L106 HydrophobicContact CG-CD1 4.29Å; P101-L106 HydrophobicContact CG-CD2 3.62Å; P101-L106 HydrophobicContact CG-CG 3.91Å; S102-L106 WeakPolarHBondContact O-CG 3.39Å; S102-L106 PolarHBondContact O-N 2.83Å; P103-L106 PolarHBondContact O-N 3.45Å; L106-N110 WeakPolarHBondContact O-CB 3.3Å; L106-N110 PolarHBondContact O-N 2.91Å; L106-N110 PolarHBondContact O-ND2 2.79Å; L106-P240 HydrophobicContact CD1-CB 3.81Å; L106-P240 HydrophobicContact CD1-CG 4.17Å; L106-Y241 HydrophobicContact CD1-CE1 4.22Å; L106-Y241 HydrophobicContact CD1-CE2 4Å
107	E	90	Very high	90.8	Very high	61 Å²	61	41.6 Å²	41.6	29%	0.285	24%	0.235	S	C	.	.	H	α-helix	trans	-60.2	-46.7	170.1	-72.3	175.2	-177.2	0	0	111.6	P103 S104 N110 N111 R499	P103-E107 WeakPolarHBondContact O-CG 3.32Å; P103-E107 PolarHBondContact O-N 3Å; S104-E107 WeakPolarHBondContact O-CB 3.37Å; S104-E107 PolarHBondContact O-N 3.38Å; E107-N110 PolarHBondContact O-N 3.24Å; E107-N111 VanDerWaalsContact O-CG 3.28Å; E107-N111 PolarHBondContact O-N 2.89Å; E107-N111 PolarHBondContact O-ND2 2.92Å; E107-N111 VanDerWaalsContact O-ND2 3.1Å; E107-R499 IonicContact OE1-NH1 2.91Å; E107-R499 PolarHBondContact OE1-NH1 3.02Å; E107-R499 IonicContact OE2-CZ 3.6Å; E107-R499 IonicContact OE2-NH1 3.43Å; E107-R499 PolarHBondContact OE2-NH1 3.01Å
108	V	91.5	Very high	89.9	Confident	72 Å²	72	44.1 Å²	44.1	44%	0.436	25%	0.251	S	S	.	.	H	α-helix	trans	-59.8	-48.6	177.2	171.4	0	0	0	0	111.3	S104 K105 N110 N111 I112	S104-V108 WeakPolarHBondContact O-CG2 3.49Å; S104-V108 PolarHBondContact O-N 3.41Å; S104-V108 VanDerWaalsContact O-N 3.11Å; K105-V108 PolarHBondContact O-N 2.79Å; V108-N110 PolarHBondContact O-N 2.96Å; V108-N111 PolarHBondContact O-N 3.06Å; V108-I112 HydrophobicContact CG1-CD1 3.88Å; V108-I112 WeakPolarHBondContact O-CG1 3.49Å; V108-I112 PolarHBondContact O-N 3.5Å
109	I	90.1	Very high	88.7	Confident	18 Å²	18	48 Å²	48	9%	0.092	28%	0.275	C	S	.	.	H	α-helix	trans	-60.9	-43.9	178.5	-69.5	167.1	0	0	0	111.1	F51 Y56 K105 N111 I112 I113	F51-I109 HydrophobicContact CE2-CD1 4.03Å; Y56-I109 HydrophobicContact CD1-CG2 4.01Å; Y56-I109 HydrophobicContact CG-CG2 4.21Å; K105-I109 HydrophobicContact CD-CD1 4.28Å; K105-I109 HydrophobicContact CG-CD1 3.98Å; K105-I109 WeakPolarHBondContact O-CG1 3.33Å; K105-I109 PolarHBondContact O-N 3.5Å; I109-N111 VanDerWaalsContact C-N 3.34Å; I109-N111 PolarHBondContact O-N 3.48Å; I109-I112 PolarHBondContact O-N 3Å; I109-I113 HydrophobicContact CG2-CD1 3.79Å; I109-I113 HydrophobicContact CG2-CG1 4.48Å; I109-I113 VanDerWaalsContact O-CG1 3.3Å; I109-I113 WeakPolarHBondContact O-CG1 3.26Å; I109-I113 PolarHBondContact O-N 2.99Å
110	N	87.4	Confident	87.1	Confident	73 Å²	73	49.6 Å²	49.6	39%	0.39	29%	0.288	S	S	.	.	H	α-helix	trans	-61.6	-40.1	175.9	-79.9	-58.8	0	0	0	112.3	L106 E107 V108 I113 L114	L106-N110 WeakPolarHBondContact O-CB 3.3Å; L106-N110 PolarHBondContact O-N 2.91Å; L106-N110 PolarHBondContact O-ND2 2.79Å; E107-N110 PolarHBondContact O-N 3.24Å; V108-N110 PolarHBondContact O-N 2.96Å; N110-I113 PolarHBondContact O-N 3.01Å; N110-L114 WeakPolarHBondContact O-CB 3.19Å; N110-L114 VanDerWaalsContact O-CG 3.24Å; N110-L114 WeakPolarHBondContact O-CG 3.45Å; N110-L114 PolarHBondContact O-N 3.28Å
111	N	88.5	Confident	85.4	Confident	103 Å²	103	52.2 Å²	52.2	55%	0.551	31%	0.31	S	S	*	.	H	α-helix	trans	-66.2	-38.2	176.4	-71	-35.1	0	0	0	112.4	E107 V108 I109 S115	E107-N111 VanDerWaalsContact O-CG 3.28Å; E107-N111 PolarHBondContact O-N 2.89Å; E107-N111 PolarHBondContact O-ND2 2.92Å; E107-N111 VanDerWaalsContact O-ND2 3.1Å; V108-N111 PolarHBondContact O-N 3.06Å; I109-N111 VanDerWaalsContact C-N 3.34Å; I109-N111 PolarHBondContact O-N 3.48Å; N111-S115 WeakPolarHBondContact O-CB 3.37Å; N111-S115 PolarHBondContact O-N 3.17Å; N111-S115 PolarHBondContact O-OG 3.19Å
112	I	87.8	Confident	83.3	Confident	102 Å²	102	57.1 Å²	57.1	52%	0.523	34%	0.336	S	S	.	.	H	α-helix	trans	-62.8	-47.3	173.1	-67	165.5	0	0	0	110.5	V108 I109 L114 S115 A116	V108-I112 HydrophobicContact CG1-CD1 3.88Å; V108-I112 WeakPolarHBondContact O-CG1 3.49Å; V108-I112 PolarHBondContact O-N 3.5Å; I109-I112 PolarHBondContact O-N 3Å; I112-L114 PolarHBondContact O-N 3.08Å; I112-S115 WeakPolarHBondContact CA-OG 3.45Å; I112-S115 PolarHBondContact O-N 3.02Å; I112-S115 PolarHBondContact O-OG 2.92Å; I112-A116 WeakPolarHBondContact O-CB 3.49Å; I112-A116 PolarHBondContact O-N 2.61Å
113	I	84.1	Confident	81.3	Confident	46 Å²	46	61.2 Å²	61.2	24%	0.236	36%	0.361	C	S	.	.	H	α-helix	trans	-60.6	-46.3	177.3	-66.5	164	0	0	0	111.2	Y56 I109 N110 S115 A116 I117	Y56-I113 HydrophobicContact CD1-CD1 4.13Å; Y56-I113 HydrophobicContact CE1-CD1 3.54Å; Y56-I113 HydrophobicContact CE1-CG1 3.9Å; I109-I113 HydrophobicContact CG2-CD1 3.79Å; I109-I113 HydrophobicContact CG2-CG1 4.48Å; I109-I113 VanDerWaalsContact O-CG1 3.3Å; I109-I113 WeakPolarHBondContact O-CG1 3.26Å; I109-I113 PolarHBondContact O-N 2.99Å; N110-I113 PolarHBondContact O-N 3.01Å; I113-S115 PolarHBondContact O-N 2.76Å; I113-A116 PolarHBondContact O-N 3.47Å; I113-I117 HydrophobicContact CG2-CD1 3.72Å; I113-I117 HydrophobicContact CG2-CG1 4.48Å; I113-I117 VanDerWaalsContact O-CG1 3.28Å; I113-I117 WeakPolarHBondContact O-CG1 3.01Å; I113-I117 PolarHBondContact O-N 2.95Å
114	L	84.4	Confident	79	Confident	104 Å²	104	67.2 Å²	67.2	55%	0.545	39%	0.392	S	S	.	.	H	α-helix	trans	-64.7	-39.3	-179.6	-73.3	169.3	0	0	0	112.8	N110 I112 T118	N110-L114 WeakPolarHBondContact O-CB 3.19Å; N110-L114 VanDerWaalsContact O-CG 3.24Å; N110-L114 WeakPolarHBondContact O-CG 3.45Å; N110-L114 PolarHBondContact O-N 3.28Å; I112-L114 PolarHBondContact O-N 3.08Å; L114-T118 WeakPolarHBondContact O-CB 3.5Å; L114-T118 PolarHBondContact O-N 3.41Å; L114-T118 PolarHBondContact O-OG1 3.22Å
115	S	84.1	Confident	76.7	Confident	64 Å²	64	72.1 Å²	72.1	45%	0.448	42%	0.421	S	S	.	.	H	α-helix	trans	-71.3	-37.6	176.5	54.1	0	0	0	0	112.5	N111 I112 I113 T118 T119	N111-S115 WeakPolarHBondContact O-CB 3.37Å; N111-S115 PolarHBondContact O-N 3.17Å; N111-S115 PolarHBondContact O-OG 3.19Å; I112-S115 WeakPolarHBondContact CA-OG 3.45Å; I112-S115 PolarHBondContact O-N 3.02Å; I112-S115 PolarHBondContact O-OG 2.92Å; I113-S115 PolarHBondContact O-N 2.76Å; S115-T118 PolarHBondContact O-N 3.01Å; S115-T119 WeakPolarHBondContact O-CB 3.43Å; S115-T119 PolarHBondContact O-N 2.82Å; S115-T119 PolarHBondContact O-OG1 3.25Å
116	A	82.6	Confident	74.1	Confident	58 Å²	58	77.1 Å²	77.1	48%	0.479	45%	0.453	S	S	.	.	H	α-helix	trans	-61.9	-47.2	171.9	0	0	0	0	0	112	I112 I113 T118 T119 A120	I112-A116 WeakPolarHBondContact O-CB 3.49Å; I112-A116 PolarHBondContact O-N 2.61Å; I113-A116 PolarHBondContact O-N 3.47Å; A116-T118 PolarHBondContact O-N 2.69Å; A116-T119 PolarHBondContact O-N 3.01Å; A116-A120 WeakPolarHBondContact O-CB 3.5Å; A116-A120 PolarHBondContact O-N 3.01Å
117	I	79.3	Confident	71.4	Confident	96 Å²	96	84.9 Å²	84.9	49%	0.492	49%	0.488	S	S	.	.	H	α-helix	trans	-60.8	-43.6	175.7	-69	167.7	0	0	0	111.1	I113 T119 A120 A121	I113-I117 HydrophobicContact CG2-CD1 3.72Å; I113-I117 HydrophobicContact CG2-CG1 4.48Å; I113-I117 VanDerWaalsContact O-CG1 3.28Å; I113-I117 WeakPolarHBondContact O-CG1 3.01Å; I113-I117 PolarHBondContact O-N 2.95Å; I117-T119 VanDerWaalsContact C-N 3.33Å; I117-T119 PolarHBondContact O-N 2.95Å; I117-A120 PolarHBondContact O-N 3.14Å; I117-A121 WeakPolarHBondContact O-CB 3.25Å; I117-A121 PolarHBondContact O-N 3.21Å
118	T	75.1	Confident	68.7	Low	78 Å²	78	92 Å²	92	48%	0.479	52%	0.519	S	S	.	.	H	α-helix	trans	-63.4	-39.7	178	-57	0	0	0	0	111.6	L114 S115 A116 A121 N122	L114-T118 WeakPolarHBondContact O-CB 3.5Å; L114-T118 PolarHBondContact O-N 3.41Å; L114-T118 PolarHBondContact O-OG1 3.22Å; S115-T118 PolarHBondContact O-N 3.01Å; A116-T118 PolarHBondContact O-N 2.69Å; T118-A121 PolarHBondContact O-N 3.48Å; T118-N122 VanDerWaalsContact O-CG 3.29Å; T118-N122 PolarHBondContact O-N 2.73Å; T118-N122 VanDerWaalsContact O-N 3.09Å; T118-N122 PolarHBondContact O-ND2 3.11Å
119	T	72.1	Confident	66	Low	85 Å²	85	92.5 Å²	92.5	52%	0.521	53%	0.53	S	S	.	.	H	α-helix	trans	-65.9	-45.9	176.9	-55.7	0	0	0	0	111.1	S115 A116 I117 A121 N122 T123	S115-T119 WeakPolarHBondContact O-CB 3.43Å; S115-T119 PolarHBondContact O-N 2.82Å; S115-T119 PolarHBondContact O-OG1 3.25Å; A116-T119 PolarHBondContact O-N 3.01Å; I117-T119 VanDerWaalsContact C-N 3.33Å; I117-T119 PolarHBondContact O-N 2.95Å; T119-A121 VanDerWaalsContact C-N 3.31Å; T119-A121 PolarHBondContact O-N 3.07Å; T119-N122 PolarHBondContact O-N 3.23Å; T119-T123 PolarHBondContact O-N 3.15Å; T119-T123 PolarHBondContact O-OG1 3.18Å
120	A	65.2	Low	63.3	Low	32 Å²	32	99.5 Å²	99.5	26%	0.264	57%	0.568	S	S	.	*	H	α-helix	trans	-65.5	-30.4	176.6	0	0	0	0	0	113.4	A116 I117 T123 N124 L160	A116-A120 WeakPolarHBondContact O-CB 3.5Å; A116-A120 PolarHBondContact O-N 3.01Å; I117-A120 PolarHBondContact O-N 3.14Å; A120-T123 PolarHBondContact O-OG1 3.44Å; A120-N124 PolarHBondContact O-ND2 2.81Å; A120-L160 HydrophobicContact CB-CD1 4.33Å
121	A	62	Low	60.8	Low	56 Å²	56	104.8 Å²	104.8	46%	0.463	59%	0.59	S	S	.	*	H	α-helix	trans	-68.5	-41.3	172.1	0	0	0	0	0	111.8	I117 T118 T119	I117-A121 WeakPolarHBondContact O-CB 3.25Å; I117-A121 PolarHBondContact O-N 3.21Å; T118-A121 PolarHBondContact O-N 3.48Å; T119-A121 VanDerWaalsContact C-N 3.31Å; T119-A121 PolarHBondContact O-N 3.07Å
122	N	54.4	Low	58.6	Low	102 Å²	102	107 Å²	107	55%	0.545	60%	0.601	S	S	.	*	H	α-helix	trans	-72.1	-42.9	-177.8	-70.9	-16.6	0	0	0	112.9	T118 T119 N124 V125 V126	T118-N122 VanDerWaalsContact O-CG 3.29Å; T118-N122 PolarHBondContact O-N 2.73Å; T118-N122 VanDerWaalsContact O-N 3.09Å; T118-N122 PolarHBondContact O-ND2 3.11Å; T119-N122 PolarHBondContact O-N 3.23Å; N122-N124 PolarHBondContact O-N 3.49Å; N122-V125 PolarHBondContact O-N 3Å; N122-V126 VanDerWaalsContact O-CG2 3.24Å; N122-V126 WeakPolarHBondContact O-CG2 3.34Å
123	T	54.6	Low	56.4	Low	88 Å²	88	109.8 Å²	109.8	54%	0.54	61%	0.611	S	S	.	*	H	α-helix	trans	-64.7	-25.6	-175.9	50.6	0	0	0	0	113.9	T119 A120 V125	T119-T123 PolarHBondContact O-N 3.15Å; T119-T123 PolarHBondContact O-OG1 3.18Å; A120-T123 PolarHBondContact O-OG1 3.44Å; T123-V125 VanDerWaalsContact C-N 3.28Å; T123-V125 PolarHBondContact O-N 3.44Å
124	N	46.3	Very low	54.2	Low	136 Å²	136	114.9 Å²	114.9	73%	0.727	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	2.7	179.1	-75.6	-71.6	0	0	0	114.7	A120 N122	A120-N124 PolarHBondContact O-ND2 2.81Å; N122-N124 PolarHBondContact O-N 3.49Å
125	V	43.1	Very low	52.2	Low	124 Å²	124	115 Å²	115	75%	0.752	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.8	-15.5	-177.8	-178.4	0	0	0	0	113.2	N122 T123	N122-V125 PolarHBondContact O-N 3Å; T123-V125 VanDerWaalsContact C-N 3.28Å; T123-V125 PolarHBondContact O-N 3.44Å
126	V	40.2	Very low	50.2	Low	118 Å²	118	118.6 Å²	118.6	72%	0.715	67%	0.666	S	S	*	*	S	Bend	trans	-105.3	11.7	-164.1	-140.6	0	0	0	0	115.6	N122	N122-V126 VanDerWaalsContact O-CG2 3.24Å; N122-V126 WeakPolarHBondContact O-CG2 3.34Å
127	H	36.9	Very low	48.2	Very low	166 Å²	166	122.4 Å²	122.4	77%	0.769	68%	0.683	S	S	*	*	S	Bend	trans	-126.5	18.8	-170.6	-143.4	-57.8	0	0	0	115.9
128	F	33	Very low	46.4	Very low	212 Å²	212	127.6 Å²	127.6	93%	0.93	70%	0.702	S	S	*	*	S	Bend	trans	-136.4	17.4	-178.8	-95.6	-76.8	0	0	0	115
129	A	34.5	Very low	45	Very low	81 Å²	81	129.5 Å²	129.5	67%	0.669	72%	0.716	S	S	*	*	S	Bend	trans	-141.2	140.5	172.1	0	0	0	0	0	110
130	N	34.6	Very low	43.4	Very low	166 Å²	166	130.3 Å²	130.3	89%	0.888	73%	0.731	S	S	*	*			trans	64.6	137.2	-154	-49.6	-19.9	0	0	0	111.2
131	E	33.8	Very low	42.2	Very low	183 Å²	183	134.3 Å²	134.3	86%	0.855	75%	0.754	S	S	*	*			cis	-137.9	144.1	14	-167.1	165.1	-164.7	0	0	110.6
132	I	43.1	Very low	41.3	Very low	151 Å²	151	139 Å²	139	77%	0.774	78%	0.777	S	S	*	*			trans	-132.5	138.1	-177.4	-73.4	173.9	0	0	0	107.9
133	Q	41.8	Very low	40.5	Very low	160 Å²	160	137.4 Å²	137.4	75%	0.748	79%	0.785	S	S	*	*			trans	73.1	139.9	-170.1	-58.4	158.2	16.9	0	0	113.7
134	N	36.8	Very low	39.8	Very low	152 Å²	152	136.4 Å²	136.4	81%	0.813	79%	0.792	S	S	*	*			cis	-153.3	162.3	-17.5	-124.3	5.1	0	0	0	110.4
135	P	43.2	Very low	39.3	Very low	106 Å²	106	140.3 Å²	140.3	69%	0.688	80%	0.803	S	S	*	*			trans	-109.7	144.7	-160.5	38.7	-33.9	0	0	0	117.2
136	T	42.3	Very low	39.1	Very low	141 Å²	141	137.5 Å²	137.5	87%	0.865	80%	0.799	S	S	*	*			trans	-167.5	140.1	142.6	41.8	0	0	0	0	106.8
137	T	39.5	Very low	39.1	Very low	138 Å²	138	137.9 Å²	137.9	85%	0.847	81%	0.807	S	S	*	*			cis	-132.9	178.3	27.7	46.8	0	0	0	0	113
138	K	42.4	Very low	39.3	Very low	204 Å²	204	134.3 Å²	134.3	89%	0.887	81%	0.806	S	S	*	*			trans	-106.9	162.7	-173.8	-96.9	-169.7	174.6	-177.5	0	114.6
139	P	45.2	Very low	39.5	Very low	119 Å²	119	131.5 Å²	131.5	77%	0.773	80%	0.801	S	S	*	*			trans	-109.5	-173.5	-162.1	43.6	-37.8	0	0	0	114.9
140	A	37.7	Very low	39.9	Very low	102 Å²	102	133.1 Å²	133.1	84%	0.843	80%	0.802	S	S	*	*			trans	-134.5	125.6	165.9	0	0	0	0	0	111.5
141	P	40.3	Very low	40.2	Very low	115 Å²	115	131.2 Å²	131.2	75%	0.747	80%	0.797	S	S	*	*			trans	-125.4	130.7	178.1	37.2	-23.8	0	0	0	115.4
142	V	44	Very low	40.4	Very low	154 Å²	154	129.6 Å²	129.6	93%	0.933	79%	0.793	S	S	*	*			trans	-155.3	145.2	166.7	-163.3	0	0	0	0	107.6
143	G	36.5	Very low	40.1	Very low	70 Å²	70	128.9 Å²	128.9	72%	0.722	79%	0.787	S	S	*	*			cis	155.4	113.8	-11	0	0	0	0	0	112.8
144	G	40.1	Very low	39.8	Very low	67 Å²	67	131.6 Å²	131.6	69%	0.691	79%	0.79	S	S	*	*			trans	87.2	167.7	174.1	0	0	0	0	0	116.5
145	F	37.6	Very low	39.6	Very low	218 Å²	218	128.1 Å²	128.1	96%	0.956	79%	0.79	S	S	*	*			cis	-165.3	160.1	-15.5	-100.9	-61.6	0	0	0	110.1
146	G	38.2	Very low	39.2	Very low	64 Å²	64	126.8 Å²	126.8	66%	0.66	80%	0.795	S	S	*	*			trans	100.2	113.9	175.3	0	0	0	0	0	113.2
147	S	40.9	Very low	38.9	Very low	127 Å²	127	128.3 Å²	128.3	89%	0.888	80%	0.798	S	S	*	*				86.8	139.1	53.1	-66.1	0	0	0	0	113.7
148	A	39.3	Very low	38.9	Very low	91 Å²	91	133.7 Å²	133.7	75%	0.752	80%	0.803	S	S	*	*			cis	-173	135.1	-22.6	0	0	0	0	0	109.2
149	D	39	Very low	38.5	Very low	152 Å²	152	127.3 Å²	127.3	81%	0.813	80%	0.796	S	S	*	*			trans	-162.8	176.8	140.7	-139.7	-42.5	0	0	0	111.4
150	T	42.6	Very low	38	Very low	115 Å²	115	128.1 Å²	128.1	71%	0.706	79%	0.793	S	S	*	*			trans	-87.1	166.3	-168.9	55.3	0	0	0	0	112.5
151	T	40.1	Very low	37.8	Very low	126 Å²	126	130.8 Å²	130.8	77%	0.773	79%	0.792	S	S	*	*			cis	-147.4	172.3	35.2	48.5	0	0	0	0	115.8
152	L	37.3	Very low	37.3	Very low	150 Å²	150	133.6 Å²	133.6	79%	0.785	80%	0.8	S	S	*	*			trans	-46.4	160.7	166.6	-76.9	69.5	0	0	0	114.7
153	E	37.1	Very low	36.8	Very low	136 Å²	136	131 Å²	131	64%	0.636	79%	0.789	S	S	*	*			cis	-144.8	143	1.9	-100.9	-120.5	127.6	0	0	107.6
154	R	35.3	Very low	36.8	Very low	217 Å²	217	131.9 Å²	131.9	82%	0.819	78%	0.784	S	S	*	*				49.9	120.5	91.8	-156	-174.2	-169.8	-170.1	5.2	114.4
155	G	33.5	Very low	36.5	Very low	78 Å²	78	136 Å²	136	80%	0.804	79%	0.79	S	S	*	*			cis	143.3	142.9	-6.8	0	0	0	0	0	112.7
156	G	34.7	Very low	36.6	Very low	78 Å²	78	132.3 Å²	132.3	80%	0.804	79%	0.785	S	S	*	*			trans	138.1	111.8	163	0	0	0	0	0	117.3	R158	G156-R158 PolarHBondContact O-N 2.96Å
157	N	35.6	Very low	36.3	Very low	174 Å²	174	136.4 Å²	136.4	93%	0.93	79%	0.792	S	S	*	*			trans	-69.5	121.6	166.7	-79.9	-0.5	0	0	0	111.5
158	R	39.3	Very low	36.3	Very low	250 Å²	250	138.6 Å²	138.6	94%	0.943	79%	0.787	S	S	*	*			trans	-144.6	143.7	154.2	-64.3	-174.9	177.5	170.5	-1	106.7	G156	G156-R158 PolarHBondContact O-N 2.96Å
159	G	34	Very low	36.2	Very low	71 Å²	71	144.8 Å²	144.8	73%	0.732	79%	0.791	S	S	*	*			cis	139	109.5	8.5	0	0	0	0	0	107.8	L161	G159-L161 PolarHBondContact O-N 3.44Å
160	L	34.4	Very low	35.8	Very low	135 Å²	135	140.1 Å²	140.1	71%	0.707	78%	0.779	S	S	*	*			trans	-63.4	119.3	-170.2	-72.9	166.6	0	0	0	112.7	A120	A120-L160 HydrophobicContact CB-CD1 4.33Å
161	L	33.4	Very low	35.6	Very low	159 Å²	159	140 Å²	140	83%	0.832	78%	0.781	S	S	*	*			trans	-143.3	137.6	160.3	-80.6	-179.6	0	0	0	111.2	G159	G159-L161 PolarHBondContact O-N 3.44Å
162	L	31.2	Very low	35.4	Very low	174 Å²	174	138.8 Å²	138.8	91%	0.911	77%	0.773	S	S	*	*			trans	-90.6	116.1	163.1	-89.8	67.5	0	0	0	108.6
163	S	33.6	Very low	35.4	Very low	100 Å²	100	139 Å²	139	70%	0.699	77%	0.774	S	S	*	*			trans	-154	109.9	167.3	-96.8	0	0	0	0	106.1
164	S	34.8	Very low	35.1	Very low	88 Å²	88	137.8 Å²	137.8	62%	0.615	78%	0.78	S	S	*	*				78.9	117.3	84.1	69.2	0	0	0	0	112.6
165	D	34	Very low	35.3	Very low	154 Å²	154	132.4 Å²	132.4	82%	0.824	78%	0.783	S	S	*	*			trans	64.7	89.4	154.9	-45.2	-34	0	0	0	117.8
166	V	40	Very low	35.2	Very low	139 Å²	139	135.2 Å²	135.2	84%	0.842	78%	0.779	S	S	*	*			trans	-127.6	86.5	153.5	-174	0	0	0	0	108.7
167	D	33	Very low	35.3	Very low	151 Å²	151	143 Å²	143	81%	0.807	78%	0.784	S	S	*	*			trans	-52.2	136.1	149.8	-85.2	-51.4	0	0	0	108.3
168	H	40.8	Very low	35.3	Very low	173 Å²	173	142.2 Å²	142.2	80%	0.801	78%	0.775	S	S	*	*			trans	-171	94.2	143.7	-101.2	31.7	0	0	0	113
169	R	36.7	Very low	35.2	Very low	220 Å²	220	142.1 Å²	142.1	83%	0.83	78%	0.775	S	S	*	*			trans	40.9	114.3	137.6	-66.7	-179.1	173	-176.6	-3.1	119.7
170	G	31.6	Very low	35.2	Very low	55 Å²	55	147.3 Å²	147.3	57%	0.567	78%	0.78	S	S	*	*			trans	-63.1	156.8	140	0	0	0	0	0	111.6	T172	G170-T172 PolarHBondContact O-N 3.23Å; G170-T172 VanDerWaalsContact O-N 3.08Å
171	P	38	Very low	35.4	Very low	113 Å²	113	145 Å²	145	73%	0.734	78%	0.776	S	S	*	*			trans	-75.1	100.9	-169.8	29.6	-35.3	0	0	0	113.1	L173	P171-L173 PolarHBondContact O-N 3.48Å
172	T	35.2	Very low	35.6	Very low	100 Å²	100	145.3 Å²	145.3	61%	0.613	77%	0.772	S	S	*	*			trans	-73	115.5	166.1	50.2	0	0	0	0	110.7	G170 S174	G170-T172 PolarHBondContact O-N 3.23Å; G170-T172 VanDerWaalsContact O-N 3.08Å; T172-S174 PolarHBondContact O-N 2.86Å; T172-S174 PolarHBondContact O-OG 3.46Å
173	L	37.4	Very low	36	Very low	155 Å²	155	142.2 Å²	142.2	81%	0.812	77%	0.765	S	S	*	*			trans	-64.3	105.5	172.8	-69.6	171.1	0	0	0	110.3	P171 A175	P171-L173 PolarHBondContact O-N 3.48Å; L173-A175 PolarHBondContact O-N 3.35Å
174	S	31.9	Very low	36.2	Very low	109 Å²	109	143.3 Å²	143.3	76%	0.762	77%	0.77	S	S	*	*			trans	-86.4	92.3	-177.3	-61.6	0	0	0	0	111.2	T172 N176	T172-S174 PolarHBondContact O-N 2.86Å; T172-S174 PolarHBondContact O-OG 3.46Å; S174-N176 PolarHBondContact O-N 2.96Å
175	A	37.8	Very low	36.4	Very low	105 Å²	105	144.8 Å²	144.8	87%	0.868	78%	0.778	S	S	*	*			trans	-74.8	101.4	170.1	0	0	0	0	0	110.3	L173	L173-A175 PolarHBondContact O-N 3.35Å
176	N	31.7	Very low	36.6	Very low	136 Å²	136	144.2 Å²	144.2	73%	0.727	78%	0.78	S	S	*	*			trans	-76.4	127.4	-179.7	-175.9	17	0	0	0	111.5	S174	S174-N176 PolarHBondContact O-N 2.96Å
177	R	37.2	Very low	36.5	Very low	242 Å²	242	146.2 Å²	146.2	91%	0.913	78%	0.779	S	S	*	*			trans	-148.5	106.9	166.1	-141.2	177.9	-160.4	-151.6	4.4	112.6
178	Q	34.8	Very low	36.8	Very low	158 Å²	158	149 Å²	149	74%	0.738	78%	0.784	S	S	*	*			trans	-68	147.4	173.3	-64.4	153	-85.9	0	0	112
179	R	38.5	Very low	36.2	Very low	247 Å²	247	147.3 Å²	147.3	93%	0.932	78%	0.781	S	S	*	*			trans	-156.7	146.1	130.3	-108.8	168.9	-166.1	-107.7	-0.8	110.5
180	Q	34.5	Very low	36	Very low	180 Å²	180	148.5 Å²	148.5	84%	0.841	79%	0.786	S	S	*	*			trans	-84.6	174.6	172.3	-61.5	139.6	-35.4	0	0	108.6
181	S	37.9	Very low	36.1	Very low	88 Å²	88	153 Å²	153	62%	0.615	79%	0.789	S	S	*	*			cis	-155	170.1	20	62.8	0	0	0	0	114.9
182	E	37.6	Very low	36.1	Very low	164 Å²	164	153.6 Å²	153.6	77%	0.766	79%	0.787	S	S	*	*			trans	67.6	104.1	143	-74.5	158.1	130.3	0	0	124
183	S	39.1	Very low	36.5	Very low	109 Å²	109	154.4 Å²	154.4	76%	0.762	79%	0.791	S	S	*	*				81.2	148.6	108.7	-61.2	0	0	0	0	122
184	P	38.8	Very low	36.7	Very low	123 Å²	123	153.7 Å²	153.7	80%	0.799	79%	0.788	S	S	*	*			trans	-134.9	-142.6	-136.2	45.2	-23.2	0	0	0	114.3
185	P	39.1	Very low	36.8	Very low	120 Å²	120	152.4 Å²	152.4	78%	0.779	78%	0.784	S	S	*	*				-124	175	-124.5	34.2	-11.4	0	0	0	116.2
186	V	38.2	Very low	37.3	Very low	142 Å²	142	158.6 Å²	158.6	86%	0.861	79%	0.787	S	S	*	*			trans	-134.8	130.6	171.3	179.5	0	0	0	0	112.2
187	H	36.1	Very low	37.7	Very low	180 Å²	180	159.5 Å²	159.5	83%	0.833	79%	0.791	S	S	*	*			trans	-74.8	136	171.7	-118.5	-101.3	0	0	0	111.6
188	K	39.4	Very low	38.1	Very low	210 Å²	210	155.6 Å²	155.6	91%	0.913	78%	0.784	S	S	*	*			trans	-146.7	150.4	140.1	-75.4	-155.5	177.2	179.7	0	110.7
189	N	29.8	Very low	38.7	Very low	138 Å²	138	155 Å²	155	74%	0.738	79%	0.785	S	S	*	*			trans	-118.9	141	-178.1	-174.6	25.1	0	0	0	108.2
190	W	31.7	Very low	39.2	Very low	245 Å²	245	149.9 Å²	149.9	93%	0.928	78%	0.777	S	S	*	*			trans	-146.3	161.2	164.5	-149.6	-87.8	0	0	0	110.2
191	K	33.1	Very low	40.2	Very low	148 Å²	148	147.5 Å²	147.5	64%	0.643	77%	0.769	S	S	*	*			trans	-139.7	155.9	-155.6	-142.1	-168.9	169.3	-135	0	109.4
192	D	38.2	Very low	40.4	Very low	126 Å²	126	152.9 Å²	152.9	67%	0.674	78%	0.776	S	S	*	*			trans	66.6	154.9	165.6	-42.2	-39.5	0	0	0	113.2
193	V	43.3	Very low	40.7	Very low	117 Å²	117	151.6 Å²	151.6	71%	0.709	77%	0.774	S	S	*	*			cis	-154.4	-172	-4.7	100.3	0	0	0	0	110.2
194	D	41.4	Very low	40.9	Very low	141 Å²	141	152.6 Å²	152.6	75%	0.754	78%	0.776	S	S	*	*			trans	77.6	117.2	177	-53.3	-42.8	0	0	0	116.4
195	A	35.7	Very low	40.9	Very low	81 Å²	81	152.6 Å²	152.6	67%	0.669	78%	0.776	S	S	*	*			cis	89	106.1	26.5	0	0	0	0	0	115.3
196	Y	46.5	Very low	40.5	Very low	236 Å²	236	155.8 Å²	155.8	93%	0.925	78%	0.78	S	S	*	*			trans	-151.3	129	159.5	-87.3	-74.7	0	0	0	110.4
197	D	41.7	Very low	40.5	Very low	154 Å²	154	155.4 Å²	155.4	82%	0.824	78%	0.779	S	S	*	*			trans	-79.9	178.8	179.1	-64.2	-66.3	0	0	0	112.7
198	E	45.2	Very low	40.9	Very low	161 Å²	161	153.4 Å²	153.4	75%	0.752	78%	0.778	S	S	*	*			cis	-159.6	-167.3	1.6	-124.9	-88.9	67.8	0	0	108.7
199	D	46.5	Very low	40.5	Very low	144 Å²	144	151.8 Å²	151.8	77%	0.77	77%	0.774	S	S	*	*			trans	74.5	139.6	168.4	-57.9	-51.8	0	0	0	116.5
200	D	50.1	Low	41.4	Very low	141 Å²	141	152 Å²	152	75%	0.754	78%	0.781	S	S	*	*			cis	-150.5	108.9	24.2	-173.7	5.2	0	0	0	113.1
201	L	55.9	Low	41.7	Very low	129 Å²	129	146.3 Å²	146.3	68%	0.675	78%	0.775	S	S	*	*			trans	39.7	123.9	138.6	-142.8	74	0	0	0	123.9
202	R	41.9	Very low	42	Very low	202 Å²	202	143.3 Å²	143.3	76%	0.762	79%	0.786	S	S	*	*				150.6	115.2	118.6	-78.8	176.2	-159.2	-114.3	-7	116.4
203	D	42.4	Very low	42	Very low	137 Å²	137	146.2 Å²	146.2	73%	0.733	80%	0.795	S	S	*	*				41.5	143	129.3	-51.2	-40.1	0	0	0	121.8
204	T	44	Very low	41.7	Very low	130 Å²	130	145.2 Å²	145.2	80%	0.798	79%	0.791	S	S	*	*			cis	-152.8	-170.2	21.8	-12.3	0	0	0	0	110.8
205	P	39.4	Very low	41.4	Very low	122 Å²	122	143.8 Å²	143.8	79%	0.792	79%	0.788	S	S	*	*				-116.8	-172.2	-127.2	41.3	-22.8	0	0	0	117.3
206	Q	30.6	Very low	41.5	Very low	187 Å²	187	147.1 Å²	147.1	87%	0.874	80%	0.8	S	S	*	*			trans	-88.6	164.1	-170	-55.1	167.4	-1.6	0	0	114.8
207	T	38	Very low	41.1	Very low	135 Å²	135	145 Å²	145	83%	0.828	80%	0.795	S	S	*	*			trans	-142.2	104.7	158.9	-55	0	0	0	0	112.9
208	V	43.4	Very low	40.9	Very low	137 Å²	137	147.2 Å²	147.2	83%	0.83	80%	0.798	S	S	*	*			trans	36.6	141.7	139.8	-165.7	0	0	0	0	122
209	E	31.9	Very low	40.3	Very low	176 Å²	176	145 Å²	145	82%	0.822	80%	0.798	S	S	*	*			trans	-87.5	153.1	-174.1	-43.6	164.8	117.9	0	0	115.2
210	V	48.7	Very low	39.5	Very low	144 Å²	144	146.5 Å²	146.5	87%	0.873	80%	0.8	S	S	*	*			trans	-151.2	126.4	148.6	-173.8	0	0	0	0	110.8
211	P	37.4	Very low	39	Very low	124 Å²	124	145.9 Å²	145.9	81%	0.805	80%	0.803	S	S	*	*			trans	-107.5	143.8	170.8	36.1	-29.2	0	0	0	114
212	G	39.7	Very low	38.2	Very low	85 Å²	85	146.6 Å²	146.6	88%	0.876	81%	0.813	S	S	*	*			trans	-157.5	140.8	178.9	0	0	0	0	0	115.1
213	Q	38.2	Very low	38.1	Very low	188 Å²	188	139.9 Å²	139.9	88%	0.879	81%	0.806	S	S	*	*			trans	-96.7	-177.1	-175.4	-111	-176	31.5	0	0	112.2
214	P	37.5	Very low	38	Very low	95 Å²	95	139.7 Å²	139.7	62%	0.617	81%	0.813	S	S	*	*			cis	-140.3	165.1	-10.3	31	-8.5	0	0	0	117.9
215	T	34.7	Very low	37.5	Very low	111 Å²	111	137.3 Å²	137.3	68%	0.681	81%	0.814	S	S	*	*			trans	41.5	128.7	144.4	61.6	0	0	0	0	124.6
216	T	38	Very low	37.9	Very low	151 Å²	151	137.8 Å²	137.8	93%	0.926	81%	0.814	S	S	*	*				-139.1	167	121.3	44.5	0	0	0	0	109.9
217	K	37.6	Very low	38.6	Very low	191 Å²	191	138.5 Å²	138.5	83%	0.83	81%	0.814	S	S	*	*			trans	-140.5	163	-171.1	-68.2	-176.8	179.5	177.5	0	113.4
218	K	37.8	Very low	38.8	Very low	202 Å²	202	140.3 Å²	140.3	88%	0.878	81%	0.811	S	S	*	*			trans	81.9	155	168.3	-65.3	-176.5	174.3	-178.6	0	117.1
219	P	32.3	Very low	38.9	Very low	115 Å²	115	143.7 Å²	143.7	75%	0.747	81%	0.808	S	S	*	*			cis	-132.3	172.1	-28.9	35.3	-18.4	0	0	0	114.2
220	Q	30	Very low	39.5	Very low	175 Å²	175	139.9 Å²	139.9	82%	0.818	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-76.1	144.8	165.5	-67.4	177.5	-12.1	0	0	111.7
221	P	38.8	Very low	39.5	Very low	127 Å²	127	141.9 Å²	141.9	83%	0.825	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-96	126.1	157.1	33.7	-27.2	0	0	0	111
222	V	39.1	Very low	39.9	Very low	145 Å²	145	141.8 Å²	141.8	88%	0.879	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-95.1	125.3	169.9	-176.2	0	0	0	0	108.5
223	G	41.5	Very low	40.1	Very low	60 Å²	60	146.1 Å²	146.1	62%	0.619	79%	0.794	S	S	*	*			trans	-169.4	146.8	178.4	0	0	0	0	0	112
224	P	39.6	Very low	40.3	Very low	134 Å²	134	147 Å²	147	87%	0.87	80%	0.795	S	S	*	*			trans	-68.7	137.8	-168.7	26.4	-34.2	0	0	0	113	V226	P224-V226 PolarHBondContact O-N 3.2Å
225	G	33.8	Very low	40.6	Very low	79 Å²	79	149.3 Å²	149.3	81%	0.814	80%	0.802	S	S	*	*			trans	-82.5	104.8	-165.1	0	0	0	0	0	115.4
226	V	46.5	Very low	41.5	Very low	133 Å²	133	152.2 Å²	152.2	81%	0.806	81%	0.807	S	S	*	*			trans	-89.6	102	156.1	-178.3	0	0	0	0	108.7	P224 K228	P224-V226 PolarHBondContact O-N 3.2Å; V226-K228 PolarHBondContact O-N 3.07Å
227	K	46	Very low	43	Very low	202 Å²	202	150.2 Å²	150.2	88%	0.878	79%	0.786	S	S	*	*			trans	-67.4	90.1	174.1	-72.4	-178.7	179	175.2	0	110.1	R229	K227-R229 PolarHBondContact O-N 2.83Å; K227-R229 VanDerWaalsContact O-N 3.17Å
228	K	43.2	Very low	45	Very low	173 Å²	173	145.6 Å²	145.6	75%	0.752	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-51.4	120.3	170	-77.5	-177.3	173.5	179.8	0	109.2	V226 F231	V226-K228 PolarHBondContact O-N 3.07Å; K228-F231 HydrophobicContact CB-CE2 4.37Å
229	R	44.8	Very low	47.3	Very low	207 Å²	207	137.5 Å²	137.5	78%	0.781	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-63.5	136.5	175.9	-62	-175.2	-175.7	-169.3	2.9	108.8	K227 F231	K227-R229 PolarHBondContact O-N 2.83Å; K227-R229 VanDerWaalsContact O-N 3.17Å; R229-F231 VanDerWaalsContact O-CD2 3.27Å; R229-F231 WeakPolarHBondContact O-CD2 3.46Å; R229-F231 WeakPolarHBondContact O-CE2 3.46Å; R229-F231 PolarHBondContact O-N 3.21Å
230	P	43.9	Very low	50.2	Low	97 Å²	97	132.9 Å²	132.9	63%	0.63	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-66.1	116.8	179.4	25.2	-33	0	0	0	110.9	S232	P230-S232 PolarHBondContact O-N 3.37Å
231	F	49.4	Very low	53.3	Low	185 Å²	185	124.6 Å²	124.6	81%	0.811	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	35.6	-165.1	-69.1	-89.4	0	0	0	116	K228 R229	K228-F231 HydrophobicContact CB-CE2 4.37Å; R229-F231 VanDerWaalsContact O-CD2 3.27Å; R229-F231 WeakPolarHBondContact O-CD2 3.46Å; R229-F231 WeakPolarHBondContact O-CE2 3.46Å; R229-F231 PolarHBondContact O-N 3.21Å
232	S	46.5	Very low	55.8	Low	122 Å²	122	120.7 Å²	120.7	85%	0.853	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.6	8.7	177.9	-55	0	0	0	0	115.5	P230	P230-S232 PolarHBondContact O-N 3.37Å
233	K	43	Very low	58.4	Low	177 Å²	177	114.3 Å²	114.3	77%	0.77	60%	0.604	S	S	*	*			trans	-87	110.2	168.5	-66.5	-169.5	177.6	-173	0	109.4	N235	K233-N235 PolarHBondContact O-N 3.42Å
234	K	41.4	Very low	61	Low	207 Å²	207	111.5 Å²	111.5	90%	0.9	58%	0.575	S	S	*	*			trans	-55.4	121.4	161.3	-71.7	-173.7	177.7	-176.1	0	107.1	E236	K234-E236 PolarHBondContact O-N 2.93Å
235	N	45.8	Very low	63.7	Low	143 Å²	143	105.1 Å²	105.1	77%	0.765	53%	0.534	S	S	*	.			trans	-80.4	89.2	-177.9	-166.2	95.3	0	0	0	108.6	K233 F237	K233-N235 PolarHBondContact O-N 3.42Å; N235-F237 PolarHBondContact O-N 2.96Å; N235-F237 VanDerWaalsContact O-N 3.17Å
236	E	53.5	Low	66.7	Low	171 Å²	171	102 Å²	102	80%	0.799	50%	0.499	S	S	*	.			trans	-52.7	116.8	-178.5	-168.5	170	-171	0	0	110.5	K234 V238	K234-E236 PolarHBondContact O-N 2.93Å; E236-V238 PolarHBondContact O-N 2.93Å
237	F	68.4	Low	69.1	Low	110 Å²	110	95.6 Å²	95.6	48%	0.482	46%	0.461	S	S	.	.			trans	-75.8	107.3	-178.8	177.6	-92.1	0	0	0	109	N235 P239 A500	N235-F237 PolarHBondContact O-N 2.96Å; N235-F237 VanDerWaalsContact O-N 3.17Å; F237-P239 HydrophobicContact CE1-CB 4.2Å; F237-A500 HydrophobicContact CB-CB 4.1Å; F237-A500 HydrophobicContact CD1-CB 3.77Å; F237-A500 HydrophobicContact CG-CB 4.22Å
238	V	79.5	Confident	71.6	Confident	93 Å²	93	87.7 Å²	87.7	56%	0.564	43%	0.425	S	S	*	.			trans	-84.7	117.4	171	-177.5	0	0	0	0	107.6	N48 E236	N48-V238 HydrophobicContact CB-CG1 3.74Å; E236-V238 PolarHBondContact O-N 2.93Å
239	P	87.5	Confident	74.2	Confident	33 Å²	33	79.5 Å²	79.5	21%	0.214	39%	0.39	C	S	.	.			trans	-64.3	145.9	177.8	28.1	-34.7	0	0	0	110.1	N48 F237 Y241	N48-P239 WeakPolarHBondContact CB-O 3.46Å; N48-P239 PolarHBondContact ND2-O 3.43Å; F237-P239 HydrophobicContact CE1-CB 4.2Å; P239-Y241 PolarHBondContact O-N 3.36Å; P239-Y241 VanDerWaalsContact O-N 3.15Å
240	P	92.6	Very high	76.7	Confident	18 Å²	18	69.9 Å²	69.9	12%	0.117	35%	0.354	C	S	.	.	S	Bend	trans	-63.2	-25.4	-174.9	25.4	-34.6	0	0	0	113	N48 I49 P103 L106	N48-P240 PolarHBondContact N-O 3.17Å; I49-P240 HydrophobicContact CD1-CB 3.91Å; I49-P240 HydrophobicContact CG1-CB 4.04Å; P103-P240 HydrophobicContact CB-CG 4.05Å; L106-P240 HydrophobicContact CD1-CB 3.81Å; L106-P240 HydrophobicContact CD1-CG 4.17Å
241	Y	94.8	Very high	79.3	Confident	1 Å²	1	65.3 Å²	65.3	0%	0.004	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	147.8	175.5	-59.5	-39.5	0	0	0	110.3	V45 R46 T47 F69 L75 W86 I100 P101 P103 L106 P239 L495	V45-Y241 HydrophobicContact CB-CG 4.43Å; V45-Y241 HydrophobicContact CG2-CD1 4.1Å; V45-Y241 HydrophobicContact CG2-CG 4.05Å; R46-Y241 WeakPolarHBondContact O-CA 3.34Å; T47-Y241 HydrophobicContact CG2-CD1 4.2Å; T47-Y241 HydrophobicContact CG2-CE1 4.11Å; F69-Y241 HydrophobicContact CE1-CE1 4.34Å; F69-Y241 HydrophobicContact CE2-CE1 4.11Å; F69-Y241 AromaticContact CZ-CE1 3.65Å; F69-Y241 HydrophobicContact CZ-CE1 3.65Å; F69-Y241 AromaticContact CZ-CZ 3.95Å; F69-Y241 WeakPolarHBondContact CZ-OH 3.14Å; L75-Y241 HydrophobicContact CD1-CE1 3.87Å; W86-Y241 HydrophobicContact CE3-CE2 4.32Å; W86-Y241 HydrophobicContact CH2-CD2 4.01Å; W86-Y241 HydrophobicContact CH2-CE2 4.24Å; W86-Y241 AromaticContact CZ3-CD2 3.75Å; W86-Y241 HydrophobicContact CZ3-CD2 3.75Å; W86-Y241 AromaticContact CZ3-CE2 3.77Å; W86-Y241 HydrophobicContact CZ3-CE2 3.77Å; I100-Y241 VanDerWaalsContact CG2-OH 3.32Å; I100-Y241 WeakPolarHBondContact CG2-OH 3.18Å; P101-Y241 VanDerWaalsContact O-CE2 3.31Å; P101-Y241 WeakPolarHBondContact O-CE2 3.45Å; P101-Y241 PolarHBondContact O-OH 3.35Å; P103-Y241 HydrophobicContact CG-CD2 3.93Å; P103-Y241 HydrophobicContact CG-CE2 4.38Å; L106-Y241 HydrophobicContact CD1-CE1 4.22Å; L106-Y241 HydrophobicContact CD1-CE2 4Å; P239-Y241 PolarHBondContact O-N 3.36Å; P239-Y241 VanDerWaalsContact O-N 3.15Å; Y241-L495 HydrophobicContact CD2-CD2 4.27Å
242	E	91.3	Very high	81.6	Confident	45 Å²	45	56.6 Å²	56.6	21%	0.21	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	129.4	173.2	-178.6	-176.7	162.1	0	0	108.6	V45 R46 V244 C357	V45-E242 CarbonylContact C-O 3.59Å; V45-E242 WeakPolarHBondContact CA-O 3.26Å; V45-E242 WeakPolarHBondContact CB-O 3.32Å; R46-E242 IonicContact CZ-OE1 3.94Å; R46-E242 IonicContact CZ-OE2 2.72Å; R46-E242 PolarHBondContact N-O 3.09Å; R46-E242 IonicContact NE-OE2 3.25Å; R46-E242 PolarHBondContact NE-OE2 2.91Å; R46-E242 IonicContact NH2-OE1 3.17Å; R46-E242 PolarHBondContact NH2-OE1 2.9Å; R46-E242 IonicContact NH2-OE2 3.12Å; R46-E242 PolarHBondContact NH2-OE2 3.44Å; R46-E242 PolarHBondContact O-N 2.77Å; E242-V244 PolarHBondContact O-N 2.86Å; E242-C357 WeakPolarHBondContact OE1-CA 3.47Å
243	I	93.8	Very high	84	Confident	10 Å²	10	50.8 Å²	50.8	5%	0.051	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	129.6	177.4	-76.1	172	0	0	0	110.2	V45 F331 L475 V478 L495 T496	V45-I243 HydrophobicContact CG1-CG1 4.5Å; I243-F331 HydrophobicContact CG2-CE1 3.55Å; I243-F331 HydrophobicContact CG2-CZ 3.98Å; I243-L475 HydrophobicContact CD1-CD1 4.42Å; I243-V478 HydrophobicContact CD1-CG1 4.24Å; I243-V478 HydrophobicContact CG2-CG2 3.9Å; I243-L495 HydrophobicContact CD1-CB 3.71Å; I243-L495 HydrophobicContact CD1-CD1 4.19Å; I243-L495 HydrophobicContact CG1-CB 4.04Å; I243-L495 HydrophobicContact CG1-CD1 4.23Å; I243-T496 HydrophobicContact CD1-CG2 4.12Å
244	V	95.1	Very high	86.5	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.006	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	159	178.3	-56.8	0	0	0	0	111.3	S44 R46 F74 E242 C357 A359	S44-V244 PolarHBondContact O-N 3.25Å; S44-V244 VanDerWaalsContact O-N 3.12Å; R46-V244 HydrophobicContact CB-CG1 3.76Å; F74-V244 HydrophobicContact CD1-CG2 4.05Å; F74-V244 HydrophobicContact CE1-CG2 4.26Å; E242-V244 PolarHBondContact O-N 2.86Å; V244-C357 WeakPolarHBondContact CA-O 3.3Å; V244-C357 WeakPolarHBondContact CG1-O 3.4Å; V244-A359 HydrophobicContact CB-CB 4.36Å; V244-A359 HydrophobicContact CG1-CB 3.84Å
245	P	96.6	Very high	89.2	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.006	17%	0.166	C	C	.	.			trans	-57.3	144.2	175.1	-26.4	36.1	0	0	0	112.5	M247 I330 F331 C357 L358	P245-M247 VanDerWaalsContact C-N 3.31Å; P245-M247 WeakPolarHBondContact CB-O 3.42Å; P245-M247 PolarHBondContact O-N 3.01Å; P245-I330 HydrophobicContact CG-CG2 4.46Å; P245-F331 HydrophobicContact CB-CD1 4.45Å; P245-F331 HydrophobicContact CG-CD1 4.03Å; P245-F331 HydrophobicContact CG-CD2 4.28Å; P245-F331 HydrophobicContact CG-CE1 4.02Å; P245-F331 HydrophobicContact CG-CE2 4.26Å; P245-F331 HydrophobicContact CG-CG 4.17Å; P245-F331 HydrophobicContact CG-CZ 4.13Å; P245-C357 WeakPolarHBondContact CD-O 3.47Å; P245-L358 HydrophobicContact CG-CD2 4.09Å
246	C	96.6	Very high	91.6	Very high	12 Å²	12	25.8 Å²	25.8	8%	0.081	13%	0.13	C	C	.	.	S	Bend	trans	-62.1	-38.9	-177.8	-59.3	0	0	0	0	112.6	V41 H76 G334 M337	V41-C246 HydrophobicContact CG1-CB 4.31Å; H76-C246 PolarHBondContact NE2-O 2.95Å; C246-G334 WeakPolarHBondContact CB-O 3.38Å; C246-M337 HydrophobicContact CB-SD 4.05Å
247	M	98.1	Very high	93.7	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.104	C	C	.	.	S	Bend	trans	-104.1	122.1	163.1	-65.3	-69.6	-76.9	0	0	109.1	P245 G334 M337 Q338 L339 Y429 W430 T433	P245-M247 VanDerWaalsContact C-N 3.31Å; P245-M247 WeakPolarHBondContact CB-O 3.42Å; P245-M247 PolarHBondContact O-N 3.01Å; M247-G334 PolarHBondContact N-O 3.2Å; M247-G334 VanDerWaalsContact N-O 3.11Å; M247-M337 HydrophobicContact CG-SD 4.29Å; M247-M337 HydrophobicContact SD-CE 4.18Å; M247-M337 HydrophobicContact SD-SD 4.49Å; M247-Q338 VanDerWaalsContact CB-O 3.31Å; M247-Q338 WeakPolarHBondContact CB-O 3.37Å; M247-Q338 VanDerWaalsContact CG-O 3.3Å; M247-Q338 WeakPolarHBondContact CG-O 3.24Å; M247-L339 HydrophobicContact CE-CD2 3.94Å; M247-Y429 HydrophobicContact CE-CE1 4.05Å; M247-W430 HydrophobicContact CE-CE3 4.18Å; M247-W430 HydrophobicContact CE-CZ3 4.31Å; M247-T433 HydrophobicContact CE-CG2 4.48Å; M247-T433 HydrophobicContact SD-CG2 3.61Å; M247-T433 PolarHBondContact SD-OG1 2.7Å
248	R	97.8	Very high	95	Very high	36 Å²	36	15.3 Å²	15.3	14%	0.136	8%	0.084	C	C	.	.	P	Polyproline II helix	trans	-61.9	128.1	176.8	-67.1	174.1	67.1	-160.6	-2	108.9	F74 A359 P360 I361 D407 Y429	F74-R248 HydrophobicContact CD1-CG 4.29Å; F74-R248 HydrophobicContact CE1-CG 3.94Å; F74-R248 HydrophobicContact CZ-CG 4.26Å; R248-A359 PolarHBondContact NE-O 3.09Å; R248-P360 PolarHBondContact NH2-O 2.78Å; R248-I361 HydrophobicContact CB-CD1 3.96Å; R248-I361 HydrophobicContact CB-CG1 3.84Å; R248-D407 IonicContact CZ-OD1 3.04Å; R248-D407 VanDerWaalsContact CZ-OD1 3.23Å; R248-D407 IonicContact NH1-OD1 2.62Å; R248-D407 PolarHBondContact NH1-OD1 3.1Å; R248-D407 VanDerWaalsContact NH2-CG 3.31Å; R248-D407 IonicContact NH2-OD1 2.72Å; R248-D407 PolarHBondContact NH2-OD1 3.34Å; R248-D407 IonicContact NH2-OD2 2.69Å; R248-D407 PolarHBondContact NH2-OD2 3.39Å; R248-D407 VanDerWaalsContact NH2-OD2 3.17Å; R248-Y429 PolarHBondContact N-OH 3.24Å
249	P	98	Very high	95.8	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	9%	0.087	C	C	.	.	P	Polyproline II helix	trans	-69.4	132.7	176.7	24	-29.4	0	0	0	111.5	I330 L340 L342 L358 P360 I361	P249-I330 HydrophobicContact CB-CG2 4.45Å; P249-I330 HydrophobicContact CG-CG2 4.22Å; P249-L340 CarbonylContact C-O 3.58Å; P249-L340 VanDerWaalsContact CA-O 3.3Å; P249-L340 WeakPolarHBondContact CA-O 3.47Å; P249-L340 HydrophobicContact CB-CD2 4.23Å; P249-L340 HydrophobicContact CB-CG 4.24Å; P249-L342 HydrophobicContact CB-CD1 3.46Å; P249-L342 VanDerWaalsContact CB-CD1 3.46Å; P249-L342 HydrophobicContact CB-CG 3.71Å; P249-L342 HydrophobicContact CG-CD1 4.1Å; P249-L358 WeakPolarHBondContact CD-O 3.47Å; P249-L358 HydrophobicContact CG-CB 4.12Å; P249-P360 HydrophobicContact CG-CB 4.18Å; P249-P360 CarbonylContact O-C 3.41Å; P249-P360 WeakPolarHBondContact O-CA 3.5Å; P249-P360 WeakPolarHBondContact O-CB 3.4Å; P249-I361 PolarHBondContact O-N 2.89Å
250	V	98.1	Very high	96.2	Very high	5 Å²	5	14.4 Å²	14.4	3%	0.03	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	129.9	173.2	-178.8	0	0	0	0	109.4	F252 L340 L341 L342 I361 I363 L426	V250-F252 HydrophobicContact CG1-CD2 4.36Å; V250-F252 HydrophobicContact CG1-CE2 3.94Å; V250-L340 PolarHBondContact N-O 2.89Å; V250-L341 HydrophobicContact CB-CD1 4.24Å; V250-L341 HydrophobicContact CG1-CD1 4.13Å; V250-L342 PolarHBondContact O-N 3.38Å; V250-I361 WeakPolarHBondContact CA-O 3.49Å; V250-I361 HydrophobicContact CG2-CB 4.21Å; V250-I361 HydrophobicContact CG2-CD1 4.3Å; V250-I361 HydrophobicContact CG2-CG2 4.36Å; V250-I363 HydrophobicContact CG1-CD1 3.55Å; V250-I363 HydrophobicContact CG1-CG1 4.07Å; V250-L426 HydrophobicContact CG2-CD2 4.03Å
251	V	97.6	Very high	96.5	Very high	2 Å²	2	16.3 Å²	16.3	1%	0.012	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	127.3	-179.3	-176.2	0	0	0	0	110.1	L342 I347 I353 P360 I361 I363	V251-L342 HydrophobicContact CG2-CB 4.33Å; V251-I347 HydrophobicContact CG1-CG2 4.07Å; V251-I353 HydrophobicContact CB-CD1 4.01Å; V251-I353 HydrophobicContact CG1-CD1 3.88Å; V251-I353 HydrophobicContact CG2-CD1 4.27Å; V251-P360 HydrophobicContact CG2-CB 3.81Å; V251-I361 PolarHBondContact N-O 3.34Å; V251-I363 PolarHBondContact O-N 3.43Å
252	F	97.3	Very high	96.5	Very high	1 Å²	1	16.8 Å²	16.8	0%	0.004	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	135.8	178.2	-74.2	-97.4	0	0	0	113.3	V250 K258 Q267 I270 F271 L341 I363 I365 I410 L422	V250-F252 HydrophobicContact CG1-CD2 4.36Å; V250-F252 HydrophobicContact CG1-CE2 3.94Å; F252-K258 VanDerWaalsContact O-CE 3.3Å; F252-K258 WeakPolarHBondContact O-CE 3.4Å; F252-K258 PolarHBondContact O-NZ 3.17Å; F252-K258 VanDerWaalsContact O-NZ 3.17Å; F252-Q267 HydrophobicContact CB-CG 4.49Å; F252-Q267 PolarHBondContact O-NE2 3.28Å; F252-I270 HydrophobicContact CE1-CG2 3.81Å; F252-I270 HydrophobicContact CZ-CG2 3.79Å; F252-F271 HydrophobicContact CB-CE1 3.87Å; F252-F271 HydrophobicContact CB-CZ 4.16Å; F252-F271 HydrophobicContact CD1-CE1 4.37Å; F252-F271 HydrophobicContact CD2-CD1 4.01Å; F252-F271 AromaticContact CD2-CE1 3.24Å; F252-F271 HydrophobicContact CD2-CE1 3.24Å; F252-F271 AromaticContact CD2-CZ 3.89Å; F252-F271 HydrophobicContact CD2-CZ 3.89Å; F252-F271 HydrophobicContact CE2-CD1 4.04Å; F252-F271 AromaticContact CE2-CE1 3.75Å; F252-F271 HydrophobicContact CE2-CE1 3.75Å; F252-F271 AromaticContact CG-CE1 3.59Å; F252-F271 HydrophobicContact CG-CE1 3.59Å; F252-F271 HydrophobicContact CG-CZ 4.28Å; F252-F271 HydrophobicContact CZ-CE1 4.47Å; F252-L341 HydrophobicContact CD2-CD1 3.73Å; F252-L341 HydrophobicContact CE2-CD1 3.59Å; F252-I363 WeakPolarHBondContact CA-O 3.21Å; F252-I363 HydrophobicContact CD1-CB 3.92Å; F252-I363 HydrophobicContact CD1-CG2 3.84Å; F252-I363 HydrophobicContact CE1-CB 3.98Å; F252-I363 HydrophobicContact CE1-CD1 4.49Å; F252-I363 HydrophobicContact CE1-CG2 3.59Å; F252-I363 HydrophobicContact CG-CB 4.4Å; F252-I363 HydrophobicContact CZ-CB 4.5Å; F252-I363 HydrophobicContact CZ-CD1 4.26Å; F252-I363 HydrophobicContact CZ-CG2 4.35Å; F252-I365 HydrophobicContact CD1-CD1 3.8Å; F252-I365 HydrophobicContact CD1-CG1 4.04Å; F252-I365 HydrophobicContact CE1-CD1 4.47Å; F252-I410 HydrophobicContact CE1-CD1 3.9Å; F252-L422 HydrophobicContact CE1-CD2 4.15Å; F252-L422 HydrophobicContact CZ-CD2 3.76Å
253	V	97.3	Very high	96.8	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	151.1	173.2	-64.8	0	0	0	0	111.1	I347 V362 I363 Y364 I365 L398 F406	V253-I347 HydrophobicContact CG1-CG2 4.28Å; V253-V362 HydrophobicContact CG1-CG1 4.37Å; V253-V362 HydrophobicContact CG2-CG1 3.94Å; V253-I363 PolarHBondContact N-O 3.39Å; V253-Y364 HydrophobicContact CG2-CD2 4.48Å; V253-Y364 WeakPolarHBondContact O-CA 3.43Å; V253-I365 PolarHBondContact O-N 2.89Å; V253-L398 HydrophobicContact CG2-CD2 4.41Å; V253-F406 HydrophobicContact CG2-CD1 4.17Å; V253-F406 HydrophobicContact CG2-CE1 3.93Å
254	G	96.3	Very high	97	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.098	C	C	.	.			trans	73.9	179.7	-175.7	0	0	0	0	0	114.3	Q267 L398	G254-Q267 PolarHBondContact O-NE2 3.29Å; G254-L398 VanDerWaalsContact CA-CD1 3.5Å
255	P	96.9	Very high	97.1	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.006	12%	0.121	C	C	.	.	S	Bend	cis	-76.7	-19.9	7.1	30.4	-36.4	0	0	0	115.4	M266 I365 I367 A395	P255-M266 HydrophobicContact CG-CE 4.05Å; P255-M266 HydrophobicContact CG-SD 3.87Å; P255-I365 WeakPolarHBondContact CA-O 3.47Å; P255-I365 HydrophobicContact CB-CG2 4.31Å; P255-I365 WeakPolarHBondContact CB-O 3.43Å; P255-I365 HydrophobicContact CG-CG2 4.31Å; P255-I367 HydrophobicContact CB-CB 4.21Å; P255-I367 HydrophobicContact CB-CD1 3.63Å; P255-I367 HydrophobicContact CB-CG1 3.64Å; P255-I367 HydrophobicContact CG-CD1 3.74Å; P255-I367 HydrophobicContact CG-CG1 4.19Å; P255-A395 WeakPolarHBondContact O-CB 3.48Å
256	A	97.1	Very high	97.1	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.008	14%	0.135	C	C	.	.	S	Bend	trans	-131.1	-157.5	172.3	0	0	0	0	0	109.6	L373 Q391 A395	A256-L373 HydrophobicContact CB-CD1 4.14Å; A256-L373 HydrophobicContact CB-CD2 4.16Å; A256-Q391 HydrophobicContact CB-CB 4.07Å; A256-A395 HydrophobicContact CB-CB 4.41Å
257	L	96.7	Very high	97.1	Very high	46 Å²	46	24.3 Å²	24.3	24%	0.241	13%	0.133	C	C	.	.			trans	-70.2	136.8	175.5	-161	63.8	0	0	0	110.5	Y260 T263 N348 V390 A394	L257-Y260 HydrophobicContact CB-CD2 4.09Å; L257-Y260 HydrophobicContact CB-CE2 4.14Å; L257-Y260 HydrophobicContact CD2-CE2 3.76Å; L257-Y260 HydrophobicContact CG-CD2 4.39Å; L257-Y260 HydrophobicContact CG-CE2 4.07Å; L257-Y260 WeakPolarHBondContact O-CD2 3.44Å; L257-T263 VanDerWaalsContact O-CB 3.25Å; L257-T263 WeakPolarHBondContact O-CB 3.3Å; L257-T263 PolarHBondContact O-OG1 3.08Å; L257-N348 HydrophobicContact CD1-CB 4.06Å; L257-V390 HydrophobicContact CD2-CG1 3.81Å; L257-A394 HydrophobicContact CB-CB 3.79Å; L257-A394 HydrophobicContact CD1-CB 4.18Å; L257-A394 HydrophobicContact CG-CB 4.47Å
258	K	96.6	Very high	97.1	Very high	16 Å²	16	29.9 Å²	29.9	7%	0.07	16%	0.157	C	C	.	.	S	Bend	trans	-69.7	163.5	171.2	-66.2	-170.8	-177.8	-160.5	0	112.1	F252 Y260 T263 D264 C344 I347 N348	F252-K258 VanDerWaalsContact O-CE 3.3Å; F252-K258 WeakPolarHBondContact O-CE 3.4Å; F252-K258 PolarHBondContact O-NZ 3.17Å; F252-K258 VanDerWaalsContact O-NZ 3.17Å; K258-Y260 VanDerWaalsContact C-N 3.33Å; K258-Y260 WeakPolarHBondContact O-CD2 3.46Å; K258-T263 HydrophobicContact CG-CG2 3.94Å; K258-D264 WeakPolarHBondContact CA-OD1 3.5Å; K258-C344 WeakPolarHBondContact CD-O 3.4Å; K258-C344 PolarHBondContact NZ-O 3.03Å; K258-I347 WeakPolarHBondContact CD-O 3.49Å; K258-I347 WeakPolarHBondContact CE-O 3.22Å; K258-N348 WeakPolarHBondContact CB-OD1 3.42Å; K258-N348 WeakPolarHBondContact CG-OD1 3.37Å; K258-N348 PolarHBondContact N-OD1 3.42Å
259	G	95.2	Very high	97	Very high	60 Å²	60	29.9 Å²	29.9	62%	0.619	16%	0.164	S	C	*	.	S	Bend	trans	79.7	21.4	-172.1	0	0	0	0	0	112.3	D264	G259-D264 VanDerWaalsContact C-OD2 3.23Å; G259-D264 WeakPolarHBondContact CA-OD2 3.4Å; G259-D264 PolarHBondContact N-OD1 2.82Å; G259-D264 PolarHBondContact N-OD2 3.19Å; G259-D264 VanDerWaalsContact N-OD2 3.08Å
260	Y	97.3	Very high	97	Very high	47 Å²	47	30.2 Å²	30.2	18%	0.184	17%	0.166	C	C	.	.	S	Bend	trans	-139.5	134.7	178.7	-64.9	-84.6	0	0	0	109.4	L257 K258 V262 T263 D264 N387 Q391	L257-Y260 HydrophobicContact CB-CD2 4.09Å; L257-Y260 HydrophobicContact CB-CE2 4.14Å; L257-Y260 HydrophobicContact CD2-CE2 3.76Å; L257-Y260 HydrophobicContact CG-CD2 4.39Å; L257-Y260 HydrophobicContact CG-CE2 4.07Å; L257-Y260 WeakPolarHBondContact O-CD2 3.44Å; K258-Y260 VanDerWaalsContact C-N 3.33Å; K258-Y260 WeakPolarHBondContact O-CD2 3.46Å; Y260-V262 PolarHBondContact O-N 3.27Å; Y260-T263 PolarHBondContact O-N 3.21Å; Y260-D264 PolarHBondContact N-OD2 2.71Å; Y260-D264 VanDerWaalsContact O-CG 3.26Å; Y260-D264 PolarHBondContact O-N 3.46Å; Y260-N387 HydrophobicContact CD1-CB 4.31Å; Y260-N387 HydrophobicContact CE1-CB 3.54Å; Y260-Q391 HydrophobicContact CD1-CG 4.11Å; Y260-Q391 HydrophobicContact CD2-CG 4.02Å; Y260-Q391 HydrophobicContact CE1-CG 4.45Å; Y260-Q391 HydrophobicContact CE2-CG 4.41Å; Y260-Q391 HydrophobicContact CG-CG 3.85Å
261	E	97.2	Very high	96.8	Very high	58 Å²	58	30.9 Å²	30.9	27%	0.271	17%	0.169	S	C	.	.	H	α-helix	trans	-50.7	-36.8	-170.4	-66.8	161.3	-122.5	0	0	114.2	M265 R380 Q384	E261-M265 WeakPolarHBondContact O-CB 3.48Å; E261-M265 WeakPolarHBondContact O-CG 3.32Å; E261-M265 PolarHBondContact O-N 3.43Å; E261-R380 HydrophobicContact CB-CG 4.46Å; E261-R380 IonicContact OE2-CZ 2.78Å; E261-R380 IonicContact OE2-NE 3.24Å; E261-R380 PolarHBondContact OE2-NE 2.9Å; E261-R380 IonicContact OE2-NH2 2.64Å; E261-R380 PolarHBondContact OE2-NH2 2.88Å; E261-Q384 HydrophobicContact CB-CG 4.41Å; E261-Q384 HydrophobicContact CG-CG 4.42Å; E261-Q384 VanDerWaalsContact OE1-CG 3.23Å; E261-Q384 WeakPolarHBondContact OE1-CG 3.3Å; E261-Q384 PolarHBondContact OE1-NE2 3.27Å
262	V	96.8	Very high	96.8	Very high	11 Å²	11	34.8 Å²	34.8	7%	0.067	19%	0.189	C	C	.	.	H	α-helix	trans	-64.8	-49	-180	-176.4	0	0	0	0	111.3	Y260 M266 L373 L376 I377 R380	Y260-V262 PolarHBondContact O-N 3.27Å; V262-M266 HydrophobicContact CG1-SD 4.28Å; V262-M266 WeakPolarHBondContact O-CB 3.26Å; V262-M266 WeakPolarHBondContact O-CG 3.18Å; V262-M266 PolarHBondContact O-N 3.27Å; V262-L373 HydrophobicContact CG1-CD1 4.17Å; V262-L376 HydrophobicContact CG1-CB 4.07Å; V262-L376 HydrophobicContact CG1-CD1 4.45Å; V262-I377 HydrophobicContact CG2-CB 4.44Å; V262-I377 HydrophobicContact CG2-CG1 3.91Å; V262-R380 HydrophobicContact CG2-CG 3.76Å
263	T	97.2	Very high	96.7	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-67.7	-50.2	178.8	-53.8	0	0	0	0	110.3	L257 K258 Y260 M265 M266 Q267	L257-T263 VanDerWaalsContact O-CB 3.25Å; L257-T263 WeakPolarHBondContact O-CB 3.3Å; L257-T263 PolarHBondContact O-OG1 3.08Å; K258-T263 HydrophobicContact CG-CG2 3.94Å; Y260-T263 PolarHBondContact O-N 3.21Å; T263-M265 PolarHBondContact O-N 3.04Å; T263-M266 PolarHBondContact O-N 2.9Å; T263-Q267 WeakPolarHBondContact O-CG 3.22Å; T263-Q267 PolarHBondContact O-N 3.42Å
264	D	96.8	Very high	96.7	Very high	60 Å²	60	36.1 Å²	36.1	32%	0.321	20%	0.201	S	C	.	.	H	α-helix	trans	-71.3	-38.3	-167.8	-54.7	-16.5	0	0	0	111.3	K258 G259 Y260 K268	K258-D264 WeakPolarHBondContact CA-OD1 3.5Å; G259-D264 VanDerWaalsContact C-OD2 3.23Å; G259-D264 WeakPolarHBondContact CA-OD2 3.4Å; G259-D264 PolarHBondContact N-OD1 2.82Å; G259-D264 PolarHBondContact N-OD2 3.19Å; G259-D264 VanDerWaalsContact N-OD2 3.08Å; Y260-D264 PolarHBondContact N-OD2 2.71Å; Y260-D264 VanDerWaalsContact O-CG 3.26Å; Y260-D264 PolarHBondContact O-N 3.46Å; D264-K268 VanDerWaalsContact O-CB 3.3Å; D264-K268 WeakPolarHBondContact O-CB 3.29Å; D264-K268 PolarHBondContact O-N 3.48Å
265	M	97.1	Very high	96.7	Very high	100 Å²	100	42 Å²	42	49%	0.493	23%	0.226	S	C	.	.	H	α-helix	trans	-68.9	-36	174	-67	-179.2	66.7	0	0	112.5	E261 T263 A269 R380	E261-M265 WeakPolarHBondContact O-CB 3.48Å; E261-M265 WeakPolarHBondContact O-CG 3.32Å; E261-M265 PolarHBondContact O-N 3.43Å; T263-M265 PolarHBondContact O-N 3.04Å; M265-A269 WeakPolarHBondContact O-CB 3.38Å; M265-A269 PolarHBondContact O-N 2.91Å; M265-R380 VanDerWaalsContact SD-CZ 3.55Å; M265-R380 PolarHBondContact SD-NH1 2.84Å; M265-R380 VanDerWaalsContact SD-NH1 3.41Å
266	M	97	Very high	96.6	Very high	61 Å²	61	50.4 Å²	50.4	30%	0.3	26%	0.263	S	S	.	.	H	α-helix	trans	-68.9	-41.1	176.5	-74.7	-177.9	66.2	0	0	111.8	P255 V262 T263 I270 I365 I367	P255-M266 HydrophobicContact CG-CE 4.05Å; P255-M266 HydrophobicContact CG-SD 3.87Å; V262-M266 HydrophobicContact CG1-SD 4.28Å; V262-M266 WeakPolarHBondContact O-CB 3.26Å; V262-M266 WeakPolarHBondContact O-CG 3.18Å; V262-M266 PolarHBondContact O-N 3.27Å; T263-M266 PolarHBondContact O-N 2.9Å; M266-I270 PolarHBondContact O-N 3.36Å; M266-I365 HydrophobicContact CE-CG2 4.12Å; M266-I367 HydrophobicContact CE-CD1 4.08Å; M266-I367 HydrophobicContact CE-CG1 4.31Å; M266-I367 HydrophobicContact SD-CD1 4.08Å
267	Q	97.3	Very high	96.6	Very high	6 Å²	6	55.1 Å²	55.1	3%	0.028	28%	0.284	C	S	.	.	H	α-helix	trans	-63.4	-49.3	172.1	-69.2	-157.6	3.8	0	0	110.9	F252 G254 T263 A269 I270 F271 I365	F252-Q267 HydrophobicContact CB-CG 4.49Å; F252-Q267 PolarHBondContact O-NE2 3.28Å; G254-Q267 PolarHBondContact O-NE2 3.29Å; T263-Q267 WeakPolarHBondContact O-CG 3.22Å; T263-Q267 PolarHBondContact O-N 3.42Å; Q267-A269 VanDerWaalsContact C-N 3.33Å; Q267-A269 PolarHBondContact O-N 2.61Å; Q267-I270 PolarHBondContact O-N 3.05Å; Q267-F271 HydrophobicContact CB-CD1 4.45Å; Q267-F271 HydrophobicContact CB-CE1 3.88Å; Q267-F271 HydrophobicContact CB-CZ 4.11Å; Q267-F271 WeakPolarHBondContact O-CD1 3.35Å; Q267-F271 WeakPolarHBondContact O-CG 3.29Å; Q267-F271 PolarHBondContact O-N 2.92Å; Q267-I365 HydrophobicContact CG-CD1 3.71Å
268	K	96.7	Very high	96.6	Very high	117 Å²	117	53 Å²	53	51%	0.509	27%	0.273	S	S	.	.	H	α-helix	trans	-56.5	-43.7	179.9	-164.8	-163.2	-176.4	-54.5	0	112.7	D264 I270 F271 D272	D264-K268 VanDerWaalsContact O-CB 3.3Å; D264-K268 WeakPolarHBondContact O-CB 3.29Å; D264-K268 PolarHBondContact O-N 3.48Å; K268-I270 VanDerWaalsContact C-N 3.27Å; K268-I270 PolarHBondContact O-N 3.19Å; K268-F271 PolarHBondContact O-N 3.18Å; K268-F271 VanDerWaalsContact O-N 3.12Å; K268-D272 IonicContact NZ-OD1 3.09Å; K268-D272 PolarHBondContact NZ-OD1 3.46Å; K268-D272 IonicContact NZ-OD2 3.19Å; K268-D272 PolarHBondContact NZ-OD2 3.03Å; K268-D272 WeakPolarHBondContact O-CB 3.38Å; K268-D272 VanDerWaalsContact O-CG 3.24Å; K268-D272 PolarHBondContact O-N 2.97Å
269	A	97.4	Very high	96.5	Very high	35 Å²	35	58.5 Å²	58.5	29%	0.289	30%	0.303	S	S	.	.	H	α-helix	trans	-60	-36.5	178.7	0	0	0	0	0	112.8	M265 Q267 A273 L415	M265-A269 WeakPolarHBondContact O-CB 3.38Å; M265-A269 PolarHBondContact O-N 2.91Å; Q267-A269 VanDerWaalsContact C-N 3.33Å; Q267-A269 PolarHBondContact O-N 2.61Å; A269-A273 PolarHBondContact O-N 3.11Å; A269-L415 HydrophobicContact CB-CD1 4.17Å; A269-L415 HydrophobicContact CB-CD2 4.12Å
270	I	97	Very high	96.5	Very high	8 Å²	8	58 Å²	58	4%	0.041	30%	0.299	C	S	.	.	H	α-helix	trans	-74.7	-39.1	174.5	-64.6	167.2	0	0	0	110.6	F252 M266 Q267 K268 A273 M274 I365 I410 L415 L422	F252-I270 HydrophobicContact CE1-CG2 3.81Å; F252-I270 HydrophobicContact CZ-CG2 3.79Å; M266-I270 PolarHBondContact O-N 3.36Å; Q267-I270 PolarHBondContact O-N 3.05Å; K268-I270 VanDerWaalsContact C-N 3.27Å; K268-I270 PolarHBondContact O-N 3.19Å; I270-A273 PolarHBondContact O-N 3.32Å; I270-M274 HydrophobicContact CG2-CG 4.24Å; I270-M274 WeakPolarHBondContact O-CB 3.33Å; I270-M274 VanDerWaalsContact O-CG 3.32Å; I270-M274 WeakPolarHBondContact O-CG 3.39Å; I270-M274 PolarHBondContact O-N 2.91Å; I270-I365 HydrophobicContact CD1-CD1 3.72Å; I270-I365 HydrophobicContact CD1-CG1 3.9Å; I270-I410 HydrophobicContact CD1-CD1 4.3Å; I270-L415 HydrophobicContact CG1-CD1 3.79Å; I270-L422 HydrophobicContact CG2-CD2 3.71Å
271	F	95	Very high	96.4	Very high	19 Å²	19	58.9 Å²	58.9	8%	0.083	30%	0.302	C	S	.	.	H	α-helix	trans	-65.4	-44	179.6	-70.7	22.1	0	0	0	111.5	F252 Q267 K268 A273 M274 K275 L341 D343	F252-F271 HydrophobicContact CB-CE1 3.87Å; F252-F271 HydrophobicContact CB-CZ 4.16Å; F252-F271 HydrophobicContact CD1-CE1 4.37Å; F252-F271 HydrophobicContact CD2-CD1 4.01Å; F252-F271 AromaticContact CD2-CE1 3.24Å; F252-F271 HydrophobicContact CD2-CE1 3.24Å; F252-F271 AromaticContact CD2-CZ 3.89Å; F252-F271 HydrophobicContact CD2-CZ 3.89Å; F252-F271 HydrophobicContact CE2-CD1 4.04Å; F252-F271 AromaticContact CE2-CE1 3.75Å; F252-F271 HydrophobicContact CE2-CE1 3.75Å; F252-F271 AromaticContact CG-CE1 3.59Å; F252-F271 HydrophobicContact CG-CE1 3.59Å; F252-F271 HydrophobicContact CG-CZ 4.28Å; F252-F271 HydrophobicContact CZ-CE1 4.47Å; Q267-F271 HydrophobicContact CB-CD1 4.45Å; Q267-F271 HydrophobicContact CB-CE1 3.88Å; Q267-F271 HydrophobicContact CB-CZ 4.11Å; Q267-F271 WeakPolarHBondContact O-CD1 3.35Å; Q267-F271 WeakPolarHBondContact O-CG 3.29Å; Q267-F271 PolarHBondContact O-N 2.92Å; K268-F271 PolarHBondContact O-N 3.18Å; K268-F271 VanDerWaalsContact O-N 3.12Å; F271-A273 VanDerWaalsContact C-N 3.29Å; F271-A273 PolarHBondContact O-N 3.26Å; F271-M274 PolarHBondContact O-N 2.78Å; F271-K275 WeakPolarHBondContact O-CB 3.46Å; F271-K275 PolarHBondContact O-N 3.32Å; F271-L341 HydrophobicContact CB-CD2 4.28Å; F271-L341 HydrophobicContact CD1-CD2 4.29Å; F271-L341 HydrophobicContact CD2-CD2 4.3Å; F271-L341 HydrophobicContact CG-CD2 4.01Å; F271-D343 HydrophobicContact CD2-CB 4.47Å; F271-D343 HydrophobicContact CE2-CB 3.82Å
272	D	96.6	Very high	96.4	Very high	83 Å²	83	57.3 Å²	57.3	44%	0.444	30%	0.295	S	S	.	.	H	α-helix	trans	-59.5	-42.1	176.2	-67.7	-23.4	0	0	0	110.7	K268 K276	K268-D272 IonicContact NZ-OD1 3.09Å; K268-D272 PolarHBondContact NZ-OD1 3.46Å; K268-D272 IonicContact NZ-OD2 3.19Å; K268-D272 PolarHBondContact NZ-OD2 3.03Å; K268-D272 WeakPolarHBondContact O-CB 3.38Å; K268-D272 VanDerWaalsContact O-CG 3.24Å; K268-D272 PolarHBondContact O-N 2.97Å; D272-K276 WeakPolarHBondContact O-CB 3.39Å; D272-K276 PolarHBondContact O-N 3.06Å; D272-K276 VanDerWaalsContact O-N 3.11Å
273	A	96.2	Very high	96.5	Very high	28 Å²	28	58.1 Å²	58.1	23%	0.231	30%	0.298	C	S	.	.	H	α-helix	trans	-68	-44.1	177	0	0	0	0	0	112.7	A269 I270 F271 K276 H277 T419	A269-A273 PolarHBondContact O-N 3.11Å; I270-A273 PolarHBondContact O-N 3.32Å; F271-A273 VanDerWaalsContact C-N 3.29Å; F271-A273 PolarHBondContact O-N 3.26Å; A273-K276 PolarHBondContact O-N 2.94Å; A273-H277 WeakPolarHBondContact O-CB 3.41Å; A273-H277 PolarHBondContact O-N 2.89Å; A273-T419 HydrophobicContact CB-CG2 3.51Å
274	M	96.2	Very high	96.4	Very high	2 Å²	2	61 Å²	61	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-63.9	-42.2	176	-71.8	-60.5	101.4	0	0	112.1	I270 F271 K276 H277 F278 I282 T419 L422 S423 L426	I270-M274 HydrophobicContact CG2-CG 4.24Å; I270-M274 WeakPolarHBondContact O-CB 3.33Å; I270-M274 VanDerWaalsContact O-CG 3.32Å; I270-M274 WeakPolarHBondContact O-CG 3.39Å; I270-M274 PolarHBondContact O-N 2.91Å; F271-M274 PolarHBondContact O-N 2.78Å; M274-K276 VanDerWaalsContact C-N 3.29Å; M274-K276 PolarHBondContact O-N 3.35Å; M274-H277 PolarHBondContact O-N 2.57Å; M274-F278 PolarHBondContact O-N 2.88Å; M274-F278 HydrophobicContact SD-CD2 4.14Å; M274-F278 HydrophobicContact SD-CE2 3.81Å; M274-I282 HydrophobicContact CB-CD1 4.38Å; M274-T419 HydrophobicContact CE-CG2 4.16Å; M274-T419 WeakPolarHBondContact CE-O 3.2Å; M274-L422 HydrophobicContact CE-CB 4.46Å; M274-L422 HydrophobicContact CE-CD2 3.91Å; M274-L422 HydrophobicContact CE-CG 4.19Å; M274-L422 HydrophobicContact CG-CD2 3.66Å; M274-L422 HydrophobicContact SD-CD2 3.4Å; M274-L422 WeakPolarHBondContact SD-CD2 3.43Å; M274-L422 HydrophobicContact SD-CG 3.65Å; M274-S423 WeakPolarHBondContact CE-OG 3.47Å; M274-L426 HydrophobicContact SD-CD1 3.89Å
275	K	95.5	Very high	96.4	Very high	122 Å²	122	59.1 Å²	59.1	53%	0.53	31%	0.307	S	S	.	.	H	α-helix	trans	-58.9	-40.9	174.7	-174.7	178.7	176.7	-178.5	0	111.6	F271 D279 V284	F271-K275 WeakPolarHBondContact O-CB 3.46Å; F271-K275 PolarHBondContact O-N 3.32Å; K275-D279 PolarHBondContact O-N 2.74Å; K275-V284 HydrophobicContact CB-CG2 4.27Å; K275-V284 HydrophobicContact CD-CG2 4.34Å; K275-V284 HydrophobicContact CG-CG2 4.23Å
276	K	95.9	Very high	96.3	Very high	178 Å²	178	61.5 Å²	61.5	77%	0.774	31%	0.311	S	S	*	.	H	α-helix	trans	-71.4	-36.7	176.7	-175	179.2	178	-177.2	0	113.1	D272 A273 M274	D272-K276 WeakPolarHBondContact O-CB 3.39Å; D272-K276 PolarHBondContact O-N 3.06Å; D272-K276 VanDerWaalsContact O-N 3.11Å; A273-K276 PolarHBondContact O-N 2.94Å; M274-K276 VanDerWaalsContact C-N 3.29Å; M274-K276 PolarHBondContact O-N 3.35Å
277	H	96.3	Very high	96.2	Very high	101 Å²	101	58.6 Å²	58.6	47%	0.468	30%	0.297	S	S	.	.	H	α-helix	trans	-76.5	-36	-176.3	-167.5	100.9	0	0	0	112.8	A273 M274 S423	A273-H277 WeakPolarHBondContact O-CB 3.41Å; A273-H277 PolarHBondContact O-N 2.89Å; M274-H277 PolarHBondContact O-N 2.57Å; H277-S423 PolarHBondContact CD2-OG 3.39Å; H277-S423 PolarHBondContact CE1-OG 3.27Å; H277-S423 PolarHBondContact ND1-OG 2.93Å; H277-S423 WeakPolarHBondContact NE2-CB 3.24Å; H277-S423 PolarHBondContact NE2-OG 2.7Å; H277-S423 VanDerWaalsContact NE2-OG 3.1Å
278	F	96.9	Very high	95.9	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	30.1	-179.2	-66.6	-81.3	0	0	0	112.7	M274 R281 I282 L339 L426 E427	M274-F278 PolarHBondContact O-N 2.88Å; M274-F278 HydrophobicContact SD-CD2 4.14Å; M274-F278 HydrophobicContact SD-CE2 3.81Å; F278-R281 CarbonylContact O-C 3.57Å; F278-R281 WeakPolarHBondContact O-CA 3.47Å; F278-R281 WeakPolarHBondContact O-CB 3.31Å; F278-R281 PolarHBondContact O-N 3.41Å; F278-I282 HydrophobicContact CB-CB 3.77Å; F278-I282 HydrophobicContact CB-CD1 4.37Å; F278-I282 HydrophobicContact CB-CG2 3.88Å; F278-I282 WeakPolarHBondContact O-CG2 3.28Å; F278-I282 PolarHBondContact O-N 2.92Å; F278-L339 HydrophobicContact CB-CD1 4.15Å; F278-L339 HydrophobicContact CD1-CD1 3.42Å; F278-L339 VanDerWaalsContact CD1-CD1 3.42Å; F278-L339 HydrophobicContact CD2-CD1 4.22Å; F278-L339 HydrophobicContact CE1-CD1 3.78Å; F278-L339 HydrophobicContact CG-CD1 3.67Å; F278-L339 HydrophobicContact CZ-CD1 4.33Å; F278-L426 HydrophobicContact CE1-CB 4.36Å; F278-L426 HydrophobicContact CE2-CB 4.07Å; F278-L426 HydrophobicContact CE2-CD1 4.05Å; F278-L426 HydrophobicContact CZ-CB 3.66Å; F278-L426 HydrophobicContact CZ-CD1 4.49Å; F278-E427 HydrophobicContact CE1-CG 3.89Å; F278-E427 HydrophobicContact CZ-CG 4.1Å
279	D	94.8	Very high	95.7	Very high	132 Å²	132	57.8 Å²	57.8	71%	0.706	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	143	-179.3	-160.6	8.3	0	0	0	111.6	K275 R281	K275-D279 PolarHBondContact O-N 2.74Å; D279-R281 PolarHBondContact O-N 3.33Å
280	G	94.2	Very high	95.4	Very high	51 Å²	51	58.9 Å²	58.9	53%	0.526	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	-12.5	-168	0	0	0	0	0	116.4	Q338	G280-Q338 PolarHBondContact O-NE2 3.33Å
281	R	96.8	Very high	95.3	Very high	65 Å²	65	58.6 Å²	58.6	25%	0.245	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-6.8	179.3	-66.4	-170.7	-67.9	151.4	-2.2	114.5	F278 D279 Q338 L339 E427 W430	F278-R281 CarbonylContact O-C 3.57Å; F278-R281 WeakPolarHBondContact O-CA 3.47Å; F278-R281 WeakPolarHBondContact O-CB 3.31Å; F278-R281 PolarHBondContact O-N 3.41Å; D279-R281 PolarHBondContact O-N 3.33Å; R281-Q338 WeakPolarHBondContact O-CB 3.49Å; R281-L339 PolarHBondContact O-N 3.31Å; R281-E427 IonicContact CZ-OE1 3.72Å; R281-E427 VanDerWaalsContact CZ-OE1 3.32Å; R281-E427 IonicContact CZ-OE2 3.96Å; R281-E427 VanDerWaalsContact NH1-CD 3.3Å; R281-E427 IonicContact NH1-OE1 2.8Å; R281-E427 PolarHBondContact NH1-OE1 3.11Å; R281-E427 IonicContact NH1-OE2 3.96Å; R281-E427 PolarHBondContact NH1-OE2 2.78Å; R281-E427 IonicContact NH2-OE1 3.06Å; R281-E427 PolarHBondContact NH2-OE1 2.86Å; R281-E427 IonicContact NH2-OE2 3.92Å; R281-W430 HydrophobicContact CB-CH2 3.97Å; R281-W430 HydrophobicContact CB-CZ3 4.04Å; R281-W430 HydrophobicContact CG-CH2 3.88Å; R281-W430 HydrophobicContact CG-CZ2 4.06Å; R281-W430 HydrophobicContact CG-CZ3 4.42Å
282	I	97.4	Very high	95.1	Very high	25 Å²	25	58.8 Å²	58.8	13%	0.128	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	128.9	-177	-164.6	171.2	0	0	0	113.2	M274 F278 V284 L339 L341	M274-I282 HydrophobicContact CB-CD1 4.38Å; F278-I282 HydrophobicContact CB-CB 3.77Å; F278-I282 HydrophobicContact CB-CD1 4.37Å; F278-I282 HydrophobicContact CB-CG2 3.88Å; F278-I282 WeakPolarHBondContact O-CG2 3.28Å; F278-I282 PolarHBondContact O-N 2.92Å; I282-V284 HydrophobicContact CD1-CG2 4.48Å; I282-V284 HydrophobicContact CG1-CG2 4.38Å; I282-L339 CarbonylContact C-O 3.57Å; I282-L339 WeakPolarHBondContact CA-O 3.3Å; I282-L339 HydrophobicContact CB-CB 4.25Å; I282-L339 HydrophobicContact CG1-CB 3.99Å; I282-L341 HydrophobicContact CD1-CB 4.11Å; I282-L341 HydrophobicContact CD1-CD2 4.34Å; I282-L341 HydrophobicContact CG1-CB 4.38Å
283	I	97.2	Very high	94.8	Very high	27 Å²	27	56.6 Å²	56.6	14%	0.138	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	119.2	166.7	-57	175.5	0	0	0	107.2	L333 K336 Q338 L339 L340 L341	I283-L333 HydrophobicContact CD1-CB 4.39Å; I283-L333 HydrophobicContact CD1-CD2 4.32Å; I283-L333 HydrophobicContact CG2-CD1 4.17Å; I283-L333 HydrophobicContact CG2-CD2 4.24Å; I283-K336 HydrophobicContact CD1-CB 4.03Å; I283-K336 HydrophobicContact CD1-CD 3.91Å; I283-K336 HydrophobicContact CD1-CG 4.44Å; I283-Q338 HydrophobicContact CD1-CB 4.06Å; I283-Q338 HydrophobicContact CG1-CB 3.95Å; I283-L339 PolarHBondContact N-O 2.77Å; I283-L340 HydrophobicContact CB-CD1 4.04Å; I283-L340 HydrophobicContact CG2-CD1 3.89Å; I283-L341 PolarHBondContact O-N 2.89Å
284	V	96.2	Very high	94.3	Very high	60 Å²	60	55.7 Å²	55.7	36%	0.364	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	127.4	170	-173.3	0	0	0	0	108.4	K275 I282 L341	K275-V284 HydrophobicContact CB-CG2 4.27Å; K275-V284 HydrophobicContact CD-CG2 4.34Å; K275-V284 HydrophobicContact CG-CG2 4.23Å; I282-V284 HydrophobicContact CD1-CG2 4.48Å; I282-V284 HydrophobicContact CG1-CG2 4.38Å; V284-L341 WeakPolarHBondContact CA-O 3.49Å; V284-L341 HydrophobicContact CG1-CD2 4.37Å; V284-L341 HydrophobicContact CG1-CG 4.38Å; V284-L341 HydrophobicContact CG2-CB 4.39Å; V284-L341 HydrophobicContact CG2-CD2 4.24Å
285	S	96.5	Very high	93.6	Very high	21 Å²	21	60.2 Å²	60.2	15%	0.147	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	131.2	-176.8	-150.9	0	0	0	0	112.2	R329 L341 L342 D343	S285-R329 PolarHBondContact OG-NH1 2.95Å; S285-L341 PolarHBondContact N-O 3.44Å; S285-L342 WeakPolarHBondContact O-CA 3.44Å; S285-D343 PolarHBondContact O-N 3.18Å
286	R	95.8	Very high	93	Very high	151 Å²	151	58.5 Å²	58.5	57%	0.57	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	148.1	177.4	-168.2	168.5	170.3	-154	-3	111.4	R329 D343 D345	R286-R329 PolarHBondContact O-NH2 3.43Å; R286-D343 CarbonylContact C-O 3.55Å; R286-D343 WeakPolarHBondContact CA-O 3.38Å; R286-D343 HydrophobicContact CB-CB 4.31Å; R286-D343 HydrophobicContact CG-CB 4.27Å; R286-D343 WeakPolarHBondContact CG-O 3.32Å; R286-D345 IonicContact CZ-OD1 3.89Å; R286-D345 IonicContact CZ-OD2 2.7Å; R286-D345 IonicContact NE-OD1 3.32Å; R286-D345 PolarHBondContact NE-OD1 3.03Å; R286-D345 IonicContact NE-OD2 3.79Å; R286-D345 IonicContact NH2-OD1 2.78Å; R286-D345 PolarHBondContact NH2-OD1 3.25Å; R286-D345 IonicContact NH2-OD2 2.88Å; R286-D345 PolarHBondContact NH2-OD2 3.42Å
287	V	95	Very high	92.3	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	95.8	-177.9	-178.4	0	0	0	0	107.7	I291 I330 L342 D343 D345	V287-I291 HydrophobicContact CG1-CD1 4.34Å; V287-I291 HydrophobicContact CG1-CG1 4.38Å; V287-I291 HydrophobicContact CG1-CG2 3.52Å; V287-I330 HydrophobicContact CG2-CD1 4.18Å; V287-L342 HydrophobicContact CG2-CB 4.3Å; V287-L342 HydrophobicContact CG2-CD1 4.4Å; V287-L342 HydrophobicContact CG2-CD2 4.11Å; V287-D343 PolarHBondContact N-O 2.93Å; V287-D345 PolarHBondContact O-N 3.4Å
288	S	90.6	Very high	91.3	Very high	82 Å²	82	46.7 Å²	46.7	57%	0.573	26%	0.255	S	S	*	.			trans	-81.4	-24.2	177.8	52.1	0	0	0	0	112.6
289	T	92.6	Very high	90.1	Very high	23 Å²	23	50.3 Å²	50.3	14%	0.141	27%	0.272	C	S	.	.	S	Bend	trans	-68.3	154.8	178.1	69.1	0	0	0	0	111.7	I291 E322 D326	T289-I291 VanDerWaalsContact C-N 3.33Å; T289-I291 PolarHBondContact O-N 3.33Å; T289-E322 HydrophobicContact CG2-CB 3.98Å; T289-D326 WeakPolarHBondContact CB-OD2 3.31Å; T289-D326 WeakPolarHBondContact CG2-OD2 3.35Å; T289-D326 PolarHBondContact OG1-OD2 2.91Å
290	N	91.7	Very high	89	Confident	59 Å²	59	44.5 Å²	44.5	32%	0.316	24%	0.241	S	C	.	.			trans	-83.6	75.8	178.5	-171.7	-5	0	0	0	111.1	S292 L293 T346	N290-S292 PolarHBondContact O-N 3Å; N290-S292 WeakPolarHBondContact OD1-CB 3.48Å; N290-S292 PolarHBondContact OD1-N 3.47Å; N290-S292 PolarHBondContact OD1-OG 3.27Å; N290-L293 HydrophobicContact CB-CD1 4.37Å; N290-L293 HydrophobicContact CB-CG 4.26Å; N290-L293 VanDerWaalsContact O-CB 3.3Å; N290-L293 WeakPolarHBondContact O-CB 3.2Å; N290-L293 WeakPolarHBondContact O-CG 3.34Å; N290-L293 PolarHBondContact O-N 3.28Å; N290-T346 HydrophobicContact CB-CG2 4.48Å
291	I	93.1	Very high	87.7	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-58.8	-11	-179.7	57.7	166.2	0	0	0	114.9	V287 T289 L293 A294 D326 I347 I353 L358	V287-I291 HydrophobicContact CG1-CD1 4.34Å; V287-I291 HydrophobicContact CG1-CG1 4.38Å; V287-I291 HydrophobicContact CG1-CG2 3.52Å; T289-I291 VanDerWaalsContact C-N 3.33Å; T289-I291 PolarHBondContact O-N 3.33Å; I291-L293 PolarHBondContact O-N 3.25Å; I291-A294 VanDerWaalsContact O-CB 3.22Å; I291-A294 WeakPolarHBondContact O-CB 3.35Å; I291-A294 PolarHBondContact O-N 3.29Å; I291-D326 HydrophobicContact CG2-CB 4.45Å; I291-I347 HydrophobicContact CD1-CG1 4.39Å; I291-I347 HydrophobicContact CG1-CD1 4.08Å; I291-I347 HydrophobicContact CG1-CG1 4.09Å; I291-I353 HydrophobicContact CD1-CG2 4.45Å; I291-L358 HydrophobicContact CD1-CD1 4.09Å
292	S	91.6	Very high	86.1	Confident	23 Å²	23	47.1 Å²	47.1	16%	0.161	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-62.2	-20.3	168.5	79.4	0	0	0	0	113	N290 A294 Q352	N290-S292 PolarHBondContact O-N 3Å; N290-S292 WeakPolarHBondContact OD1-CB 3.48Å; N290-S292 PolarHBondContact OD1-N 3.47Å; N290-S292 PolarHBondContact OD1-OG 3.27Å; S292-A294 VanDerWaalsContact C-N 3.28Å; S292-A294 PolarHBondContact O-N 3.33Å; S292-Q352 WeakPolarHBondContact CB-O 3.48Å
293	L	89.9	Confident	84.4	Confident	36 Å²	36	49.5 Å²	49.5	19%	0.188	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-77	-4.3	173.7	-56.7	-171.5	0	0	0	114	N290 I291 K295 R296 L320	N290-L293 HydrophobicContact CB-CD1 4.37Å; N290-L293 HydrophobicContact CB-CG 4.26Å; N290-L293 VanDerWaalsContact O-CB 3.3Å; N290-L293 WeakPolarHBondContact O-CB 3.2Å; N290-L293 WeakPolarHBondContact O-CG 3.34Å; N290-L293 PolarHBondContact O-N 3.28Å; I291-L293 PolarHBondContact O-N 3.25Å; L293-K295 PolarHBondContact O-N 3.12Å; L293-R296 WeakPolarHBondContact O-CA 3.32Å; L293-R296 WeakPolarHBondContact O-CB 3.49Å; L293-R296 PolarHBondContact O-N 2.8Å; L293-L320 HydrophobicContact CB-CD2 4.15Å
294	A	86.2	Confident	82.4	Confident	10 Å²	10	53.5 Å²	53.5	8%	0.083	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-50.5	-32.2	178.6	0	0	0	0	0	113.6	I291 S292 R296 V297 L327 T356	I291-A294 VanDerWaalsContact O-CB 3.22Å; I291-A294 WeakPolarHBondContact O-CB 3.35Å; I291-A294 PolarHBondContact O-N 3.29Å; S292-A294 VanDerWaalsContact C-N 3.28Å; S292-A294 PolarHBondContact O-N 3.33Å; A294-R296 PolarHBondContact O-N 3.23Å; A294-V297 WeakPolarHBondContact O-CB 3.48Å; A294-V297 PolarHBondContact O-N 3.49Å; A294-V297 VanDerWaalsContact O-N 3.11Å; A294-L327 HydrophobicContact CB-CD1 3.63Å; A294-L327 HydrophobicContact CB-CD2 4.08Å; A294-L327 HydrophobicContact CB-CG 4.42Å; A294-T356 HydrophobicContact CB-CG2 3.91Å
295	K	82.5	Confident	80.4	Confident	96 Å²	96	56.8 Å²	56.8	42%	0.417	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-60.9	-25.4	175.6	-63.3	159.5	-144.8	171	0	113.8	L293 N351 Q352 K355 T356	L293-K295 PolarHBondContact O-N 3.12Å; K295-N351 PolarHBondContact NZ-O 3Å; K295-Q352 WeakPolarHBondContact CE-O 3.2Å; K295-Q352 PolarHBondContact NZ-O 2.88Å; K295-K355 HydrophobicContact CD-CB 4.08Å; K295-K355 VanDerWaalsContact CE-O 3.28Å; K295-K355 WeakPolarHBondContact CE-O 3.4Å; K295-K355 WeakPolarHBondContact CG-O 3.37Å; K295-T356 HydrophobicContact CG-CG2 4.5Å
296	R	81.3	Confident	78.3	Confident	86 Å²	86	65.1 Å²	65.1	33%	0.325	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-97.8	-2.2	179.3	-64.6	-163.2	-56.9	137.9	-5.1	113	L293 A294 G298 E299 L320	L293-R296 WeakPolarHBondContact O-CA 3.32Å; L293-R296 WeakPolarHBondContact O-CB 3.49Å; L293-R296 PolarHBondContact O-N 2.8Å; A294-R296 PolarHBondContact O-N 3.23Å; R296-G298 PolarHBondContact O-N 3.26Å; R296-E299 HydrophobicContact CB-CG 4.47Å; R296-E299 VanDerWaalsContact CB-OE1 3.32Å; R296-E299 WeakPolarHBondContact CB-OE1 3.28Å; R296-E299 VanDerWaalsContact CD-OE1 3.26Å; R296-E299 WeakPolarHBondContact CD-OE1 3.46Å; R296-E299 WeakPolarHBondContact CG-OE1 3.27Å; R296-E299 IonicContact NH1-OE1 2.82Å; R296-E299 WeakPolarHBondContact O-CB 3.48Å; R296-E299 VanDerWaalsContact O-CG 3.26Å; R296-E299 WeakPolarHBondContact O-CG 3.38Å; R296-E299 PolarHBondContact O-N 2.73Å; R296-L320 HydrophobicContact CB-CD2 3.94Å
297	V	81.7	Confident	76.2	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.006	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-62.4	-28.1	176.4	169.2	0	0	0	0	111.5	A294 E299 L300 L320 V323 Q324 L327 G471	A294-V297 WeakPolarHBondContact O-CB 3.48Å; A294-V297 PolarHBondContact O-N 3.49Å; A294-V297 VanDerWaalsContact O-N 3.11Å; V297-E299 PolarHBondContact O-N 2.87Å; V297-L300 VanDerWaalsContact O-CB 3.29Å; V297-L300 WeakPolarHBondContact O-CB 3.01Å; V297-L300 PolarHBondContact O-N 2.83Å; V297-L320 HydrophobicContact CG2-CD2 4.37Å; V297-V323 HydrophobicContact CG2-CG1 3.92Å; V297-Q324 HydrophobicContact CG1-CB 4.02Å; V297-Q324 HydrophobicContact CG1-CG 4.29Å; V297-Q324 VanDerWaalsContact CG1-OE1 3.28Å; V297-L327 HydrophobicContact CG2-CD1 4.1Å; V297-G471 WeakPolarHBondContact O-CA 3.37Å
298	G	75.7	Confident	74.3	Confident	31 Å²	31	65 Å²	65	32%	0.32	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-57.2	-17.9	169.8	0	0	0	0	0	114.9	R296 L300 L301	R296-G298 PolarHBondContact O-N 3.26Å; G298-L300 PolarHBondContact O-N 3.17Å; G298-L301 WeakPolarHBondContact O-CB 3.44Å; G298-L301 WeakPolarHBondContact O-CG 3.4Å; G298-L301 PolarHBondContact O-N 2.8Å
299	E	70.6	Confident	72.7	Confident	75 Å²	75	68.8 Å²	68.8	35%	0.35	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-63	-18.2	170.6	-62.7	172.8	-155.7	0	0	112.3	R296 V297 L301 L320	R296-E299 HydrophobicContact CB-CG 4.47Å; R296-E299 VanDerWaalsContact CB-OE1 3.32Å; R296-E299 WeakPolarHBondContact CB-OE1 3.28Å; R296-E299 VanDerWaalsContact CD-OE1 3.26Å; R296-E299 WeakPolarHBondContact CD-OE1 3.46Å; R296-E299 WeakPolarHBondContact CG-OE1 3.27Å; R296-E299 IonicContact NH1-OE1 2.82Å; R296-E299 WeakPolarHBondContact O-CB 3.48Å; R296-E299 VanDerWaalsContact O-CG 3.26Å; R296-E299 WeakPolarHBondContact O-CG 3.38Å; R296-E299 PolarHBondContact O-N 2.73Å; V297-E299 PolarHBondContact O-N 2.87Å; E299-L301 VanDerWaalsContact C-N 3.29Å; E299-L301 PolarHBondContact O-N 3.33Å; E299-L320 HydrophobicContact CB-CD1 4.34Å
300	L	72.8	Confident	71.1	Confident	10 Å²	10	73.8 Å²	73.8	5%	0.052	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-77.4	-7.5	173.4	-80.8	53.9	0	0	0	113.6	V297 G298 H302 L303 L317 L320 I321 P470	V297-L300 VanDerWaalsContact O-CB 3.29Å; V297-L300 WeakPolarHBondContact O-CB 3.01Å; V297-L300 PolarHBondContact O-N 2.83Å; G298-L300 PolarHBondContact O-N 3.17Å; L300-H302 VanDerWaalsContact C-N 3.33Å; L300-L303 HydrophobicContact CB-CD1 4.41Å; L300-L303 HydrophobicContact CG-CD1 4.31Å; L300-L303 WeakPolarHBondContact O-CG 3.24Å; L300-L317 HydrophobicContact CD1-CD1 4.02Å; L300-L317 HydrophobicContact CG-CD1 4.3Å; L300-L320 HydrophobicContact CD1-CB 3.53Å; L300-L320 HydrophobicContact CD1-CD1 3.85Å; L300-L320 HydrophobicContact CD1-CG 4.33Å; L300-I321 HydrophobicContact CD2-CG1 3.94Å; L300-P470 HydrophobicContact CB-CB 4.09Å
301	L	67	Low	69.5	Low	67 Å²	67	80.5 Å²	80.5	35%	0.351	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-70.3	-33.3	170.9	-63.6	170.7	0	0	0	111.4	G298 E299 P470	G298-L301 WeakPolarHBondContact O-CB 3.44Å; G298-L301 WeakPolarHBondContact O-CG 3.4Å; G298-L301 PolarHBondContact O-N 2.8Å; E299-L301 VanDerWaalsContact C-N 3.29Å; E299-L301 PolarHBondContact O-N 3.33Å; L301-P470 VanDerWaalsContact CD2-O 3.29Å; L301-P470 WeakPolarHBondContact CD2-O 3.4Å
302	H	62.6	Low	68.1	Low	105 Å²	105	82.4 Å²	82.4	49%	0.486	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-107.5	47.7	-172.4	-60.2	-60.2	0	0	0	112.4	L300 D304 N307	L300-H302 VanDerWaalsContact C-N 3.33Å; H302-D304 PolarHBondContact O-N 3.07Å; H302-N307 PolarHBondContact O-ND2 3.42Å
303	L	62	Low	67.2	Low	75 Å²	75	84.9 Å²	84.9	39%	0.393	42%	0.418	S	S	.	.			trans	-80.5	44	173.3	-57.6	-173.1	0	0	0	113	L300 K305 L317	L300-L303 HydrophobicContact CB-CD1 4.41Å; L300-L303 HydrophobicContact CG-CD1 4.31Å; L300-L303 WeakPolarHBondContact O-CG 3.24Å; L303-K305 PolarHBondContact O-N 3.32Å; L303-L317 HydrophobicContact CD1-CD1 3.9Å; L303-L317 HydrophobicContact CD2-CD1 3.43Å; L303-L317 VanDerWaalsContact CD2-CD1 3.43Å; L303-L317 HydrophobicContact CG-CD1 4.32Å
304	D	55.8	Low	66.4	Low	111 Å²	111	85.8 Å²	85.8	59%	0.594	43%	0.428	S	S	*	.			trans	-54.6	135.5	165	-80.1	-56.1	0	0	0	110.3	H302 K306 N307	H302-D304 PolarHBondContact O-N 3.07Å; D304-K306 PolarHBondContact O-N 3.4Å; D304-N307 WeakPolarHBondContact O-CB 3.15Å; D304-N307 PolarHBondContact O-N 3.03Å
305	K	53.7	Low	66.2	Low	129 Å²	129	94.7 Å²	94.7	56%	0.561	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-49.1	-24.4	-173.4	-69.2	170.8	179.4	166.8	0	115.1	L303 N307 A642	L303-K305 PolarHBondContact O-N 3.32Å; K305-N307 VanDerWaalsContact C-N 3.34Å; K305-A642 WeakPolarHBondContact CE-O 3.19Å; K305-A642 PolarHBondContact NZ-O 3.06Å
306	K	52.7	Low	66.2	Low	195 Å²	195	94.6 Å²	94.6	85%	0.848	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-67.7	-29	177.9	-63.1	178.3	-178.4	173.8	0	113	D304 I308	D304-K306 PolarHBondContact O-N 3.4Å; K306-I308 VanDerWaalsContact C-N 3.28Å; K306-I308 PolarHBondContact O-N 3.41Å
307	N	52.3	Low	66.3	Low	49 Å²	49	92.7 Å²	92.7	26%	0.262	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-74.6	-8.9	-176	-79.5	-32.2	0	0	0	114.7	H302 D304 K305 R313	H302-N307 PolarHBondContact O-ND2 3.42Å; D304-N307 WeakPolarHBondContact O-CB 3.15Å; D304-N307 PolarHBondContact O-N 3.03Å; K305-N307 VanDerWaalsContact C-N 3.34Å; N307-R313 VanDerWaalsContact CG-NH1 3.3Å; N307-R313 PolarHBondContact OD1-NH1 3.43Å
308	I	55	Low	66.5	Low	101 Å²	101	96.3 Å²	96.3	52%	0.518	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-84.5	-20.6	-172.9	-64.9	171.4	0	0	0	112.9	K306 E310	K306-I308 VanDerWaalsContact C-N 3.28Å; K306-I308 PolarHBondContact O-N 3.41Å; I308-E310 PolarHBondContact O-N 2.91Å
309	L	56.2	Low	67.1	Low	160 Å²	160	96.4 Å²	96.4	84%	0.838	47%	0.474	S	S	*	.			trans	-77.7	-15.4	-165.9	-165.9	59.7	0	0	0	114.9	K311	L309-K311 PolarHBondContact O-N 3.37Å
310	E	58.6	Low	68	Low	128 Å²	128	93 Å²	93	60%	0.598	46%	0.458	S	S	*	.			trans	-79.3	113.6	178.2	-67.2	-168.5	135.4	0	0	112.1	I308 G312 R313	I308-E310 PolarHBondContact O-N 2.91Å; E310-G312 PolarHBondContact O-N 2.94Å; E310-R313 HydrophobicContact CB-CB 4.14Å; E310-R313 PolarHBondContact O-N 3.46Å
311	K	58.4	Low	68.7	Low	200 Å²	200	95.6 Å²	95.6	87%	0.87	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-17.7	-177.4	-76.1	-178.2	172.7	179.9	0	116.1	L309	L309-K311 PolarHBondContact O-N 3.37Å
312	G	63.4	Low	69.9	Low	42 Å²	42	96.7 Å²	96.7	43%	0.433	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-36.9	173.1	0	0	0	0	0	113.7	E310	E310-G312 PolarHBondContact O-N 2.94Å
313	R	73.5	Confident	71.3	Confident	75 Å²	75	91.9 Å²	91.9	28%	0.283	45%	0.452	S	S	.	.	H	α-helix	trans	-76.5	-28.4	-164.5	-164.7	166.1	178.6	-171.7	-8.6	113.3	N307 E310 R315 Q316 L317	N307-R313 VanDerWaalsContact CG-NH1 3.3Å; N307-R313 PolarHBondContact OD1-NH1 3.43Å; E310-R313 HydrophobicContact CB-CB 4.14Å; E310-R313 PolarHBondContact O-N 3.46Å; R313-R315 VanDerWaalsContact C-N 3.27Å; R313-R315 PolarHBondContact O-N 3.27Å; R313-Q316 WeakPolarHBondContact O-CB 3.34Å; R313-Q316 PolarHBondContact O-N 2.92Å; R313-Q316 VanDerWaalsContact O-N 3.1Å; R313-L317 PolarHBondContact O-N 2.83Å
314	S	73.4	Confident	72.6	Confident	56 Å²	56	88.5 Å²	88.5	39%	0.392	43%	0.434	S	S	.	.	H	α-helix	trans	-57.2	-37.8	177.4	-33.5	0	0	0	0	112.8	L317 V318	S314-L317 PolarHBondContact O-N 3.11Å; S314-V318 WeakPolarHBondContact O-CG2 3.33Å; S314-V318 PolarHBondContact O-N 3.46Å; S314-V318 VanDerWaalsContact O-N 3.15Å
315	R	81.8	Confident	74.3	Confident	197 Å²	197	87 Å²	87	74%	0.743	42%	0.424	S	S	*	.	H	α-helix	trans	-71	-37.3	176.8	-69.8	-172.6	-68.2	177.6	-1.1	112.6	R313 S319	R313-R315 VanDerWaalsContact C-N 3.27Å; R313-R315 PolarHBondContact O-N 3.27Å; R315-S319 PolarHBondContact O-N 2.82Å
316	Q	82.1	Confident	76.2	Confident	94 Å²	94	81.7 Å²	81.7	44%	0.439	40%	0.402	S	S	.	.	H	α-helix	trans	-65.5	-42.5	174.8	-64.7	177.7	-18.2	0	0	110.5	R313 V318 S319 L320	R313-Q316 WeakPolarHBondContact O-CB 3.34Å; R313-Q316 PolarHBondContact O-N 2.92Å; R313-Q316 VanDerWaalsContact O-N 3.1Å; Q316-V318 PolarHBondContact O-N 3.39Å; Q316-S319 PolarHBondContact O-N 2.96Å; Q316-S319 PolarHBondContact O-OG 2.96Å; Q316-L320 WeakPolarHBondContact O-CG 3.29Å; Q316-L320 PolarHBondContact O-N 2.88Å
317	L	82.9	Confident	78.1	Confident	45 Å²	45	72.4 Å²	72.4	24%	0.236	36%	0.362	C	S	.	.	H	α-helix	trans	-57.2	-48.7	176.1	-172.7	71.7	0	0	0	112.1	L300 L303 R313 S314 S319 L320 I321	L300-L317 HydrophobicContact CD1-CD1 4.02Å; L300-L317 HydrophobicContact CG-CD1 4.3Å; L303-L317 HydrophobicContact CD1-CD1 3.9Å; L303-L317 HydrophobicContact CD2-CD1 3.43Å; L303-L317 VanDerWaalsContact CD2-CD1 3.43Å; L303-L317 HydrophobicContact CG-CD1 4.32Å; R313-L317 PolarHBondContact O-N 2.83Å; S314-L317 PolarHBondContact O-N 3.11Å; L317-S319 PolarHBondContact O-N 2.76Å; L317-L320 PolarHBondContact O-N 3.12Å; L317-L320 VanDerWaalsContact O-N 3.14Å; L317-I321 HydrophobicContact CG-CD1 4.06Å; L317-I321 WeakPolarHBondContact O-CG1 3.35Å; L317-I321 PolarHBondContact O-N 2.64Å
318	V	86.5	Confident	80	Confident	77 Å²	77	70.3 Å²	70.3	47%	0.467	35%	0.35	S	S	.	.	H	α-helix	trans	-56.1	-49.2	175.8	171.5	0	0	0	0	110.8	S314 Q316 L320 I321 E322	S314-V318 WeakPolarHBondContact O-CG2 3.33Å; S314-V318 PolarHBondContact O-N 3.46Å; S314-V318 VanDerWaalsContact O-N 3.15Å; Q316-V318 PolarHBondContact O-N 3.39Å; V318-L320 PolarHBondContact O-N 3.29Å; V318-I321 WeakPolarHBondContact O-CB 3.4Å; V318-I321 PolarHBondContact O-N 2.73Å; V318-E322 HydrophobicContact CG1-CG 4.42Å; V318-E322 WeakPolarHBondContact CG1-OE1 3.38Å; V318-E322 WeakPolarHBondContact O-CG 3.41Å; V318-E322 PolarHBondContact O-N 2.72Å
319	S	88.2	Confident	81.9	Confident	34 Å²	34	68.5 Å²	68.5	24%	0.238	34%	0.337	C	S	.	.	H	α-helix	trans	-63	-26.6	178.9	70	0	0	0	0	114.5	R315 Q316 L317 V323	R315-S319 PolarHBondContact O-N 2.82Å; Q316-S319 PolarHBondContact O-N 2.96Å; Q316-S319 PolarHBondContact O-OG 2.96Å; L317-S319 PolarHBondContact O-N 2.76Å; S319-V323 WeakPolarHBondContact O-CB 3.37Å; S319-V323 VanDerWaalsContact O-CG2 3.26Å; S319-V323 WeakPolarHBondContact O-CG2 3.34Å; S319-V323 PolarHBondContact O-N 2.87Å; S319-V323 VanDerWaalsContact O-N 3.15Å
320	L	88.9	Confident	83.8	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.016	30%	0.297	C	S	.	.	H	α-helix	trans	-81	-29.8	174.5	-70.2	174.8	0	0	0	112.4	L293 R296 V297 E299 L300 Q316 L317 V318 Q324	L293-L320 HydrophobicContact CB-CD2 4.15Å; R296-L320 HydrophobicContact CB-CD2 3.94Å; V297-L320 HydrophobicContact CG2-CD2 4.37Å; E299-L320 HydrophobicContact CB-CD1 4.34Å; L300-L320 HydrophobicContact CD1-CB 3.53Å; L300-L320 HydrophobicContact CD1-CD1 3.85Å; L300-L320 HydrophobicContact CD1-CG 4.33Å; Q316-L320 WeakPolarHBondContact O-CG 3.29Å; Q316-L320 PolarHBondContact O-N 2.88Å; L317-L320 PolarHBondContact O-N 3.12Å; L317-L320 VanDerWaalsContact O-N 3.14Å; V318-L320 PolarHBondContact O-N 3.29Å; L320-Q324 WeakPolarHBondContact O-CB 3.3Å; L320-Q324 PolarHBondContact O-N 2.68Å
321	I	88.4	Confident	85.6	Confident	64 Å²	64	55 Å²	55	33%	0.328	27%	0.269	S	S	.	.	H	α-helix	trans	-68.3	-45.3	171.1	-66.9	164.6	0	0	0	110.1	L300 L317 V318 V323 Q324 Q325	L300-I321 HydrophobicContact CD2-CG1 3.94Å; L317-I321 HydrophobicContact CG-CD1 4.06Å; L317-I321 WeakPolarHBondContact O-CG1 3.35Å; L317-I321 PolarHBondContact O-N 2.64Å; V318-I321 WeakPolarHBondContact O-CB 3.4Å; V318-I321 PolarHBondContact O-N 2.73Å; I321-V323 VanDerWaalsContact C-N 3.35Å; I321-V323 PolarHBondContact O-N 2.92Å; I321-Q324 PolarHBondContact O-N 3.37Å; I321-Q325 WeakPolarHBondContact O-CG 3.12Å; I321-Q325 PolarHBondContact O-N 2.85Å
322	E	91.2	Very high	87.3	Confident	91 Å²	91	49.1 Å²	49.1	43%	0.425	25%	0.245	S	C	.	.	H	α-helix	trans	-58.2	-44.9	174	-68.5	167.3	171	0	0	111.5	T289 V318 Q325 D326	T289-E322 HydrophobicContact CG2-CB 3.98Å; V318-E322 HydrophobicContact CG1-CG 4.42Å; V318-E322 WeakPolarHBondContact CG1-OE1 3.38Å; V318-E322 WeakPolarHBondContact O-CG 3.41Å; V318-E322 PolarHBondContact O-N 2.72Å; E322-Q325 WeakPolarHBondContact O-CB 3.41Å; E322-Q325 PolarHBondContact O-N 3.4Å; E322-D326 PolarHBondContact O-N 3Å
323	V	91.8	Very high	88.9	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.018	23%	0.227	C	C	.	.	H	α-helix	trans	-64.7	-40.7	174.7	166.6	0	0	0	0	111.7	V297 S319 I321 Q325 D326 L327	V297-V323 HydrophobicContact CG2-CG1 3.92Å; S319-V323 WeakPolarHBondContact O-CB 3.37Å; S319-V323 VanDerWaalsContact O-CG2 3.26Å; S319-V323 WeakPolarHBondContact O-CG2 3.34Å; S319-V323 PolarHBondContact O-N 2.87Å; S319-V323 VanDerWaalsContact O-N 3.15Å; I321-V323 VanDerWaalsContact C-N 3.35Å; I321-V323 PolarHBondContact O-N 2.92Å; V323-Q325 VanDerWaalsContact C-N 3.29Å; V323-Q325 PolarHBondContact O-N 3.47Å; V323-D326 PolarHBondContact O-N 2.9Å; V323-L327 HydrophobicContact CG1-CD1 4Å; V323-L327 HydrophobicContact CG1-CG 4.34Å; V323-L327 WeakPolarHBondContact O-CB 3.37Å; V323-L327 WeakPolarHBondContact O-CG 3.42Å; V323-L327 PolarHBondContact O-N 2.85Å
324	Q	89.8	Confident	90	Very high	4 Å²	4	44.1 Å²	44.1	2%	0.019	21%	0.214	C	C	.	.	H	α-helix	trans	-63.4	-34.4	174.7	175.2	62.2	3.8	0	0	112.1	V297 L320 I321 L327 E328 M468 T469 P473	V297-Q324 HydrophobicContact CG1-CB 4.02Å; V297-Q324 HydrophobicContact CG1-CG 4.29Å; V297-Q324 VanDerWaalsContact CG1-OE1 3.28Å; L320-Q324 WeakPolarHBondContact O-CB 3.3Å; L320-Q324 PolarHBondContact O-N 2.68Å; I321-Q324 PolarHBondContact O-N 3.37Å; Q324-L327 PolarHBondContact O-N 3.09Å; Q324-E328 PolarHBondContact NE2-OE1 3.2Å; Q324-E328 PolarHBondContact O-N 3.13Å; Q324-M468 HydrophobicContact CB-CE 4.46Å; Q324-M468 HydrophobicContact CG-CE 3.74Å; Q324-M468 WeakPolarHBondContact O-CE 3.39Å; Q324-T469 PolarHBondContact NE2-O 3.17Å; Q324-P473 VanDerWaalsContact OE1-CB 3.32Å
325	Q	91.6	Very high	91	Very high	80 Å²	80	44 Å²	44	37%	0.374	21%	0.212	S	C	.	.	H	α-helix	trans	-65.4	-47.6	174.2	-75	170.7	-10.3	0	0	111.8	I321 E322 V323 L327 E328 R329 L465 M468	I321-Q325 WeakPolarHBondContact O-CG 3.12Å; I321-Q325 PolarHBondContact O-N 2.85Å; E322-Q325 WeakPolarHBondContact O-CB 3.41Å; E322-Q325 PolarHBondContact O-N 3.4Å; V323-Q325 VanDerWaalsContact C-N 3.29Å; V323-Q325 PolarHBondContact O-N 3.47Å; Q325-L327 VanDerWaalsContact C-N 3.31Å; Q325-L327 PolarHBondContact O-N 2.93Å; Q325-E328 PolarHBondContact O-N 3.43Å; Q325-R329 WeakPolarHBondContact O-CB 3.32Å; Q325-R329 PolarHBondContact O-N 3.47Å; Q325-L465 HydrophobicContact CG-CD1 4.33Å; Q325-M468 VanDerWaalsContact CA-CE 3.46Å; Q325-M468 HydrophobicContact CB-CE 4.14Å; Q325-M468 HydrophobicContact CG-CE 3.6Å; Q325-M468 HydrophobicContact CG-SD 3.58Å; Q325-M468 VanDerWaalsContact CG-SD 3.58Å
326	D	93.6	Very high	91.7	Very high	18 Å²	18	38.2 Å²	38.2	10%	0.096	19%	0.193	C	C	.	.	H	α-helix	trans	-62.8	-36.8	174	-95.1	-16.8	0	0	0	112.2	T289 I291 E322 V323 R329 I330	T289-D326 WeakPolarHBondContact CB-OD2 3.31Å; T289-D326 WeakPolarHBondContact CG2-OD2 3.35Å; T289-D326 PolarHBondContact OG1-OD2 2.91Å; I291-D326 HydrophobicContact CG2-CB 4.45Å; E322-D326 PolarHBondContact O-N 3Å; V323-D326 PolarHBondContact O-N 2.9Å; D326-R329 PolarHBondContact O-N 2.93Å; D326-R329 IonicContact OD1-CZ 3.55Å; D326-R329 IonicContact OD1-NE 3.61Å; D326-R329 PolarHBondContact OD1-NE 3.14Å; D326-R329 IonicContact OD1-NH2 2.69Å; D326-R329 PolarHBondContact OD1-NH2 3.34Å; D326-I330 WeakPolarHBondContact O-CB 3.32Å; D326-I330 VanDerWaalsContact O-CD1 3.29Å; D326-I330 WeakPolarHBondContact O-CD1 3.36Å; D326-I330 WeakPolarHBondContact O-CG1 3.47Å; D326-I330 PolarHBondContact O-N 3.17Å
327	L	93.3	Very high	92.3	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.7	-52.9	175.5	-70.4	170.3	0	0	0	112.1	A294 V297 V323 Q324 Q325 R329 I330 F331 L358 P473	A294-L327 HydrophobicContact CB-CD1 3.63Å; A294-L327 HydrophobicContact CB-CD2 4.08Å; A294-L327 HydrophobicContact CB-CG 4.42Å; V297-L327 HydrophobicContact CG2-CD1 4.1Å; V323-L327 HydrophobicContact CG1-CD1 4Å; V323-L327 HydrophobicContact CG1-CG 4.34Å; V323-L327 WeakPolarHBondContact O-CB 3.37Å; V323-L327 WeakPolarHBondContact O-CG 3.42Å; V323-L327 PolarHBondContact O-N 2.85Å; Q324-L327 PolarHBondContact O-N 3.09Å; Q325-L327 VanDerWaalsContact C-N 3.31Å; Q325-L327 PolarHBondContact O-N 2.93Å; L327-R329 VanDerWaalsContact C-N 3.26Å; L327-R329 PolarHBondContact O-N 2.9Å; L327-I330 PolarHBondContact O-N 3.15Å; L327-I330 VanDerWaalsContact O-N 3.14Å; L327-F331 WeakPolarHBondContact O-CD2 3.33Å; L327-F331 PolarHBondContact O-N 2.82Å; L327-L358 HydrophobicContact CD2-CD1 3.83Å; L327-L358 HydrophobicContact CD2-CD2 3.68Å; L327-L358 HydrophobicContact CD2-CG 3.7Å; L327-P473 HydrophobicContact CB-CB 3.8Å; L327-P473 HydrophobicContact CD1-CB 3.78Å; L327-P473 HydrophobicContact CD1-CG 4.21Å; L327-P473 HydrophobicContact CG-CB 4.34Å
328	E	92.4	Very high	93	Very high	4 Å²	4	36 Å²	36	2%	0.019	18%	0.181	C	C	.	.	H	α-helix	trans	-61.8	-35.6	178.6	-71	-169.6	-154	0	0	112	Q324 Q325 F331 H332 M468 T469 S476	Q324-E328 PolarHBondContact NE2-OE1 3.2Å; Q324-E328 PolarHBondContact O-N 3.13Å; Q325-E328 PolarHBondContact O-N 3.43Å; E328-F331 PolarHBondContact O-N 2.88Å; E328-H332 PolarHBondContact O-N 2.68Å; E328-M468 HydrophobicContact CB-CE 4.08Å; E328-M468 VanDerWaalsContact CD-CE 3.46Å; E328-M468 HydrophobicContact CG-CE 3.93Å; E328-M468 WeakPolarHBondContact OE1-CA 3.35Å; E328-M468 VanDerWaalsContact OE1-CB 3.3Å; E328-M468 WeakPolarHBondContact OE1-CB 3.39Å; E328-M468 WeakPolarHBondContact OE2-CA 3.31Å; E328-T469 PolarHBondContact OE1-N 2.98Å; E328-S476 WeakPolarHBondContact OE2-CB 3.32Å; E328-S476 PolarHBondContact OE2-OG 2.62Å
329	R	95	Very high	93.6	Very high	64 Å²	64	32.5 Å²	32.5	24%	0.242	16%	0.16	C	C	.	.	H	α-helix	trans	-62	-45.4	172	-173.1	177.9	69.5	82.4	-10.5	112.4	S285 R286 Q325 D326 L327 H332 L333	S285-R329 PolarHBondContact OG-NH1 2.95Å; R286-R329 PolarHBondContact O-NH2 3.43Å; Q325-R329 WeakPolarHBondContact O-CB 3.32Å; Q325-R329 PolarHBondContact O-N 3.47Å; D326-R329 PolarHBondContact O-N 2.93Å; D326-R329 IonicContact OD1-CZ 3.55Å; D326-R329 IonicContact OD1-NE 3.61Å; D326-R329 PolarHBondContact OD1-NE 3.14Å; D326-R329 IonicContact OD1-NH2 2.69Å; D326-R329 PolarHBondContact OD1-NH2 3.34Å; L327-R329 VanDerWaalsContact C-N 3.26Å; L327-R329 PolarHBondContact O-N 2.9Å; R329-H332 PolarHBondContact O-N 2.86Å; R329-L333 WeakPolarHBondContact O-CG 3.29Å; R329-L333 PolarHBondContact O-N 2.92Å
330	I	95.9	Very high	94.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-63.1	-41.5	175.5	-70.2	160	0	0	0	111	P245 P249 V287 D326 L327 L333 G334 L340 L342 L358	P245-I330 HydrophobicContact CG-CG2 4.46Å; P249-I330 HydrophobicContact CB-CG2 4.45Å; P249-I330 HydrophobicContact CG-CG2 4.22Å; V287-I330 HydrophobicContact CG2-CD1 4.18Å; D326-I330 WeakPolarHBondContact O-CB 3.32Å; D326-I330 VanDerWaalsContact O-CD1 3.29Å; D326-I330 WeakPolarHBondContact O-CD1 3.36Å; D326-I330 WeakPolarHBondContact O-CG1 3.47Å; D326-I330 PolarHBondContact O-N 3.17Å; L327-I330 PolarHBondContact O-N 3.15Å; L327-I330 VanDerWaalsContact O-N 3.14Å; I330-L333 PolarHBondContact O-N 3.43Å; I330-G334 PolarHBondContact O-N 3.41Å; I330-L340 HydrophobicContact CG2-CD2 4Å; I330-L342 HydrophobicContact CD1-CD1 3.68Å; I330-L342 HydrophobicContact CG1-CD1 3.94Å; I330-L342 HydrophobicContact CG1-CD2 4.09Å; I330-L342 HydrophobicContact CG2-CD1 4.1Å; I330-L358 HydrophobicContact CB-CD2 4.2Å; I330-L358 HydrophobicContact CD1-CD1 3.98Å; I330-L358 HydrophobicContact CG2-CD1 4.38Å; I330-L358 HydrophobicContact CG2-CD2 3.58Å
331	F	95.3	Very high	94.5	Very high	5 Å²	5	31 Å²	31	2%	0.022	15%	0.149	C	C	.	.	H	α-helix	trans	-61.5	-42	173.5	-92.2	-88.5	0	0	0	112.2	I243 P245 L327 E328 G334 S335 C357 L358 P473 G474 V477	I243-F331 HydrophobicContact CG2-CE1 3.55Å; I243-F331 HydrophobicContact CG2-CZ 3.98Å; P245-F331 HydrophobicContact CB-CD1 4.45Å; P245-F331 HydrophobicContact CG-CD1 4.03Å; P245-F331 HydrophobicContact CG-CD2 4.28Å; P245-F331 HydrophobicContact CG-CE1 4.02Å; P245-F331 HydrophobicContact CG-CE2 4.26Å; P245-F331 HydrophobicContact CG-CG 4.17Å; P245-F331 HydrophobicContact CG-CZ 4.13Å; L327-F331 WeakPolarHBondContact O-CD2 3.33Å; L327-F331 PolarHBondContact O-N 2.82Å; E328-F331 PolarHBondContact O-N 2.88Å; F331-G334 PolarHBondContact O-N 3.49Å; F331-S335 PolarHBondContact O-N 3.05Å; F331-S335 VanDerWaalsContact O-N 3.08Å; F331-C357 HydrophobicContact CZ-CB 4.44Å; F331-L358 HydrophobicContact CD2-CD2 4.33Å; F331-L358 HydrophobicContact CE2-CD2 4.12Å; F331-P473 HydrophobicContact CE2-CB 4.4Å; F331-G474 VanDerWaalsContact CD2-CA 3.49Å; F331-V477 HydrophobicContact CB-CB 4.37Å; F331-V477 HydrophobicContact CB-CG2 4.19Å
332	H	95.1	Very high	94.9	Very high	76 Å²	76	27.9 Å²	27.9	35%	0.352	13%	0.134	S	C	.	.	H	α-helix	trans	-63.7	-47.9	176	-178.8	52.2	0	0	0	112.1	E328 R329 G334 S335 V477	E328-H332 PolarHBondContact O-N 2.68Å; R329-H332 PolarHBondContact O-N 2.86Å; H332-G334 VanDerWaalsContact C-N 3.32Å; H332-G334 PolarHBondContact O-N 2.9Å; H332-S335 WeakPolarHBondContact O-CB 3.42Å; H332-S335 PolarHBondContact O-N 3.46Å; H332-S335 VanDerWaalsContact O-N 3.09Å; H332-S335 PolarHBondContact O-OG 3.23Å; H332-V477 HydrophobicContact CB-CG1 4.4Å; H332-V477 HydrophobicContact CB-CG2 4.22Å
333	L	96.5	Very high	95.1	Very high	12 Å²	12	26 Å²	26	6%	0.063	13%	0.126	C	C	.	.	H	α-helix	trans	-60.8	-41	175.4	-64	177.4	0	0	0	111.9	I283 R329 I330 S335 K336 L340	I283-L333 HydrophobicContact CD1-CB 4.39Å; I283-L333 HydrophobicContact CD1-CD2 4.32Å; I283-L333 HydrophobicContact CG2-CD1 4.17Å; I283-L333 HydrophobicContact CG2-CD2 4.24Å; R329-L333 WeakPolarHBondContact O-CG 3.29Å; R329-L333 PolarHBondContact O-N 2.92Å; I330-L333 PolarHBondContact O-N 3.43Å; L333-S335 PolarHBondContact O-N 3.04Å; L333-K336 HydrophobicContact CD2-CD 4.32Å; L333-K336 WeakPolarHBondContact O-CB 3.38Å; L333-K336 PolarHBondContact O-N 3.44Å; L333-K336 VanDerWaalsContact O-N 3.07Å; L333-L340 HydrophobicContact CB-CD1 3.92Å; L333-L340 HydrophobicContact CB-CD2 3.86Å; L333-L340 HydrophobicContact CD1-CD1 4.01Å
334	G	96.2	Very high	95.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63.7	-22.1	175.7	0	0	0	0	0	114.1	C246 M247 I330 F331 H332 K336	C246-G334 WeakPolarHBondContact CB-O 3.38Å; M247-G334 PolarHBondContact N-O 3.2Å; M247-G334 VanDerWaalsContact N-O 3.11Å; I330-G334 PolarHBondContact O-N 3.41Å; F331-G334 PolarHBondContact O-N 3.49Å; H332-G334 VanDerWaalsContact C-N 3.32Å; H332-G334 PolarHBondContact O-N 2.9Å; G334-K336 VanDerWaalsContact C-N 3.34Å
335	S	95.3	Very high	95.5	Very high	52 Å²	52	28.4 Å²	28.4	36%	0.364	14%	0.139	S	C	.	.	H	α-helix	trans	-76.7	-16.9	173.9	75.9	0	0	0	0	113.9	F331 H332 L333 M337	F331-S335 PolarHBondContact O-N 3.05Å; F331-S335 VanDerWaalsContact O-N 3.08Å; H332-S335 WeakPolarHBondContact O-CB 3.42Å; H332-S335 PolarHBondContact O-N 3.46Å; H332-S335 VanDerWaalsContact O-N 3.09Å; H332-S335 PolarHBondContact O-OG 3.23Å; L333-S335 PolarHBondContact O-N 3.04Å; S335-M337 PolarHBondContact O-N 3.35Å; S335-M337 VanDerWaalsContact O-N 3.13Å
336	K	95.6	Very high	95.5	Very high	77 Å²	77	26.7 Å²	26.7	34%	0.335	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	2.2	177.4	-59.3	-174.6	177.5	-172.5	0	113.6	I283 L333 G334 Q338 D460	I283-K336 HydrophobicContact CD1-CB 4.03Å; I283-K336 HydrophobicContact CD1-CD 3.91Å; I283-K336 HydrophobicContact CD1-CG 4.44Å; L333-K336 HydrophobicContact CD2-CD 4.32Å; L333-K336 WeakPolarHBondContact O-CB 3.38Å; L333-K336 PolarHBondContact O-N 3.44Å; L333-K336 VanDerWaalsContact O-N 3.07Å; G334-K336 VanDerWaalsContact C-N 3.34Å; K336-Q338 PolarHBondContact O-N 2.73Å; K336-Q338 VanDerWaalsContact O-N 3.09Å; K336-D460 IonicContact NZ-OD1 3.68Å; K336-D460 PolarHBondContact NZ-OD1 2.8Å; K336-D460 IonicContact NZ-OD2 3.18Å; K336-D460 PolarHBondContact NZ-OD2 3.39Å
337	M	96	Very high	95.7	Very high	39 Å²	39	25.9 Å²	25.9	19%	0.192	13%	0.13	C	C	.	.			trans	55.6	20.6	-179.9	-69.1	-64.7	-59.7	0	0	115.5	V41 C246 M247 S335 H434	V41-M337 HydrophobicContact CB-SD 4.26Å; V41-M337 HydrophobicContact CG2-CE 4.24Å; V41-M337 HydrophobicContact CG2-SD 4.04Å; C246-M337 HydrophobicContact CB-SD 4.05Å; M247-M337 HydrophobicContact CG-SD 4.29Å; M247-M337 HydrophobicContact SD-CE 4.18Å; M247-M337 HydrophobicContact SD-SD 4.49Å; S335-M337 PolarHBondContact O-N 3.35Å; S335-M337 VanDerWaalsContact O-N 3.13Å; M337-H434 PolarHBondContact O-CE1 2.88Å; M337-H434 PolarHBondContact O-NE2 2.82Å; M337-H434 VanDerWaalsContact O-NE2 3.15Å
338	Q	97.3	Very high	95.8	Very high	52 Å²	52	27.2 Å²	27.2	24%	0.243	14%	0.137	C	C	.	.	S	Bend	trans	-99.2	160.1	173.8	-75.7	173.7	-24	0	0	111.3	M247 G280 R281 I283 K336 L340	M247-Q338 VanDerWaalsContact CB-O 3.31Å; M247-Q338 WeakPolarHBondContact CB-O 3.37Å; M247-Q338 VanDerWaalsContact CG-O 3.3Å; M247-Q338 WeakPolarHBondContact CG-O 3.24Å; G280-Q338 PolarHBondContact O-NE2 3.33Å; R281-Q338 WeakPolarHBondContact O-CB 3.49Å; I283-Q338 HydrophobicContact CD1-CB 4.06Å; I283-Q338 HydrophobicContact CG1-CB 3.95Å; K336-Q338 PolarHBondContact O-N 2.73Å; K336-Q338 VanDerWaalsContact O-N 3.09Å; Q338-L340 PolarHBondContact O-N 2.88Å
339	L	98.1	Very high	96	Very high	4 Å²	4	29.3 Å²	29.3	2%	0.021	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	126.5	169.8	-67.3	175.8	0	0	0	108.6	M247 F278 R281 I282 I283 L426 Y429 W430	M247-L339 HydrophobicContact CE-CD2 3.94Å; F278-L339 HydrophobicContact CB-CD1 4.15Å; F278-L339 HydrophobicContact CD1-CD1 3.42Å; F278-L339 VanDerWaalsContact CD1-CD1 3.42Å; F278-L339 HydrophobicContact CD2-CD1 4.22Å; F278-L339 HydrophobicContact CE1-CD1 3.78Å; F278-L339 HydrophobicContact CG-CD1 3.67Å; F278-L339 HydrophobicContact CZ-CD1 4.33Å; R281-L339 PolarHBondContact O-N 3.31Å; I282-L339 CarbonylContact C-O 3.57Å; I282-L339 WeakPolarHBondContact CA-O 3.3Å; I282-L339 HydrophobicContact CB-CB 4.25Å; I282-L339 HydrophobicContact CG1-CB 3.99Å; I283-L339 PolarHBondContact N-O 2.77Å; L339-L426 HydrophobicContact CD1-CB 4.47Å; L339-Y429 HydrophobicContact CD2-CD1 3.94Å; L339-Y429 HydrophobicContact CD2-CE1 4.35Å; L339-W430 HydrophobicContact CD2-CE3 4.2Å; L339-W430 HydrophobicContact CG-CE3 3.89Å; L339-W430 HydrophobicContact CG-CZ3 4.26Å
340	L	98.1	Very high	96.1	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	105.5	-179	178.2	55.6	0	0	0	110	P249 V250 I283 I330 L333 Q338 L342	P249-L340 CarbonylContact C-O 3.58Å; P249-L340 VanDerWaalsContact CA-O 3.3Å; P249-L340 WeakPolarHBondContact CA-O 3.47Å; P249-L340 HydrophobicContact CB-CD2 4.23Å; P249-L340 HydrophobicContact CB-CG 4.24Å; V250-L340 PolarHBondContact N-O 2.89Å; I283-L340 HydrophobicContact CB-CD1 4.04Å; I283-L340 HydrophobicContact CG2-CD1 3.89Å; I330-L340 HydrophobicContact CG2-CD2 4Å; L333-L340 HydrophobicContact CB-CD1 3.92Å; L333-L340 HydrophobicContact CB-CD2 3.86Å; L333-L340 HydrophobicContact CD1-CD1 4.01Å; Q338-L340 PolarHBondContact O-N 2.88Å; L340-L342 HydrophobicContact CD1-CD2 3.83Å; L340-L342 HydrophobicContact CD2-CD2 4.27Å; L340-L342 HydrophobicContact CG-CD2 3.87Å; L340-L342 HydrophobicContact CG-CG 4.37Å
341	L	97.8	Very high	96	Very high	4 Å²	4	31.2 Å²	31.2	2%	0.021	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	118.8	175.2	173.3	55.2	0	0	0	109.9	V250 F252 F271 I282 I283 V284 S285	V250-L341 HydrophobicContact CB-CD1 4.24Å; V250-L341 HydrophobicContact CG1-CD1 4.13Å; F252-L341 HydrophobicContact CD2-CD1 3.73Å; F252-L341 HydrophobicContact CE2-CD1 3.59Å; F271-L341 HydrophobicContact CB-CD2 4.28Å; F271-L341 HydrophobicContact CD1-CD2 4.29Å; F271-L341 HydrophobicContact CD2-CD2 4.3Å; F271-L341 HydrophobicContact CG-CD2 4.01Å; I282-L341 HydrophobicContact CD1-CB 4.11Å; I282-L341 HydrophobicContact CD1-CD2 4.34Å; I282-L341 HydrophobicContact CG1-CB 4.38Å; I283-L341 PolarHBondContact O-N 2.89Å; V284-L341 WeakPolarHBondContact CA-O 3.49Å; V284-L341 HydrophobicContact CG1-CD2 4.37Å; V284-L341 HydrophobicContact CG1-CG 4.38Å; V284-L341 HydrophobicContact CG2-CB 4.39Å; V284-L341 HydrophobicContact CG2-CD2 4.24Å; S285-L341 PolarHBondContact N-O 3.44Å
342	L	97.3	Very high	96	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	116.9	177.4	-57.6	-175.7	0	0	0	111.8	P249 V250 V251 S285 V287 I330 L340 C344	P249-L342 HydrophobicContact CB-CD1 3.46Å; P249-L342 VanDerWaalsContact CB-CD1 3.46Å; P249-L342 HydrophobicContact CB-CG 3.71Å; P249-L342 HydrophobicContact CG-CD1 4.1Å; V250-L342 PolarHBondContact O-N 3.38Å; V251-L342 HydrophobicContact CG2-CB 4.33Å; S285-L342 WeakPolarHBondContact O-CA 3.44Å; V287-L342 HydrophobicContact CG2-CB 4.3Å; V287-L342 HydrophobicContact CG2-CD1 4.4Å; V287-L342 HydrophobicContact CG2-CD2 4.11Å; I330-L342 HydrophobicContact CD1-CD1 3.68Å; I330-L342 HydrophobicContact CG1-CD1 3.94Å; I330-L342 HydrophobicContact CG1-CD2 4.09Å; I330-L342 HydrophobicContact CG2-CD1 4.1Å; L340-L342 HydrophobicContact CD1-CD2 3.83Å; L340-L342 HydrophobicContact CD2-CD2 4.27Å; L340-L342 HydrophobicContact CG-CD2 3.87Å; L340-L342 HydrophobicContact CG-CG 4.37Å; L342-C344 PolarHBondContact O-N 3.25Å
343	D	96.1	Very high	95.9	Very high	50 Å²	50	29.8 Å²	29.8	27%	0.267	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	92	168.6	-175.7	21.5	0	0	0	109.2	F271 S285 R286 V287	F271-D343 HydrophobicContact CD2-CB 4.47Å; F271-D343 HydrophobicContact CE2-CB 3.82Å; S285-D343 PolarHBondContact O-N 3.18Å; R286-D343 CarbonylContact C-O 3.55Å; R286-D343 WeakPolarHBondContact CA-O 3.38Å; R286-D343 HydrophobicContact CB-CB 4.31Å; R286-D343 HydrophobicContact CG-CB 4.27Å; R286-D343 WeakPolarHBondContact CG-O 3.32Å; V287-D343 PolarHBondContact N-O 2.93Å
344	C	95.5	Very high	95.5	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	107.4	-177.9	-53.2	0	0	0	0	111.5	K258 L342 T346 I347	K258-C344 WeakPolarHBondContact CD-O 3.4Å; K258-C344 PolarHBondContact NZ-O 3.03Å; L342-C344 PolarHBondContact O-N 3.25Å; C344-T346 VanDerWaalsContact C-N 3.28Å; C344-T346 PolarHBondContact O-N 3.42Å; C344-I347 HydrophobicContact CB-CB 3.93Å; C344-I347 HydrophobicContact CB-CG1 3.69Å
345	D	92.7	Very high	94.9	Very high	58 Å²	58	40.3 Å²	40.3	31%	0.31	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-39.7	179.8	-63.4	21.6	0	0	0	113	R286 V287	R286-D345 IonicContact CZ-OD1 3.89Å; R286-D345 IonicContact CZ-OD2 2.7Å; R286-D345 IonicContact NE-OD1 3.32Å; R286-D345 PolarHBondContact NE-OD1 3.03Å; R286-D345 IonicContact NE-OD2 3.79Å; R286-D345 IonicContact NH2-OD1 2.78Å; R286-D345 PolarHBondContact NH2-OD1 3.25Å; R286-D345 IonicContact NH2-OD2 2.88Å; R286-D345 PolarHBondContact NH2-OD2 3.42Å; V287-D345 PolarHBondContact O-N 3.4Å
346	T	93.5	Very high	94.7	Very high	45 Å²	45	38.1 Å²	38.1	28%	0.276	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-9.6	-167.8	58.2	0	0	0	0	114.9	N290 C344 N348 Q352	N290-T346 HydrophobicContact CB-CG2 4.48Å; C344-T346 VanDerWaalsContact C-N 3.28Å; C344-T346 PolarHBondContact O-N 3.42Å; T346-N348 VanDerWaalsContact C-ND2 3.33Å; T346-N348 PolarHBondContact O-ND2 3.06Å; T346-Q352 PolarHBondContact O-NE2 2.84Å; T346-Q352 VanDerWaalsContact O-NE2 3.14Å
347	I	96.2	Very high	94.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.181	C	C	.	.			trans	-99.9	118.9	-168	-56.5	-55.5	0	0	0	111.3	V251 V253 K258 I291 C344 Q352 I353	V251-I347 HydrophobicContact CG1-CG2 4.07Å; V253-I347 HydrophobicContact CG1-CG2 4.28Å; K258-I347 WeakPolarHBondContact CD-O 3.49Å; K258-I347 WeakPolarHBondContact CE-O 3.22Å; I291-I347 HydrophobicContact CD1-CG1 4.39Å; I291-I347 HydrophobicContact CG1-CD1 4.08Å; I291-I347 HydrophobicContact CG1-CG1 4.09Å; C344-I347 HydrophobicContact CB-CB 3.93Å; C344-I347 HydrophobicContact CB-CG1 3.69Å; I347-Q352 HydrophobicContact CD1-CB 4.18Å; I347-I353 HydrophobicContact CD1-CG2 3.82Å; I347-I353 HydrophobicContact CG1-CG2 4.07Å; I347-I353 HydrophobicContact CG2-CD1 4.02Å; I347-I353 HydrophobicContact CG2-CG2 3.8Å
348	N	96.6	Very high	94.3	Very high	28 Å²	28	33.7 Å²	33.7	15%	0.15	17%	0.173	C	C	.	.			trans	-133.8	-12.7	-166.7	-72.3	-84.7	0	0	0	113.4	L257 K258 T346	L257-N348 HydrophobicContact CD1-CB 4.06Å; K258-N348 WeakPolarHBondContact CB-OD1 3.42Å; K258-N348 WeakPolarHBondContact CG-OD1 3.37Å; K258-N348 PolarHBondContact N-OD1 3.42Å; T346-N348 VanDerWaalsContact C-ND2 3.33Å; T346-N348 PolarHBondContact O-ND2 3.06Å
349	H	96.9	Very high	94.2	Very high	49 Å²	49	31.4 Å²	31.4	23%	0.227	16%	0.163	C	C	.	.	S	Bend	trans	-148.9	135.7	-175.8	-171.6	-51.7	0	0	0	110.5	N351 Q352 C401	H349-N351 PolarHBondContact CE1-ND2 3.28Å; H349-N351 VanDerWaalsContact CE1-ND2 3.35Å; H349-N351 PolarHBondContact ND1-N 3.03Å; H349-N351 PolarHBondContact O-N 3.21Å; H349-Q352 WeakPolarHBondContact O-CB 3.36Å; H349-Q352 PolarHBondContact O-N 3.43Å; H349-Q352 PolarHBondContact O-OE1 3.08Å; H349-C401 PolarHBondContact CE1-SG 3.45Å
350	P	96.1	Very high	94.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-50.8	-49.4	-175.3	14.8	-30.6	0	0	0	114.1	Q352 I353 T354 V362 S405 F406	P350-Q352 PolarHBondContact O-N 3.46Å; P350-I353 VanDerWaalsContact O-CG1 3.31Å; P350-I353 WeakPolarHBondContact O-CG1 3.4Å; P350-I353 PolarHBondContact O-N 3.34Å; P350-T354 PolarHBondContact O-N 3.19Å; P350-T354 PolarHBondContact O-OG1 2.95Å; P350-V362 HydrophobicContact CB-CG1 4.29Å; P350-S405 WeakPolarHBondContact CB-O 3.3Å; P350-F406 HydrophobicContact CB-CE1 4.49Å; P350-F406 HydrophobicContact CG-CD1 4.18Å; P350-F406 HydrophobicContact CG-CE1 3.66Å; P350-F406 HydrophobicContact CG-CZ 4.17Å
351	N	94.8	Very high	94.1	Very high	103 Å²	103	31.5 Å²	31.5	55%	0.551	16%	0.164	S	C	*	.	H	α-helix	trans	-48.4	-24.3	177.8	-64.9	-6.4	0	0	0	116	K295 H349 I353 T354	K295-N351 PolarHBondContact NZ-O 3Å; H349-N351 PolarHBondContact CE1-ND2 3.28Å; H349-N351 VanDerWaalsContact CE1-ND2 3.35Å; H349-N351 PolarHBondContact ND1-N 3.03Å; H349-N351 PolarHBondContact O-N 3.21Å; N351-I353 VanDerWaalsContact C-N 3.33Å; N351-T354 PolarHBondContact N-OG1 3.49Å
352	Q	94.5	Very high	94.1	Very high	49 Å²	49	31.6 Å²	31.6	23%	0.229	16%	0.164	C	C	.	.	H	α-helix	trans	-60.5	-42.8	171.6	-69.5	177.8	-83.2	0	0	111.3	S292 K295 T346 I347 H349 P350	S292-Q352 WeakPolarHBondContact CB-O 3.48Å; K295-Q352 WeakPolarHBondContact CE-O 3.2Å; K295-Q352 PolarHBondContact NZ-O 2.88Å; T346-Q352 PolarHBondContact O-NE2 2.84Å; T346-Q352 VanDerWaalsContact O-NE2 3.14Å; I347-Q352 HydrophobicContact CD1-CB 4.18Å; H349-Q352 WeakPolarHBondContact O-CB 3.36Å; H349-Q352 PolarHBondContact O-N 3.43Å; H349-Q352 PolarHBondContact O-OE1 3.08Å; P350-Q352 PolarHBondContact O-N 3.46Å
353	I	93.2	Very high	94.1	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-108.9	-19.5	-172	62.2	-176.6	0	0	0	114.7	V251 I291 I347 P350 N351 K355 T356 P360 V362	V251-I353 HydrophobicContact CB-CD1 4.01Å; V251-I353 HydrophobicContact CG1-CD1 3.88Å; V251-I353 HydrophobicContact CG2-CD1 4.27Å; I291-I353 HydrophobicContact CD1-CG2 4.45Å; I347-I353 HydrophobicContact CD1-CG2 3.82Å; I347-I353 HydrophobicContact CG1-CG2 4.07Å; I347-I353 HydrophobicContact CG2-CD1 4.02Å; I347-I353 HydrophobicContact CG2-CG2 3.8Å; P350-I353 VanDerWaalsContact O-CG1 3.31Å; P350-I353 WeakPolarHBondContact O-CG1 3.4Å; P350-I353 PolarHBondContact O-N 3.34Å; N351-I353 VanDerWaalsContact C-N 3.33Å; I353-K355 VanDerWaalsContact C-N 3.31Å; I353-K355 PolarHBondContact O-N 3.03Å; I353-T356 WeakPolarHBondContact O-CB 3.45Å; I353-T356 WeakPolarHBondContact O-CG2 3.4Å; I353-T356 PolarHBondContact O-N 2.85Å; I353-T356 VanDerWaalsContact O-N 3.08Å; I353-T356 PolarHBondContact O-OG1 3.44Å; I353-P360 HydrophobicContact CB-CG 4.04Å; I353-P360 HydrophobicContact CD1-CB 4.31Å; I353-P360 HydrophobicContact CD1-CG 3.59Å; I353-P360 HydrophobicContact CG1-CG 3.81Å; I353-V362 HydrophobicContact CD1-CG1 4.49Å; I353-V362 HydrophobicContact CD1-CG2 3.86Å; I353-V362 HydrophobicContact CG1-CG2 4.33Å
354	T	87.9	Confident	94.2	Very high	67 Å²	67	29.6 Å²	29.6	41%	0.411	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-42.3	-175	-47.3	0	0	0	0	113.9	P350 N351 T356	P350-T354 PolarHBondContact O-N 3.19Å; P350-T354 PolarHBondContact O-OG1 2.95Å; N351-T354 PolarHBondContact N-OG1 3.49Å; T354-T356 VanDerWaalsContact C-N 3.29Å; T354-T356 PolarHBondContact O-N 2.83Å
355	K	84.2	Confident	94.3	Very high	167 Å²	167	29.9 Å²	29.9	73%	0.726	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.1	42.3	178.1	-51.4	-171.4	-176.1	-170.5	0	112.5	K295 I353	K295-K355 HydrophobicContact CD-CB 4.08Å; K295-K355 VanDerWaalsContact CE-O 3.28Å; K295-K355 WeakPolarHBondContact CE-O 3.4Å; K295-K355 WeakPolarHBondContact CG-O 3.37Å; I353-K355 VanDerWaalsContact C-N 3.31Å; I353-K355 PolarHBondContact O-N 3.03Å
356	T	90	Very high	94.5	Very high	5 Å²	5	30.3 Å²	30.3	3%	0.031	15%	0.154	C	C	.	.	S	Bend	trans	-121.7	152.7	175.2	67.2	0	0	0	0	110.4	A294 K295 I353 T354 L358 A359	A294-T356 HydrophobicContact CB-CG2 3.91Å; K295-T356 HydrophobicContact CG-CG2 4.5Å; I353-T356 WeakPolarHBondContact O-CB 3.45Å; I353-T356 WeakPolarHBondContact O-CG2 3.4Å; I353-T356 PolarHBondContact O-N 2.85Å; I353-T356 VanDerWaalsContact O-N 3.08Å; I353-T356 PolarHBondContact O-OG1 3.44Å; T354-T356 VanDerWaalsContact C-N 3.29Å; T354-T356 PolarHBondContact O-N 2.83Å; T356-L358 PolarHBondContact O-N 3.24Å; T356-L358 VanDerWaalsContact O-N 3.09Å; T356-A359 PolarHBondContact O-N 3.2Å
357	C	90.1	Very high	94.7	Very high	20 Å²	20	29.3 Å²	29.3	14%	0.135	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-6.3	175	58	0	0	0	0	113.9	E242 V244 P245 F331 A359 P473	E242-C357 WeakPolarHBondContact OE1-CA 3.47Å; V244-C357 WeakPolarHBondContact CA-O 3.3Å; V244-C357 WeakPolarHBondContact CG1-O 3.4Å; P245-C357 WeakPolarHBondContact CD-O 3.47Å; F331-C357 HydrophobicContact CZ-CB 4.44Å; C357-A359 VanDerWaalsContact C-N 3.32Å; C357-P473 VanDerWaalsContact SG-CG 3.54Å
358	L	94.3	Very high	94.4	Very high	3 Å²	3	33.8 Å²	33.8	2%	0.016	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-24.8	173.2	-63.7	-173.1	0	0	0	112.7	P245 P249 I291 L327 I330 F331 T356 P360	P245-L358 HydrophobicContact CG-CD2 4.09Å; P249-L358 WeakPolarHBondContact CD-O 3.47Å; P249-L358 HydrophobicContact CG-CB 4.12Å; I291-L358 HydrophobicContact CD1-CD1 4.09Å; L327-L358 HydrophobicContact CD2-CD1 3.83Å; L327-L358 HydrophobicContact CD2-CD2 3.68Å; L327-L358 HydrophobicContact CD2-CG 3.7Å; I330-L358 HydrophobicContact CB-CD2 4.2Å; I330-L358 HydrophobicContact CD1-CD1 3.98Å; I330-L358 HydrophobicContact CG2-CD1 4.38Å; I330-L358 HydrophobicContact CG2-CD2 3.58Å; F331-L358 HydrophobicContact CD2-CD2 4.33Å; F331-L358 HydrophobicContact CE2-CD2 4.12Å; T356-L358 PolarHBondContact O-N 3.24Å; T356-L358 VanDerWaalsContact O-N 3.09Å; L358-P360 VanDerWaalsContact C-N 3.3Å
359	A	94.3	Very high	94.4	Very high	4 Å²	4	34.8 Å²	34.8	3%	0.033	18%	0.183	C	C	.	.			trans	39.4	51.9	-175.1	0	0	0	0	0	114	F74 V244 R248 T356 C357	F74-A359 HydrophobicContact CE1-CB 3.63Å; F74-A359 HydrophobicContact CZ-CB 3.89Å; V244-A359 HydrophobicContact CB-CB 4.36Å; V244-A359 HydrophobicContact CG1-CB 3.84Å; R248-A359 PolarHBondContact NE-O 3.09Å; T356-A359 PolarHBondContact O-N 3.2Å; C357-A359 VanDerWaalsContact C-N 3.32Å
360	P	97	Very high	94.3	Very high	6 Å²	6	34.3 Å²	34.3	4%	0.039	18%	0.182	C	C	.	.			trans	-64.7	158	-167.3	26.8	-34.8	0	0	0	113.1	R248 P249 V251 I353 L358 V362	R248-P360 PolarHBondContact NH2-O 2.78Å; P249-P360 HydrophobicContact CG-CB 4.18Å; P249-P360 CarbonylContact O-C 3.41Å; P249-P360 WeakPolarHBondContact O-CA 3.5Å; P249-P360 WeakPolarHBondContact O-CB 3.4Å; V251-P360 HydrophobicContact CG2-CB 3.81Å; I353-P360 HydrophobicContact CB-CG 4.04Å; I353-P360 HydrophobicContact CD1-CB 4.31Å; I353-P360 HydrophobicContact CD1-CG 3.59Å; I353-P360 HydrophobicContact CG1-CG 3.81Å; L358-P360 VanDerWaalsContact C-N 3.3Å; P360-V362 HydrophobicContact CG-CG2 4.21Å
361	I	97.9	Very high	94.3	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	110.8	164.9	-68.8	168.2	0	0	0	107.3	R248 P249 V250 V251 I363 D407 F425 Y429	R248-I361 HydrophobicContact CB-CD1 3.96Å; R248-I361 HydrophobicContact CB-CG1 3.84Å; P249-I361 PolarHBondContact O-N 2.89Å; V250-I361 WeakPolarHBondContact CA-O 3.49Å; V250-I361 HydrophobicContact CG2-CB 4.21Å; V250-I361 HydrophobicContact CG2-CD1 4.3Å; V250-I361 HydrophobicContact CG2-CG2 4.36Å; V251-I361 PolarHBondContact N-O 3.34Å; I361-I363 HydrophobicContact CG2-CD1 4.19Å; I361-I363 HydrophobicContact CG2-CG1 4.01Å; I361-D407 WeakPolarHBondContact CA-OD2 3.31Å; I361-D407 HydrophobicContact CG2-CB 3.9Å; I361-F425 HydrophobicContact CG2-CE1 3.9Å; I361-F425 HydrophobicContact CG2-CZ 4.3Å; I361-Y429 HydrophobicContact CD1-CD1 3.58Å; I361-Y429 HydrophobicContact CD1-CD2 4.11Å; I361-Y429 HydrophobicContact CD1-CE1 3.57Å; I361-Y429 HydrophobicContact CD1-CE2 4.13Å; I361-Y429 HydrophobicContact CD1-CG 3.87Å
362	V	97.5	Very high	94.5	Very high	6 Å²	6	42.8 Å²	42.8	4%	0.036	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	116.7	-174.7	-167.4	0	0	0	0	110.7	V253 P350 I353 P360 F406 D407 Y408	V253-V362 HydrophobicContact CG1-CG1 4.37Å; V253-V362 HydrophobicContact CG2-CG1 3.94Å; P350-V362 HydrophobicContact CB-CG1 4.29Å; I353-V362 HydrophobicContact CD1-CG1 4.49Å; I353-V362 HydrophobicContact CD1-CG2 3.86Å; I353-V362 HydrophobicContact CG1-CG2 4.33Å; P360-V362 HydrophobicContact CG-CG2 4.21Å; V362-F406 HydrophobicContact CG1-CD1 4.21Å; V362-D407 PolarHBondContact N-OD2 3.05Å; V362-D407 PolarHBondContact O-N 2.9Å; V362-Y408 PolarHBondContact O-N 3.28Å
363	I	97.7	Very high	94.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	119.7	-175.9	-53.2	-166.6	0	0	0	110	V250 V251 F252 V253 I361 Y408 I410 L422	V250-I363 HydrophobicContact CG1-CD1 3.55Å; V250-I363 HydrophobicContact CG1-CG1 4.07Å; V251-I363 PolarHBondContact O-N 3.43Å; F252-I363 WeakPolarHBondContact CA-O 3.21Å; F252-I363 HydrophobicContact CD1-CB 3.92Å; F252-I363 HydrophobicContact CD1-CG2 3.84Å; F252-I363 HydrophobicContact CE1-CB 3.98Å; F252-I363 HydrophobicContact CE1-CD1 4.49Å; F252-I363 HydrophobicContact CE1-CG2 3.59Å; F252-I363 HydrophobicContact CG-CB 4.4Å; F252-I363 HydrophobicContact CZ-CB 4.5Å; F252-I363 HydrophobicContact CZ-CD1 4.26Å; F252-I363 HydrophobicContact CZ-CG2 4.35Å; V253-I363 PolarHBondContact N-O 3.39Å; I361-I363 HydrophobicContact CG2-CD1 4.19Å; I361-I363 HydrophobicContact CG2-CG1 4.01Å; I363-Y408 WeakPolarHBondContact CA-O 3.35Å; I363-Y408 HydrophobicContact CG2-CD1 4.21Å; I363-I410 HydrophobicContact CG2-CD1 3.73Å; I363-I410 HydrophobicContact CG2-CG1 4.1Å; I363-L422 HydrophobicContact CD1-CD1 3.48Å; I363-L422 VanDerWaalsContact CD1-CD1 3.48Å; I363-L422 HydrophobicContact CG2-CD1 4.46Å
364	Y	97.9	Very high	94.8	Very high	8 Å²	8	42.1 Å²	42.1	3%	0.031	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	119	179.8	175.7	-146.7	0	0	0	111.5	V253 K366 L398 L399 F406 Y408 V409 I410	V253-Y364 HydrophobicContact CG2-CD2 4.48Å; V253-Y364 WeakPolarHBondContact O-CA 3.43Å; Y364-K366 HydrophobicContact CD1-CB 4.03Å; Y364-K366 HydrophobicContact CE1-CB 3.66Å; Y364-K366 HydrophobicContact CE1-CD 4.09Å; Y364-K366 HydrophobicContact CE1-CG 3.76Å; Y364-K366 HydrophobicContact CE2-CB 4.35Å; Y364-K366 PolarHBondContact O-N 2.95Å; Y364-L398 HydrophobicContact CD2-CD1 4.32Å; Y364-L398 HydrophobicContact CE2-CB 3.75Å; Y364-L398 HydrophobicContact CE2-CD1 3.87Å; Y364-L398 HydrophobicContact CE2-CG 4.3Å; Y364-L399 WeakPolarHBondContact OH-CD2 3.31Å; Y364-F406 HydrophobicContact CD1-CD2 4.31Å; Y364-F406 HydrophobicContact CD1-CE1 4.28Å; Y364-F406 AromaticContact CD1-CE2 3.94Å; Y364-F406 HydrophobicContact CD1-CE2 3.94Å; Y364-F406 AromaticContact CD1-CZ 3.9Å; Y364-F406 HydrophobicContact CD1-CZ 3.9Å; Y364-F406 HydrophobicContact CE1-CZ 4.47Å; Y364-F406 HydrophobicContact CG-CD1 4.3Å; Y364-F406 AromaticContact CG-CE1 3.99Å; Y364-F406 HydrophobicContact CG-CE1 3.99Å; Y364-F406 HydrophobicContact CG-CE2 4.46Å; Y364-F406 HydrophobicContact CG-CZ 4.07Å; Y364-Y408 PolarHBondContact N-O 3.22Å; Y364-V409 HydrophobicContact CD1-CG1 4.02Å; Y364-V409 HydrophobicContact CD1-CG2 4.4Å; Y364-V409 WeakPolarHBondContact O-CA 3.39Å; Y364-I410 PolarHBondContact O-N 2.94Å
365	I	97.5	Very high	95.2	Very high	6 Å²	6	47.5 Å²	47.5	3%	0.031	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	109.7	168	-61.1	157.1	0	0	0	107.7	F252 V253 P255 M266 Q267 I270 I410	F252-I365 HydrophobicContact CD1-CD1 3.8Å; F252-I365 HydrophobicContact CD1-CG1 4.04Å; F252-I365 HydrophobicContact CE1-CD1 4.47Å; V253-I365 PolarHBondContact O-N 2.89Å; P255-I365 WeakPolarHBondContact CA-O 3.47Å; P255-I365 HydrophobicContact CB-CG2 4.31Å; P255-I365 WeakPolarHBondContact CB-O 3.43Å; P255-I365 HydrophobicContact CG-CG2 4.31Å; M266-I365 HydrophobicContact CE-CG2 4.12Å; Q267-I365 HydrophobicContact CG-CD1 3.71Å; I270-I365 HydrophobicContact CD1-CD1 3.72Å; I270-I365 HydrophobicContact CD1-CG1 3.9Å; I365-I410 HydrophobicContact CG1-CD1 4.25Å
366	K	96.9	Very high	95.8	Very high	67 Å²	67	42.7 Å²	42.7	29%	0.291	21%	0.206	S	C	.	.			trans	-104.1	111.6	-171.1	-179.4	-178.7	172.3	-171.1	0	111.5	Y364 T368 L399 V409 I410 D411	Y364-K366 HydrophobicContact CD1-CB 4.03Å; Y364-K366 HydrophobicContact CE1-CB 3.66Å; Y364-K366 HydrophobicContact CE1-CD 4.09Å; Y364-K366 HydrophobicContact CE1-CG 3.76Å; Y364-K366 HydrophobicContact CE2-CB 4.35Å; Y364-K366 PolarHBondContact O-N 2.95Å; K366-T368 WeakPolarHBondContact CE-OG1 3.45Å; K366-T368 PolarHBondContact O-N 2.63Å; K366-L399 HydrophobicContact CG-CD2 4.27Å; K366-V409 HydrophobicContact CB-CG1 3.82Å; K366-V409 HydrophobicContact CD-CG1 3.88Å; K366-I410 PolarHBondContact N-O 3.48Å; K366-D411 HydrophobicContact CB-CB 4.34Å; K366-D411 HydrophobicContact CD-CB 4.23Å
367	I	96.6	Very high	96.2	Very high	24 Å²	24	42.4 Å²	42.4	12%	0.123	21%	0.205	C	C	.	.			trans	-87.7	101.9	160.6	-65.4	174.6	0	0	0	108	P255 M266 S369 V372 L373 L376	P255-I367 HydrophobicContact CB-CB 4.21Å; P255-I367 HydrophobicContact CB-CD1 3.63Å; P255-I367 HydrophobicContact CB-CG1 3.64Å; P255-I367 HydrophobicContact CG-CD1 3.74Å; P255-I367 HydrophobicContact CG-CG1 4.19Å; M266-I367 HydrophobicContact CE-CD1 4.08Å; M266-I367 HydrophobicContact CE-CG1 4.31Å; M266-I367 HydrophobicContact SD-CD1 4.08Å; I367-S369 WeakPolarHBondContact CG2-O 3.42Å; I367-S369 PolarHBondContact O-N 3.4Å; I367-V372 HydrophobicContact CG2-CB 4.26Å; I367-V372 HydrophobicContact CG2-CG1 4.39Å; I367-L373 HydrophobicContact CD1-CB 4.47Å; I367-L373 HydrophobicContact CD1-CD1 4.18Å; I367-L373 HydrophobicContact CG2-CB 4.17Å; I367-L376 HydrophobicContact CD1-CD1 3.86Å
368	T	91.4	Very high	96.5	Very high	95 Å²	95	46.8 Å²	46.8	58%	0.583	22%	0.221	S	C	*	.	S	Bend	trans	-60.4	-17	-177.8	-59.3	0	0	0	0	114.2	K366	K366-T368 WeakPolarHBondContact CE-OG1 3.45Å; K366-T368 PolarHBondContact O-N 2.63Å
369	S	95.3	Very high	96.6	Very high	48 Å²	48	53 Å²	53	34%	0.336	25%	0.254	S	S	.	.			trans	-123.1	109.7	179.3	-177.4	0	0	0	0	112.7	I367 R371 V372 L373	I367-S369 WeakPolarHBondContact CG2-O 3.42Å; I367-S369 PolarHBondContact O-N 3.4Å; S369-R371 PolarHBondContact O-N 2.89Å; S369-R371 VanDerWaalsContact O-N 3.13Å; S369-R371 PolarHBondContact OG-N 2.82Å; S369-V372 WeakPolarHBondContact O-CA 3.49Å; S369-V372 WeakPolarHBondContact O-CB 3.27Å; S369-V372 PolarHBondContact O-N 3.11Å; S369-L373 PolarHBondContact O-N 2.97Å; S369-L373 VanDerWaalsContact O-N 3.11Å
370	I	96	Very high	96.7	Very high	39 Å²	39	58.1 Å²	58.1	20%	0.2	27%	0.273	C	S	.	.	H	α-helix	trans	-56.1	-27.7	171.8	-65.6	-60.7	0	0	0	112.1	L373 N374 T392 A395 E396 L399	I370-L373 HydrophobicContact CD1-CD2 4.22Å; I370-N374 WeakPolarHBondContact O-CB 3.42Å; I370-N374 PolarHBondContact O-N 2.96Å; I370-N374 PolarHBondContact O-ND2 2.95Å; I370-T392 HydrophobicContact CG2-CG2 3.54Å; I370-A395 HydrophobicContact CD1-CB 3.8Å; I370-E396 HydrophobicContact CD1-CG 3.9Å; I370-E396 HydrophobicContact CG1-CG 4.09Å; I370-L399 HydrophobicContact CD1-CD1 3.82Å; I370-L399 HydrophobicContact CG1-CD1 3.95Å
371	R	96.4	Very high	96.5	Very high	212 Å²	212	59.4 Å²	59.4	80%	0.8	29%	0.287	S	S	*	.	H	α-helix	trans	-67.3	-34.2	173	-63.5	-177.9	178.5	-178.7	-0.4	112.4	S369 R375	S369-R371 PolarHBondContact O-N 2.89Å; S369-R371 VanDerWaalsContact O-N 3.13Å; S369-R371 PolarHBondContact OG-N 2.82Å; R371-R375 WeakPolarHBondContact O-CG 3.39Å; R371-R375 PolarHBondContact O-N 2.85Å
372	V	97.2	Very high	96.4	Very high	69 Å²	69	68.7 Å²	68.7	42%	0.418	33%	0.328	S	S	.	.	H	α-helix	trans	-73.1	-46.8	174.6	174.9	0	0	0	0	110.4	I367 S369 N374 R375 L376	I367-V372 HydrophobicContact CG2-CB 4.26Å; I367-V372 HydrophobicContact CG2-CG1 4.39Å; S369-V372 WeakPolarHBondContact O-CA 3.49Å; S369-V372 WeakPolarHBondContact O-CB 3.27Å; S369-V372 PolarHBondContact O-N 3.11Å; V372-N374 VanDerWaalsContact C-N 3.28Å; V372-N374 PolarHBondContact O-N 2.84Å; V372-R375 WeakPolarHBondContact O-CA 3.45Å; V372-R375 WeakPolarHBondContact O-CB 3.42Å; V372-R375 PolarHBondContact O-N 2.98Å; V372-L376 HydrophobicContact CG1-CD1 4.34Å; V372-L376 HydrophobicContact CG1-CG 4.5Å; V372-L376 PolarHBondContact O-N 3.45Å
373	L	97.3	Very high	96.2	Very high	1 Å²	1	74 Å²	74	1%	0.005	36%	0.356	C	S	.	.	H	α-helix	trans	-53.1	-47	173.2	174.5	61.6	0	0	0	111.3	A256 V262 I367 S369 I370 R375 L376 I377 A395	A256-L373 HydrophobicContact CB-CD1 4.14Å; A256-L373 HydrophobicContact CB-CD2 4.16Å; V262-L373 HydrophobicContact CG1-CD1 4.17Å; I367-L373 HydrophobicContact CD1-CB 4.47Å; I367-L373 HydrophobicContact CD1-CD1 4.18Å; I367-L373 HydrophobicContact CG2-CB 4.17Å; S369-L373 PolarHBondContact O-N 2.97Å; S369-L373 VanDerWaalsContact O-N 3.11Å; I370-L373 HydrophobicContact CD1-CD2 4.22Å; L373-R375 VanDerWaalsContact C-N 3.28Å; L373-R375 PolarHBondContact O-N 3.42Å; L373-L376 PolarHBondContact O-N 3.36Å; L373-L376 VanDerWaalsContact O-N 3.16Å; L373-I377 HydrophobicContact CD1-CD1 3.8Å; L373-I377 HydrophobicContact CD1-CG1 4.05Å; L373-I377 HydrophobicContact CG-CD1 3.77Å; L373-I377 HydrophobicContact CG-CG1 4.44Å; L373-I377 VanDerWaalsContact O-CG1 3.31Å; L373-I377 WeakPolarHBondContact O-CG1 3.41Å; L373-I377 PolarHBondContact O-N 2.79Å; L373-A395 HydrophobicContact CD2-CB 3.4Å; L373-A395 VanDerWaalsContact CD2-CB 3.4Å
374	N	97.1	Very high	96.1	Very high	36 Å²	36	74.5 Å²	74.5	19%	0.193	36%	0.358	C	S	.	.	H	α-helix	trans	-63.2	-27.8	177.1	-93.1	-88.1	0	0	0	114.3	I370 V372 K378 T392	I370-N374 WeakPolarHBondContact O-CB 3.42Å; I370-N374 PolarHBondContact O-N 2.96Å; I370-N374 PolarHBondContact O-ND2 2.95Å; V372-N374 VanDerWaalsContact C-N 3.28Å; V372-N374 PolarHBondContact O-N 2.84Å; N374-K378 WeakPolarHBondContact O-CB 3.4Å; N374-K378 VanDerWaalsContact O-CD 3.23Å; N374-K378 WeakPolarHBondContact O-CD 3.5Å; N374-K378 WeakPolarHBondContact O-CG 3.46Å; N374-K378 PolarHBondContact O-N 3.38Å; N374-T392 PolarHBondContact ND2-OG1 3.26Å
375	R	97.1	Very high	95.9	Very high	180 Å²	180	80.5 Å²	80.5	68%	0.679	38%	0.384	S	S	*	.	H	α-helix	trans	-73.1	-46.6	171.2	-73.5	173.7	177.3	-172.7	-1.8	110.7	R371 V372 L373 I377 K378 N379	R371-R375 WeakPolarHBondContact O-CG 3.39Å; R371-R375 PolarHBondContact O-N 2.85Å; V372-R375 WeakPolarHBondContact O-CA 3.45Å; V372-R375 WeakPolarHBondContact O-CB 3.42Å; V372-R375 PolarHBondContact O-N 2.98Å; L373-R375 VanDerWaalsContact C-N 3.28Å; L373-R375 PolarHBondContact O-N 3.42Å; R375-I377 PolarHBondContact O-N 3.19Å; R375-K378 PolarHBondContact O-N 2.98Å; R375-N379 VanDerWaalsContact O-CG 3.22Å; R375-N379 PolarHBondContact O-N 2.85Å; R375-N379 PolarHBondContact O-OD1 2.76Å
376	L	97.3	Very high	95.8	Very high	66 Å²	66	88.5 Å²	88.5	35%	0.346	42%	0.419	S	S	.	.	H	α-helix	trans	-56.8	-46.7	177.4	-65.5	173.5	0	0	0	112.1	V262 I367 V372 L373 K378 N379 R380	V262-L376 HydrophobicContact CG1-CB 4.07Å; V262-L376 HydrophobicContact CG1-CD1 4.45Å; I367-L376 HydrophobicContact CD1-CD1 3.86Å; V372-L376 HydrophobicContact CG1-CD1 4.34Å; V372-L376 HydrophobicContact CG1-CG 4.5Å; V372-L376 PolarHBondContact O-N 3.45Å; L373-L376 PolarHBondContact O-N 3.36Å; L373-L376 VanDerWaalsContact O-N 3.16Å; L376-K378 PolarHBondContact O-N 2.78Å; L376-N379 PolarHBondContact O-N 2.89Å; L376-R380 PolarHBondContact O-N 3.31Å
377	I	97.5	Very high	95.8	Very high	0 Å²	0	87.5 Å²	87.5	0%	0	42%	0.416	C	S	.	.	H	α-helix	trans	-62	-43	178.2	-61.6	165.1	0	0	0	111.5	V262 L373 R375 N379 R380 Q384 A388 Q391	V262-I377 HydrophobicContact CG2-CB 4.44Å; V262-I377 HydrophobicContact CG2-CG1 3.91Å; L373-I377 HydrophobicContact CD1-CD1 3.8Å; L373-I377 HydrophobicContact CD1-CG1 4.05Å; L373-I377 HydrophobicContact CG-CD1 3.77Å; L373-I377 HydrophobicContact CG-CG1 4.44Å; L373-I377 VanDerWaalsContact O-CG1 3.31Å; L373-I377 WeakPolarHBondContact O-CG1 3.41Å; L373-I377 PolarHBondContact O-N 2.79Å; R375-I377 PolarHBondContact O-N 3.19Å; I377-N379 VanDerWaalsContact C-N 3.32Å; I377-N379 PolarHBondContact O-N 3.38Å; I377-R380 PolarHBondContact O-N 2.96Å; I377-Q384 HydrophobicContact CG2-CB 4.12Å; I377-Q384 VanDerWaalsContact CG2-O 3.26Å; I377-Q384 WeakPolarHBondContact CG2-O 3.5Å; I377-A388 HydrophobicContact CB-CB 4.46Å; I377-A388 HydrophobicContact CD1-CB 4.47Å; I377-A388 HydrophobicContact CG2-CB 3.68Å; I377-Q391 HydrophobicContact CD1-CB 3.7Å; I377-Q391 HydrophobicContact CD1-CG 4.49Å
378	K	96	Very high	95.7	Very high	111 Å²	111	86.8 Å²	86.8	48%	0.483	41%	0.414	S	S	.	.	H	α-helix	trans	-65.5	-35.2	178.1	-72.2	168.8	-168.3	178.4	0	111.9	N374 R375 L376 R380 G381 K385	N374-K378 WeakPolarHBondContact O-CB 3.4Å; N374-K378 VanDerWaalsContact O-CD 3.23Å; N374-K378 WeakPolarHBondContact O-CD 3.5Å; N374-K378 WeakPolarHBondContact O-CG 3.46Å; N374-K378 PolarHBondContact O-N 3.38Å; R375-K378 PolarHBondContact O-N 2.98Å; L376-K378 PolarHBondContact O-N 2.78Å; K378-R380 VanDerWaalsContact C-N 3.26Å; K378-R380 PolarHBondContact O-N 2.9Å; K378-G381 PolarHBondContact O-N 3.1Å; K378-G381 VanDerWaalsContact O-N 3.17Å; K378-K385 HydrophobicContact CG-CG 4.33Å
379	N	96.4	Very high	96	Very high	133 Å²	133	84.9 Å²	84.9	71%	0.711	41%	0.413	S	S	*	.	H	α-helix	trans	-69.4	-19.3	178.3	-69.8	7.8	0	0	0	113.6	R375 L376 I377 G381	R375-N379 VanDerWaalsContact O-CG 3.22Å; R375-N379 PolarHBondContact O-N 2.85Å; R375-N379 PolarHBondContact O-OD1 2.76Å; L376-N379 PolarHBondContact O-N 2.89Å; I377-N379 VanDerWaalsContact C-N 3.32Å; I377-N379 PolarHBondContact O-N 3.38Å; N379-G381 PolarHBondContact O-N 3.11Å
380	R	96	Very high	96.1	Very high	112 Å²	112	86.5 Å²	86.5	42%	0.423	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	2	171.9	-61.4	-56.5	-59	-172	-0.8	114	E261 V262 M265 L376 I377 K378 Q384	E261-R380 HydrophobicContact CB-CG 4.46Å; E261-R380 IonicContact OE2-CZ 2.78Å; E261-R380 IonicContact OE2-NE 3.24Å; E261-R380 PolarHBondContact OE2-NE 2.9Å; E261-R380 IonicContact OE2-NH2 2.64Å; E261-R380 PolarHBondContact OE2-NH2 2.88Å; V262-R380 HydrophobicContact CG2-CG 3.76Å; M265-R380 VanDerWaalsContact SD-CZ 3.55Å; M265-R380 PolarHBondContact SD-NH1 2.84Å; M265-R380 VanDerWaalsContact SD-NH1 3.41Å; L376-R380 PolarHBondContact O-N 3.31Å; I377-R380 PolarHBondContact O-N 2.96Å; K378-R380 VanDerWaalsContact C-N 3.26Å; K378-R380 PolarHBondContact O-N 2.9Å; R380-Q384 HydrophobicContact CB-CB 3.72Å; R380-Q384 HydrophobicContact CB-CG 3.56Å; R380-Q384 HydrophobicContact CG-CG 4.42Å
381	G	94.7	Very high	96.1	Very high	33 Å²	33	84.6 Å²	84.6	34%	0.34	41%	0.411	S	S	.	.			trans	90.7	-169.7	172.3	0	0	0	0	0	115.4	K378 N379 L383 Q384 K385	K378-G381 PolarHBondContact O-N 3.1Å; K378-G381 VanDerWaalsContact O-N 3.17Å; N379-G381 PolarHBondContact O-N 3.11Å; G381-L383 PolarHBondContact O-N 3.35Å; G381-Q384 PolarHBondContact O-N 2.93Å; G381-K385 WeakPolarHBondContact O-CB 3.48Å; G381-K385 PolarHBondContact O-N 3.48Å
382	K	94.1	Very high	96.2	Very high	197 Å²	197	75.2 Å²	75.2	86%	0.857	38%	0.378	S	S	*	.	H	α-helix	trans	-60.5	-41.4	-163.1	-65.8	179.7	-178.1	175.5	0	113.8	K386	K382-K386 PolarHBondContact O-N 2.87Å; K382-K386 VanDerWaalsContact O-N 3.13Å
383	L	93.4	Very high	96.1	Very high	118 Å²	118	73.9 Å²	73.9	62%	0.618	37%	0.373	S	S	*	.	H	α-helix	trans	-66.6	-47.8	-177.6	-177.7	62.8	0	0	0	111.9	G381 K386	G381-L383 PolarHBondContact O-N 3.35Å; L383-K386 WeakPolarHBondContact O-CB 3.38Å; L383-K386 PolarHBondContact O-N 3.44Å
384	Q	95.1	Very high	96.1	Very high	10 Å²	10	74.8 Å²	74.8	5%	0.047	38%	0.381	C	S	.	.	H	α-helix	trans	-66.7	-41.2	176.8	-65.7	-59.1	-28	0	0	111.5	E261 I377 R380 G381 K386 N387 A388	E261-Q384 HydrophobicContact CB-CG 4.41Å; E261-Q384 HydrophobicContact CG-CG 4.42Å; E261-Q384 VanDerWaalsContact OE1-CG 3.23Å; E261-Q384 WeakPolarHBondContact OE1-CG 3.3Å; E261-Q384 PolarHBondContact OE1-NE2 3.27Å; I377-Q384 HydrophobicContact CG2-CB 4.12Å; I377-Q384 VanDerWaalsContact CG2-O 3.26Å; I377-Q384 WeakPolarHBondContact CG2-O 3.5Å; R380-Q384 HydrophobicContact CB-CB 3.72Å; R380-Q384 HydrophobicContact CB-CG 3.56Å; R380-Q384 HydrophobicContact CG-CG 4.42Å; G381-Q384 PolarHBondContact O-N 2.93Å; Q384-K386 VanDerWaalsContact C-N 3.27Å; Q384-K386 PolarHBondContact O-N 2.8Å; Q384-N387 PolarHBondContact O-N 2.64Å; Q384-A388 PolarHBondContact O-N 2.82Å
385	K	94.8	Very high	96.1	Very high	133 Å²	133	73.2 Å²	73.2	58%	0.578	37%	0.373	S	S	*	.	H	α-helix	trans	-55.1	-37.7	174.2	-177.9	-179.9	174.8	-173.4	0	112.9	K378 G381 N387 A388	K378-K385 HydrophobicContact CG-CG 4.33Å; G381-K385 WeakPolarHBondContact O-CB 3.48Å; G381-K385 PolarHBondContact O-N 3.48Å; K385-N387 VanDerWaalsContact C-N 3.26Å; K385-N387 PolarHBondContact O-N 3.44Å; K385-A388 WeakPolarHBondContact O-CB 3.43Å; K385-A388 PolarHBondContact O-N 3.12Å
386	K	96	Very high	96.1	Very high	175 Å²	175	68.5 Å²	68.5	76%	0.761	36%	0.359	S	S	*	.	H	α-helix	trans	-59.1	-36.8	177.2	-175.1	-179	176.7	-178.4	0	112.4	K382 L383 Q384	K382-K386 PolarHBondContact O-N 2.87Å; K382-K386 VanDerWaalsContact O-N 3.13Å; L383-K386 WeakPolarHBondContact O-CB 3.38Å; L383-K386 PolarHBondContact O-N 3.44Å; Q384-K386 VanDerWaalsContact C-N 3.27Å; Q384-K386 PolarHBondContact O-N 2.8Å
387	N	95.5	Very high	96.1	Very high	46 Å²	46	71.2 Å²	71.2	25%	0.246	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	9.6	-172.6	-59.2	-32.8	0	0	0	113.2	Y260 Q384 K385 G389 V390 Q391	Y260-N387 HydrophobicContact CD1-CB 4.31Å; Y260-N387 HydrophobicContact CE1-CB 3.54Å; Q384-N387 PolarHBondContact O-N 2.64Å; K385-N387 VanDerWaalsContact C-N 3.26Å; K385-N387 PolarHBondContact O-N 3.44Å; N387-G389 VanDerWaalsContact C-N 3.31Å; N387-G389 PolarHBondContact O-N 3.26Å; N387-V390 PolarHBondContact O-N 3.45Å; N387-V390 VanDerWaalsContact O-N 3.15Å; N387-Q391 PolarHBondContact O-N 3.29Å
388	A	96.1	Very high	96.1	Very high	9 Å²	9	71.5 Å²	71.5	7%	0.074	37%	0.369	C	S	.	.	H	α-helix	trans	-60.2	-34.2	-173.6	0	0	0	0	0	114.3	I377 Q384 K385 T392	I377-A388 HydrophobicContact CB-CB 4.46Å; I377-A388 HydrophobicContact CD1-CB 4.47Å; I377-A388 HydrophobicContact CG2-CB 3.68Å; Q384-A388 PolarHBondContact O-N 2.82Å; K385-A388 WeakPolarHBondContact O-CB 3.43Å; K385-A388 PolarHBondContact O-N 3.12Å; A388-T392 VanDerWaalsContact O-CB 3.28Å; A388-T392 WeakPolarHBondContact O-CB 3.49Å; A388-T392 PolarHBondContact O-N 3.4Å; A388-T392 PolarHBondContact O-OG1 3.43Å
389	G	96.5	Very high	96	Very high	55 Å²	55	69.4 Å²	69.4	57%	0.567	36%	0.363	S	S	*	.	H	α-helix	trans	-65.1	-40.8	176.6	0	0	0	0	0	112.8	N387 T392 A393	N387-G389 VanDerWaalsContact C-N 3.31Å; N387-G389 PolarHBondContact O-N 3.26Å; G389-T392 PolarHBondContact O-N 3.27Å; G389-A393 WeakPolarHBondContact O-CB 3.33Å; G389-A393 PolarHBondContact O-N 3.43Å
390	V	97	Very high	96	Very high	81 Å²	81	70.4 Å²	70.4	49%	0.491	36%	0.363	S	S	.	.	H	α-helix	trans	-68.1	-42.6	178.5	-177.1	0	0	0	0	110.9	L257 N387 A394	L257-V390 HydrophobicContact CD2-CG1 3.81Å; N387-V390 PolarHBondContact O-N 3.45Å; N387-V390 VanDerWaalsContact O-N 3.15Å; V390-A394 PolarHBondContact O-N 3.37Å; V390-A394 VanDerWaalsContact O-N 3.13Å
391	Q	97.4	Very high	95.9	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-63.9	-40.8	174.4	-70.5	-179.2	52.3	0	0	111.9	A256 Y260 I377 N387 A394 A395	A256-Q391 HydrophobicContact CB-CB 4.07Å; Y260-Q391 HydrophobicContact CD1-CG 4.11Å; Y260-Q391 HydrophobicContact CD2-CG 4.02Å; Y260-Q391 HydrophobicContact CE1-CG 4.45Å; Y260-Q391 HydrophobicContact CE2-CG 4.41Å; Y260-Q391 HydrophobicContact CG-CG 3.85Å; I377-Q391 HydrophobicContact CD1-CB 3.7Å; I377-Q391 HydrophobicContact CD1-CG 4.49Å; N387-Q391 PolarHBondContact O-N 3.29Å; Q391-A394 PolarHBondContact O-N 3.26Å; Q391-A395 PolarHBondContact O-N 2.93Å; Q391-A395 VanDerWaalsContact O-N 3.09Å
392	T	97	Very high	95.9	Very high	15 Å²	15	67.3 Å²	67.3	9%	0.092	35%	0.354	C	S	.	.	H	α-helix	trans	-63.4	-50.4	176.7	-62.2	0	0	0	0	111.5	I370 N374 A388 G389 A394 A395 E396	I370-T392 HydrophobicContact CG2-CG2 3.54Å; N374-T392 PolarHBondContact ND2-OG1 3.26Å; A388-T392 VanDerWaalsContact O-CB 3.28Å; A388-T392 WeakPolarHBondContact O-CB 3.49Å; A388-T392 PolarHBondContact O-N 3.4Å; A388-T392 PolarHBondContact O-OG1 3.43Å; G389-T392 PolarHBondContact O-N 3.27Å; T392-A394 PolarHBondContact O-N 2.91Å; T392-A395 WeakPolarHBondContact O-CB 3.47Å; T392-A395 PolarHBondContact O-N 3.21Å; T392-E396 HydrophobicContact CG2-CG 4.29Å; T392-E396 WeakPolarHBondContact CG2-OE1 3.21Å; T392-E396 WeakPolarHBondContact O-CG 3.4Å; T392-E396 PolarHBondContact O-N 2.96Å
393	A	97	Very high	95.8	Very high	40 Å²	40	62.9 Å²	62.9	33%	0.331	35%	0.345	S	S	.	.	H	α-helix	trans	-63.7	-25.1	179.3	0	0	0	0	0	113.5	G389 K397	G389-A393 WeakPolarHBondContact O-CB 3.33Å; G389-A393 PolarHBondContact O-N 3.43Å; A393-K397 WeakPolarHBondContact O-CD 3.46Å; A393-K397 VanDerWaalsContact O-CG 3.31Å; A393-K397 WeakPolarHBondContact O-CG 3.48Å; A393-K397 PolarHBondContact O-N 3.14Å
394	A	96.9	Very high	95.7	Very high	20 Å²	20	65.9 Å²	65.9	17%	0.165	36%	0.356	C	S	.	.	H	α-helix	trans	-74.1	-42.6	170.8	0	0	0	0	0	112.1	L257 V390 Q391 T392 K397 L398	L257-A394 HydrophobicContact CB-CB 3.79Å; L257-A394 HydrophobicContact CD1-CB 4.18Å; L257-A394 HydrophobicContact CG-CB 4.47Å; V390-A394 PolarHBondContact O-N 3.37Å; V390-A394 VanDerWaalsContact O-N 3.13Å; Q391-A394 PolarHBondContact O-N 3.26Å; T392-A394 PolarHBondContact O-N 2.91Å; A394-K397 PolarHBondContact O-N 2.55Å; A394-L398 PolarHBondContact O-N 3.23Å
395	A	97.5	Very high	95.6	Very high	3 Å²	3	66.9 Å²	66.9	3%	0.025	36%	0.364	C	S	.	.	H	α-helix	trans	-64.5	-39.7	175.6	0	0	0	0	0	112.3	P255 A256 I370 L373 Q391 T392 K397 L398 L399	P255-A395 WeakPolarHBondContact O-CB 3.48Å; A256-A395 HydrophobicContact CB-CB 4.41Å; I370-A395 HydrophobicContact CD1-CB 3.8Å; L373-A395 HydrophobicContact CD2-CB 3.4Å; L373-A395 VanDerWaalsContact CD2-CB 3.4Å; Q391-A395 PolarHBondContact O-N 2.93Å; Q391-A395 VanDerWaalsContact O-N 3.09Å; T392-A395 WeakPolarHBondContact O-CB 3.47Å; T392-A395 PolarHBondContact O-N 3.21Å; A395-K397 PolarHBondContact O-N 2.92Å; A395-L398 WeakPolarHBondContact O-CB 3.35Å; A395-L398 PolarHBondContact O-N 3.32Å; A395-L398 VanDerWaalsContact O-N 3.17Å; A395-L399 WeakPolarHBondContact O-CG 3.39Å; A395-L399 PolarHBondContact O-N 3.16Å
396	E	97.1	Very high	95.7	Very high	81 Å²	81	61.6 Å²	61.6	38%	0.379	34%	0.341	S	S	.	.	H	α-helix	trans	-63.1	-39.1	176.6	-72.3	168.2	164.9	0	0	112	I370 T392 L398 L399 Q400	I370-E396 HydrophobicContact CD1-CG 3.9Å; I370-E396 HydrophobicContact CG1-CG 4.09Å; T392-E396 HydrophobicContact CG2-CG 4.29Å; T392-E396 WeakPolarHBondContact CG2-OE1 3.21Å; T392-E396 WeakPolarHBondContact O-CG 3.4Å; T392-E396 PolarHBondContact O-N 2.96Å; E396-L398 VanDerWaalsContact C-N 3.33Å; E396-L398 PolarHBondContact O-N 2.99Å; E396-L399 PolarHBondContact O-N 2.88Å; E396-Q400 VanDerWaalsContact O-CG 3.28Å; E396-Q400 WeakPolarHBondContact O-CG 3.32Å; E396-Q400 PolarHBondContact O-N 2.69Å
397	K	96.6	Very high	95.7	Very high	124 Å²	124	56 Å²	56	54%	0.539	32%	0.319	S	S	.	.	H	α-helix	trans	-64.3	-34.8	172.9	-73.6	170.9	-176.9	179.1	0	112.9	A393 A394 A395 Q400 C401	A393-K397 WeakPolarHBondContact O-CD 3.46Å; A393-K397 VanDerWaalsContact O-CG 3.31Å; A393-K397 WeakPolarHBondContact O-CG 3.48Å; A393-K397 PolarHBondContact O-N 3.14Å; A394-K397 PolarHBondContact O-N 2.55Å; A395-K397 PolarHBondContact O-N 2.92Å; K397-Q400 PolarHBondContact O-N 2.87Å; K397-C401 PolarHBondContact O-N 2.88Å; K397-C401 PolarHBondContact O-SG 3.25Å
398	L	97	Very high	95.8	Very high	5 Å²	5	56.2 Å²	56.2	3%	0.026	32%	0.317	C	S	.	.	H	α-helix	trans	-69.7	-37.4	173.1	-74	170.8	0	0	0	112.1	V253 G254 Y364 A394 A395 E396 Q400 C401 F406	V253-L398 HydrophobicContact CG2-CD2 4.41Å; G254-L398 VanDerWaalsContact CA-CD1 3.5Å; Y364-L398 HydrophobicContact CD2-CD1 4.32Å; Y364-L398 HydrophobicContact CE2-CB 3.75Å; Y364-L398 HydrophobicContact CE2-CD1 3.87Å; Y364-L398 HydrophobicContact CE2-CG 4.3Å; A394-L398 PolarHBondContact O-N 3.23Å; A395-L398 WeakPolarHBondContact O-CB 3.35Å; A395-L398 PolarHBondContact O-N 3.32Å; A395-L398 VanDerWaalsContact O-N 3.17Å; E396-L398 VanDerWaalsContact C-N 3.33Å; E396-L398 PolarHBondContact O-N 2.99Å; L398-Q400 PolarHBondContact O-N 3.3Å; L398-C401 WeakPolarHBondContact O-CB 3.33Å; L398-C401 PolarHBondContact O-N 3.44Å; L398-F406 HydrophobicContact CD2-CE1 4.19Å; L398-F406 HydrophobicContact CD2-CZ 4.24Å
399	L	95	Very high	95.8	Very high	67 Å²	67	58.1 Å²	58.1	35%	0.351	33%	0.328	S	S	.	.	H	α-helix	trans	-68.1	-21.5	173.2	-68.3	172	0	0	0	113.3	Y364 K366 I370 A395 E396	Y364-L399 WeakPolarHBondContact OH-CD2 3.31Å; K366-L399 HydrophobicContact CG-CD2 4.27Å; I370-L399 HydrophobicContact CD1-CD1 3.82Å; I370-L399 HydrophobicContact CG1-CD1 3.95Å; A395-L399 WeakPolarHBondContact O-CG 3.39Å; A395-L399 PolarHBondContact O-N 3.16Å; E396-L399 PolarHBondContact O-N 2.88Å
400	Q	94.5	Very high	95.8	Very high	154 Å²	154	55.7 Å²	55.7	72%	0.72	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-6	174.2	-71.4	167	2.8	0	0	113.9	E396 K397 L398	E396-Q400 VanDerWaalsContact O-CG 3.28Å; E396-Q400 WeakPolarHBondContact O-CG 3.32Å; E396-Q400 PolarHBondContact O-N 2.69Å; K397-Q400 PolarHBondContact O-N 2.87Å; L398-Q400 PolarHBondContact O-N 3.3Å
401	C	95.2	Very high	95.8	Very high	24 Å²	24	56 Å²	56	16%	0.162	30%	0.301	C	S	.	.	S	Bend	trans	-72.3	144.2	177.5	-69.2	0	0	0	0	111.6	H349 K397 L398 F406	H349-C401 PolarHBondContact CE1-SG 3.45Å; K397-C401 PolarHBondContact O-N 2.88Å; K397-C401 PolarHBondContact O-SG 3.25Å; L398-C401 WeakPolarHBondContact O-CB 3.33Å; L398-C401 PolarHBondContact O-N 3.44Å; C401-F406 HydrophobicContact CB-CE2 3.63Å; C401-F406 HydrophobicContact CB-CZ 3.55Å
402	S	94.4	Very high	95.7	Very high	57 Å²	57	58.6 Å²	58.6	40%	0.399	31%	0.313	S	S	.	.			trans	-58.1	138.9	166.2	175.3	0	0	0	0	109.7	E404 S405	S402-E404 PolarHBondContact O-N 2.98Å; S402-E404 VanDerWaalsContact O-N 3.13Å; S402-E404 PolarHBondContact OG-N 3.13Å; S402-S405 WeakPolarHBondContact O-CB 3.32Å; S402-S405 PolarHBondContact O-N 3.09Å; S402-S405 PolarHBondContact O-OG 3.21Å
403	P	91.2	Very high	95.6	Very high	103 Å²	103	64.9 Å²	64.9	67%	0.669	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-52.1	-33.4	174.5	-28	36.1	0	0	0	113.5	S405 F406	P403-S405 PolarHBondContact O-N 3.23Å; P403-F406 PolarHBondContact O-N 2.84Å
404	E	91.9	Very high	95.5	Very high	181 Å²	181	67.5 Å²	67.5	85%	0.846	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-64.4	-8.3	176.5	-55.6	179.5	155.2	0	0	114.3	S402 F406	S402-E404 PolarHBondContact O-N 2.98Å; S402-E404 VanDerWaalsContact O-N 3.13Å; S402-E404 PolarHBondContact OG-N 3.13Å; E404-F406 PolarHBondContact O-N 3.17Å
405	S	93.3	Very high	95.5	Very high	31 Å²	31	70.9 Å²	70.9	22%	0.217	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-76.5	-7.6	175.6	-42	0	0	0	0	112.7	P350 S402 P403	P350-S405 WeakPolarHBondContact CB-O 3.3Å; S402-S405 WeakPolarHBondContact O-CB 3.32Å; S402-S405 PolarHBondContact O-N 3.09Å; S402-S405 PolarHBondContact O-OG 3.21Å; P403-S405 PolarHBondContact O-N 3.23Å
406	F	96.2	Very high	95.5	Very high	22 Å²	22	74.9 Å²	74.9	10%	0.096	40%	0.397	C	S	.	.			trans	-131.1	141.3	-173.9	-45.6	-75.4	0	0	0	110.2	V253 P350 V362 Y364 L398 C401 P403 E404 V409	V253-F406 HydrophobicContact CG2-CD1 4.17Å; V253-F406 HydrophobicContact CG2-CE1 3.93Å; P350-F406 HydrophobicContact CB-CE1 4.49Å; P350-F406 HydrophobicContact CG-CD1 4.18Å; P350-F406 HydrophobicContact CG-CE1 3.66Å; P350-F406 HydrophobicContact CG-CZ 4.17Å; V362-F406 HydrophobicContact CG1-CD1 4.21Å; Y364-F406 HydrophobicContact CD1-CD2 4.31Å; Y364-F406 HydrophobicContact CD1-CE1 4.28Å; Y364-F406 AromaticContact CD1-CE2 3.94Å; Y364-F406 HydrophobicContact CD1-CE2 3.94Å; Y364-F406 AromaticContact CD1-CZ 3.9Å; Y364-F406 HydrophobicContact CD1-CZ 3.9Å; Y364-F406 HydrophobicContact CE1-CZ 4.47Å; Y364-F406 HydrophobicContact CG-CD1 4.3Å; Y364-F406 AromaticContact CG-CE1 3.99Å; Y364-F406 HydrophobicContact CG-CE1 3.99Å; Y364-F406 HydrophobicContact CG-CE2 4.46Å; Y364-F406 HydrophobicContact CG-CZ 4.07Å; L398-F406 HydrophobicContact CD2-CE1 4.19Å; L398-F406 HydrophobicContact CD2-CZ 4.24Å; C401-F406 HydrophobicContact CB-CE2 3.63Å; C401-F406 HydrophobicContact CB-CZ 3.55Å; P403-F406 PolarHBondContact O-N 2.84Å; E404-F406 PolarHBondContact O-N 3.17Å; F406-V409 HydrophobicContact CB-CG2 4.3Å; F406-V409 HydrophobicContact CD2-CG2 4.45Å
407	D	96.3	Very high	95.5	Very high	59 Å²	59	74 Å²	74	32%	0.316	40%	0.397	S	S	.	.	S	Bend	trans	-78.2	-29.5	172.4	-67.5	-104.8	0	0	0	111.7	R248 I361 V362 F425	R248-D407 IonicContact CZ-OD1 3.04Å; R248-D407 VanDerWaalsContact CZ-OD1 3.23Å; R248-D407 IonicContact NH1-OD1 2.62Å; R248-D407 PolarHBondContact NH1-OD1 3.1Å; R248-D407 VanDerWaalsContact NH2-CG 3.31Å; R248-D407 IonicContact NH2-OD1 2.72Å; R248-D407 PolarHBondContact NH2-OD1 3.34Å; R248-D407 IonicContact NH2-OD2 2.69Å; R248-D407 PolarHBondContact NH2-OD2 3.39Å; R248-D407 VanDerWaalsContact NH2-OD2 3.17Å; I361-D407 WeakPolarHBondContact CA-OD2 3.31Å; I361-D407 HydrophobicContact CG2-CB 3.9Å; V362-D407 PolarHBondContact N-OD2 3.05Å; V362-D407 PolarHBondContact O-N 2.9Å; D407-F425 HydrophobicContact CB-CZ 4.15Å
408	Y	97.3	Very high	95.5	Very high	49 Å²	49	68.3 Å²	68.3	19%	0.192	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	149.7	179.3	-164.7	-102.1	0	0	0	112.2	V362 I363 Y364 I410 A421 L422 F425	V362-Y408 PolarHBondContact O-N 3.28Å; I363-Y408 WeakPolarHBondContact CA-O 3.35Å; I363-Y408 HydrophobicContact CG2-CD1 4.21Å; Y364-Y408 PolarHBondContact N-O 3.22Å; Y408-I410 HydrophobicContact CD1-CG1 3.9Å; Y408-I410 HydrophobicContact CE1-CG1 3.79Å; Y408-A421 VanDerWaalsContact OH-CB 3.31Å; Y408-A421 WeakPolarHBondContact OH-CB 3.38Å; Y408-A421 PolarHBondContact OH-O 3.33Å; Y408-L422 HydrophobicContact CD1-CD1 4.3Å; Y408-L422 HydrophobicContact CE1-CB 4.5Å; Y408-F425 HydrophobicContact CD2-CB 3.87Å; Y408-F425 HydrophobicContact CD2-CD1 4.04Å; Y408-F425 AromaticContact CD2-CD2 3.52Å; Y408-F425 HydrophobicContact CD2-CD2 3.52Å; Y408-F425 HydrophobicContact CD2-CE2 4.03Å; Y408-F425 AromaticContact CD2-CG 3.52Å; Y408-F425 HydrophobicContact CD2-CG 3.52Å; Y408-F425 HydrophobicContact CE2-CB 3.75Å; Y408-F425 HydrophobicContact CE2-CD2 4.09Å; Y408-F425 AromaticContact CE2-CG 3.96Å; Y408-F425 HydrophobicContact CE2-CG 3.96Å; Y408-F425 HydrophobicContact CG-CB 4.47Å; Y408-F425 HydrophobicContact CG-CD1 4.04Å; Y408-F425 HydrophobicContact CG-CD2 4.28Å; Y408-F425 HydrophobicContact CG-CE1 4.35Å; Y408-F425 HydrophobicContact CG-CG 4Å
409	V	97.2	Very high	95.5	Very high	50 Å²	50	69 Å²	69	30%	0.303	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	122.5	178.2	-175.9	0	0	0	0	110.1	Y364 K366 F406	Y364-V409 HydrophobicContact CD1-CG1 4.02Å; Y364-V409 HydrophobicContact CD1-CG2 4.4Å; Y364-V409 WeakPolarHBondContact O-CA 3.39Å; K366-V409 HydrophobicContact CB-CG1 3.82Å; K366-V409 HydrophobicContact CD-CG1 3.88Å; F406-V409 HydrophobicContact CB-CG2 4.3Å; F406-V409 HydrophobicContact CD2-CG2 4.45Å
410	I	96.9	Very high	95.6	Very high	4 Å²	4	72 Å²	72	2%	0.021	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	103.5	174.2	-62.2	170.2	0	0	0	107.2	F252 I270 I363 Y364 I365 K366 Y408 A418 L422	F252-I410 HydrophobicContact CE1-CD1 3.9Å; I270-I410 HydrophobicContact CD1-CD1 4.3Å; I363-I410 HydrophobicContact CG2-CD1 3.73Å; I363-I410 HydrophobicContact CG2-CG1 4.1Å; Y364-I410 PolarHBondContact O-N 2.94Å; I365-I410 HydrophobicContact CG1-CD1 4.25Å; K366-I410 PolarHBondContact N-O 3.48Å; Y408-I410 HydrophobicContact CD1-CG1 3.9Å; Y408-I410 HydrophobicContact CE1-CG1 3.79Å; I410-A418 HydrophobicContact CG2-CB 3.61Å; I410-L422 HydrophobicContact CD1-CB 4.48Å; I410-L422 HydrophobicContact CD1-CD2 4.08Å
411	D	95.7	Very high	95.7	Very high	87 Å²	87	66.1 Å²	66.1	47%	0.465	37%	0.367	S	S	.	.			trans	-110.3	3.8	176.3	70	-6.5	0	0	0	113.6	K366	K366-D411 HydrophobicContact CB-CB 4.34Å; K366-D411 HydrophobicContact CD-CB 4.23Å
412	Q	95.9	Very high	95.8	Very high	54 Å²	54	65 Å²	65	25%	0.252	36%	0.36	S	S	.	.			trans	-76.7	135.3	-177	-52.6	81	38.6	0	0	110.8	T417 A418	Q412-T417 HydrophobicContact CG-CG2 4.34Å; Q412-A418 HydrophobicContact CB-CB 4.21Å
413	N	94.4	Very high	95.9	Very high	148 Å²	148	62.4 Å²	62.4	79%	0.791	34%	0.342	S	S	*	.	S	Bend	trans	-79.8	-16.9	-176.1	61.7	-13.3	0	0	0	114.5
414	N	95.8	Very high	96.2	Very high	95 Å²	95	63.9 Å²	63.9	51%	0.508	34%	0.339	S	S	.	.	S	Bend	trans	-108.3	129	-177.8	-67.9	-34.3	0	0	0	110.7	S416 T417 A418	N414-S416 VanDerWaalsContact C-N 3.33Å; N414-S416 PolarHBondContact O-N 2.89Å; N414-T417 PolarHBondContact O-N 2.64Å; N414-A418 WeakPolarHBondContact O-CB 3.46Å; N414-A418 PolarHBondContact O-N 3.08Å
415	L	95.7	Very high	96.5	Very high	91 Å²	91	58 Å²	58	48%	0.476	31%	0.311	S	S	.	.	H	α-helix	trans	-54.8	-45	-177.1	-179.4	64	0	0	0	112.7	A269 I270 T417 A418 T419	A269-L415 HydrophobicContact CB-CD1 4.17Å; A269-L415 HydrophobicContact CB-CD2 4.12Å; I270-L415 HydrophobicContact CG1-CD1 3.79Å; L415-T417 PolarHBondContact O-N 2.9Å; L415-A418 PolarHBondContact O-N 3.46Å; L415-T419 HydrophobicContact CD1-CG2 3.86Å; L415-T419 HydrophobicContact CG-CG2 4.29Å; L415-T419 WeakPolarHBondContact O-CG2 3.23Å; L415-T419 PolarHBondContact O-N 3.14Å; L415-T419 PolarHBondContact O-OG1 2.86Å
416	S	96.9	Very high	96.7	Very high	86 Å²	86	56.8 Å²	56.8	60%	0.601	30%	0.302	S	S	*	.	H	α-helix	trans	-55.9	-54	-179.9	-164.7	0	0	0	0	111.6	N414 A418 T419 E420	N414-S416 VanDerWaalsContact C-N 3.33Å; N414-S416 PolarHBondContact O-N 2.89Å; S416-A418 PolarHBondContact O-N 3.31Å; S416-T419 PolarHBondContact O-N 3.47Å; S416-T419 PolarHBondContact O-OG1 3.06Å; S416-E420 WeakPolarHBondContact O-CB 3.43Å; S416-E420 PolarHBondContact O-N 3.19Å
417	T	97.2	Very high	96.7	Very high	63 Å²	63	58.7 Å²	58.7	39%	0.387	31%	0.312	S	S	.	.	H	α-helix	trans	-65.7	-37.8	-178.8	-43	0	0	0	0	112.2	Q412 N414 L415 A421	Q412-T417 HydrophobicContact CG-CG2 4.34Å; N414-T417 PolarHBondContact O-N 2.64Å; L415-T417 PolarHBondContact O-N 2.9Å; T417-A421 VanDerWaalsContact O-CB 3.32Å; T417-A421 WeakPolarHBondContact O-CB 3.35Å; T417-A421 PolarHBondContact O-N 3.26Å
418	A	97.2	Very high	96.7	Very high	4 Å²	4	57.3 Å²	57.3	3%	0.033	31%	0.311	C	S	.	.	H	α-helix	trans	-60.6	-44.6	172.6	0	0	0	0	0	112	I410 Q412 N414 L415 S416 L422	I410-A418 HydrophobicContact CG2-CB 3.61Å; Q412-A418 HydrophobicContact CB-CB 4.21Å; N414-A418 WeakPolarHBondContact O-CB 3.46Å; N414-A418 PolarHBondContact O-N 3.08Å; L415-A418 PolarHBondContact O-N 3.46Å; S416-A418 PolarHBondContact O-N 3.31Å; A418-L422 WeakPolarHBondContact O-CB 3.47Å; A418-L422 PolarHBondContact O-N 3.08Å; A418-L422 VanDerWaalsContact O-N 3.12Å
419	T	97.3	Very high	96.8	Very high	21 Å²	21	56.3 Å²	56.3	13%	0.129	31%	0.307	C	S	.	.	H	α-helix	trans	-73.1	-35.7	179.7	55.1	0	0	0	0	112.8	A273 M274 L415 S416 S423	A273-T419 HydrophobicContact CB-CG2 3.51Å; M274-T419 HydrophobicContact CE-CG2 4.16Å; M274-T419 WeakPolarHBondContact CE-O 3.2Å; L415-T419 HydrophobicContact CD1-CG2 3.86Å; L415-T419 HydrophobicContact CG-CG2 4.29Å; L415-T419 WeakPolarHBondContact O-CG2 3.23Å; L415-T419 PolarHBondContact O-N 3.14Å; L415-T419 PolarHBondContact O-OG1 2.86Å; S416-T419 PolarHBondContact O-N 3.47Å; S416-T419 PolarHBondContact O-OG1 3.06Å; T419-S423 WeakPolarHBondContact O-CB 3.46Å; T419-S423 PolarHBondContact O-N 2.88Å; T419-S423 PolarHBondContact O-OG 3.31Å
420	E	97.1	Very high	96.8	Very high	129 Å²	129	56.4 Å²	56.4	60%	0.603	30%	0.302	S	S	*	.	H	α-helix	trans	-65.4	-48.4	176.8	-179.2	-179.7	-171.6	0	0	111.7	S416 L422 S423 H424	S416-E420 WeakPolarHBondContact O-CB 3.43Å; S416-E420 PolarHBondContact O-N 3.19Å; E420-L422 PolarHBondContact O-N 3.25Å; E420-S423 PolarHBondContact O-N 2.97Å; E420-H424 PolarHBondContact O-N 2.83Å
421	A	96.1	Very high	96.7	Very high	30 Å²	30	58 Å²	58	25%	0.248	32%	0.316	C	S	.	.	H	α-helix	trans	-65.5	-38.5	178.2	0	0	0	0	0	112	Y408 T417 F425	Y408-A421 VanDerWaalsContact OH-CB 3.31Å; Y408-A421 WeakPolarHBondContact OH-CB 3.38Å; Y408-A421 PolarHBondContact OH-O 3.33Å; T417-A421 VanDerWaalsContact O-CB 3.32Å; T417-A421 WeakPolarHBondContact O-CB 3.35Å; T417-A421 PolarHBondContact O-N 3.26Å; A421-F425 PolarHBondContact O-N 3.06Å
422	L	97.7	Very high	96.7	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.5	-44.5	172.1	173.4	62.2	0	0	0	112.4	F252 I270 M274 I363 Y408 I410 A418 E420 H424 F425 L426	F252-L422 HydrophobicContact CE1-CD2 4.15Å; F252-L422 HydrophobicContact CZ-CD2 3.76Å; I270-L422 HydrophobicContact CG2-CD2 3.71Å; M274-L422 HydrophobicContact CE-CB 4.46Å; M274-L422 HydrophobicContact CE-CD2 3.91Å; M274-L422 HydrophobicContact CE-CG 4.19Å; M274-L422 HydrophobicContact CG-CD2 3.66Å; M274-L422 HydrophobicContact SD-CD2 3.4Å; M274-L422 WeakPolarHBondContact SD-CD2 3.43Å; M274-L422 HydrophobicContact SD-CG 3.65Å; I363-L422 HydrophobicContact CD1-CD1 3.48Å; I363-L422 VanDerWaalsContact CD1-CD1 3.48Å; I363-L422 HydrophobicContact CG2-CD1 4.46Å; Y408-L422 HydrophobicContact CD1-CD1 4.3Å; Y408-L422 HydrophobicContact CE1-CB 4.5Å; I410-L422 HydrophobicContact CD1-CB 4.48Å; I410-L422 HydrophobicContact CD1-CD2 4.08Å; A418-L422 WeakPolarHBondContact O-CB 3.47Å; A418-L422 PolarHBondContact O-N 3.08Å; A418-L422 VanDerWaalsContact O-N 3.12Å; E420-L422 PolarHBondContact O-N 3.25Å; L422-H424 VanDerWaalsContact C-N 3.33Å; L422-H424 PolarHBondContact O-N 2.84Å; L422-F425 HydrophobicContact CD1-CD1 4.48Å; L422-F425 WeakPolarHBondContact O-CB 3.49Å; L422-F425 PolarHBondContact O-N 3.46Å; L422-L426 HydrophobicContact CD1-CD1 3.97Å; L422-L426 HydrophobicContact CD1-CG 4.03Å; L422-L426 HydrophobicContact CG-CD1 4.11Å; L422-L426 PolarHBondContact O-N 2.91Å
423	S	97.4	Very high	96.8	Very high	4 Å²	4	52 Å²	52	3%	0.028	29%	0.287	C	S	.	.	H	α-helix	trans	-57.8	-45.9	176	-81.7	0	0	0	0	111.4	M274 H277 T419 E420 F425 L426 E427	M274-S423 WeakPolarHBondContact CE-OG 3.47Å; H277-S423 PolarHBondContact CD2-OG 3.39Å; H277-S423 PolarHBondContact CE1-OG 3.27Å; H277-S423 PolarHBondContact ND1-OG 2.93Å; H277-S423 WeakPolarHBondContact NE2-CB 3.24Å; H277-S423 PolarHBondContact NE2-OG 2.7Å; H277-S423 VanDerWaalsContact NE2-OG 3.1Å; T419-S423 WeakPolarHBondContact O-CB 3.46Å; T419-S423 PolarHBondContact O-N 2.88Å; T419-S423 PolarHBondContact O-OG 3.31Å; E420-S423 PolarHBondContact O-N 2.97Å; S423-F425 VanDerWaalsContact C-N 3.29Å; S423-F425 PolarHBondContact O-N 2.83Å; S423-L426 PolarHBondContact O-N 2.97Å; S423-L426 VanDerWaalsContact O-N 3.17Å; S423-E427 WeakPolarHBondContact O-CG 3.27Å; S423-E427 PolarHBondContact O-N 3.41Å
424	H	97.2	Very high	96.8	Very high	133 Å²	133	47.7 Å²	47.7	62%	0.616	26%	0.262	S	S	*	.	H	α-helix	trans	-59.8	-38.8	177.3	-176.1	-77.6	0	0	0	112.4	E420 L422 G428	E420-H424 PolarHBondContact O-N 2.83Å; L422-H424 VanDerWaalsContact C-N 3.33Å; L422-H424 PolarHBondContact O-N 2.84Å; H424-G428 PolarHBondContact O-N 2.92Å; H424-G428 VanDerWaalsContact O-N 3.13Å
425	F	97.8	Very high	96.4	Very high	58 Å²	58	45.3 Å²	45.3	25%	0.254	25%	0.252	S	S	.	.	H	α-helix	trans	-64.7	-45.4	173.7	171.3	-99.9	0	0	0	112.3	I361 D407 Y408 A421 L422 S423 G428 Y429	I361-F425 HydrophobicContact CG2-CE1 3.9Å; I361-F425 HydrophobicContact CG2-CZ 4.3Å; D407-F425 HydrophobicContact CB-CZ 4.15Å; Y408-F425 HydrophobicContact CD2-CB 3.87Å; Y408-F425 HydrophobicContact CD2-CD1 4.04Å; Y408-F425 AromaticContact CD2-CD2 3.52Å; Y408-F425 HydrophobicContact CD2-CD2 3.52Å; Y408-F425 HydrophobicContact CD2-CE2 4.03Å; Y408-F425 AromaticContact CD2-CG 3.52Å; Y408-F425 HydrophobicContact CD2-CG 3.52Å; Y408-F425 HydrophobicContact CE2-CB 3.75Å; Y408-F425 HydrophobicContact CE2-CD2 4.09Å; Y408-F425 AromaticContact CE2-CG 3.96Å; Y408-F425 HydrophobicContact CE2-CG 3.96Å; Y408-F425 HydrophobicContact CG-CB 4.47Å; Y408-F425 HydrophobicContact CG-CD1 4.04Å; Y408-F425 HydrophobicContact CG-CD2 4.28Å; Y408-F425 HydrophobicContact CG-CE1 4.35Å; Y408-F425 HydrophobicContact CG-CG 4Å; A421-F425 PolarHBondContact O-N 3.06Å; L422-F425 HydrophobicContact CD1-CD1 4.48Å; L422-F425 WeakPolarHBondContact O-CB 3.49Å; L422-F425 PolarHBondContact O-N 3.46Å; S423-F425 VanDerWaalsContact C-N 3.29Å; S423-F425 PolarHBondContact O-N 2.83Å; F425-G428 PolarHBondContact O-N 3.08Å; F425-Y429 PolarHBondContact O-N 3.46Å
426	L	97.8	Very high	95.6	Very high	6 Å²	6	46.6 Å²	46.6	3%	0.031	27%	0.266	C	S	.	.	H	α-helix	trans	-71.1	-30.9	-179.8	-68	178.1	0	0	0	113.3	V250 M274 F278 L339 L422 S423 Y429 W430	V250-L426 HydrophobicContact CG2-CD2 4.03Å; M274-L426 HydrophobicContact SD-CD1 3.89Å; F278-L426 HydrophobicContact CE1-CB 4.36Å; F278-L426 HydrophobicContact CE2-CB 4.07Å; F278-L426 HydrophobicContact CE2-CD1 4.05Å; F278-L426 HydrophobicContact CZ-CB 3.66Å; F278-L426 HydrophobicContact CZ-CD1 4.49Å; L339-L426 HydrophobicContact CD1-CB 4.47Å; L422-L426 HydrophobicContact CD1-CD1 3.97Å; L422-L426 HydrophobicContact CD1-CG 4.03Å; L422-L426 HydrophobicContact CG-CD1 4.11Å; L422-L426 PolarHBondContact O-N 2.91Å; S423-L426 PolarHBondContact O-N 2.97Å; S423-L426 VanDerWaalsContact O-N 3.17Å; L426-Y429 PolarHBondContact O-N 3.31Å; L426-W430 WeakPolarHBondContact O-CB 3.45Å; L426-W430 PolarHBondContact O-N 3.4Å
427	E	96.8	Very high	94.2	Very high	62 Å²	62	47.4 Å²	47.4	29%	0.29	26%	0.263	S	S	.	.	H	α-helix	trans	-67.6	-36.2	169.3	-70.3	-69.9	-167.1	0	0	111.9	F278 R281 S423 Y429 W430 A431	F278-E427 HydrophobicContact CE1-CG 3.89Å; F278-E427 HydrophobicContact CZ-CG 4.1Å; R281-E427 IonicContact CZ-OE1 3.72Å; R281-E427 VanDerWaalsContact CZ-OE1 3.32Å; R281-E427 IonicContact CZ-OE2 3.96Å; R281-E427 VanDerWaalsContact NH1-CD 3.3Å; R281-E427 IonicContact NH1-OE1 2.8Å; R281-E427 PolarHBondContact NH1-OE1 3.11Å; R281-E427 IonicContact NH1-OE2 3.96Å; R281-E427 PolarHBondContact NH1-OE2 2.78Å; R281-E427 IonicContact NH2-OE1 3.06Å; R281-E427 PolarHBondContact NH2-OE1 2.86Å; R281-E427 IonicContact NH2-OE2 3.92Å; S423-E427 WeakPolarHBondContact O-CG 3.27Å; S423-E427 PolarHBondContact O-N 3.41Å; E427-Y429 VanDerWaalsContact C-N 3.32Å; E427-Y429 PolarHBondContact O-N 3.47Å; E427-W430 WeakPolarHBondContact O-CB 3.5Å; E427-W430 PolarHBondContact O-N 3.41Å; E427-A431 WeakPolarHBondContact O-CB 3.41Å; E427-A431 PolarHBondContact O-N 3.32Å
428	G	96.2	Very high	92.3	Very high	29 Å²	29	52 Å²	52	30%	0.299	28%	0.283	S	S	.	.	H	α-helix	trans	-60.6	-40.4	170.5	0	0	0	0	0	112.5	H424 F425 A432	H424-G428 PolarHBondContact O-N 2.92Å; H424-G428 VanDerWaalsContact O-N 3.13Å; F425-G428 PolarHBondContact O-N 3.08Å; G428-A432 PolarHBondContact O-N 3.1Å
429	Y	97.8	Very high	90.1	Very high	28 Å²	28	53.6 Å²	53.6	11%	0.11	29%	0.293	C	S	.	.	H	α-helix	trans	-68.2	-41.6	172.5	179.4	-118.1	0	0	0	112.4	V91 M247 R248 L339 I361 F425 L426 E427 A431 A432 T433	V91-Y429 HydrophobicContact CG1-CE2 4.33Å; M247-Y429 HydrophobicContact CE-CE1 4.05Å; R248-Y429 PolarHBondContact N-OH 3.24Å; L339-Y429 HydrophobicContact CD2-CD1 3.94Å; L339-Y429 HydrophobicContact CD2-CE1 4.35Å; I361-Y429 HydrophobicContact CD1-CD1 3.58Å; I361-Y429 HydrophobicContact CD1-CD2 4.11Å; I361-Y429 HydrophobicContact CD1-CE1 3.57Å; I361-Y429 HydrophobicContact CD1-CE2 4.13Å; I361-Y429 HydrophobicContact CD1-CG 3.87Å; F425-Y429 PolarHBondContact O-N 3.46Å; L426-Y429 PolarHBondContact O-N 3.31Å; E427-Y429 VanDerWaalsContact C-N 3.32Å; E427-Y429 PolarHBondContact O-N 3.47Å; Y429-A431 PolarHBondContact O-N 2.71Å; Y429-A432 WeakPolarHBondContact O-CB 3.21Å; Y429-A432 PolarHBondContact O-N 2.82Å; Y429-A432 VanDerWaalsContact O-N 3.08Å; Y429-T433 HydrophobicContact CD2-CG2 4.37Å; Y429-T433 HydrophobicContact CE1-CG2 4.24Å; Y429-T433 HydrophobicContact CE2-CG2 3.68Å; Y429-T433 PolarHBondContact O-N 3.08Å; Y429-T433 VanDerWaalsContact O-N 3.08Å; Y429-T433 PolarHBondContact O-OG1 3.09Å
430	W	97.1	Very high	87.8	Confident	52 Å²	52	55 Å²	55	20%	0.197	30%	0.303	C	S	.	.	H	α-helix	trans	-58.4	-45.5	175.8	-178.2	-93.6	0	0	0	112	M247 R281 L339 L426 E427 A432 T433 H434	M247-W430 HydrophobicContact CE-CE3 4.18Å; M247-W430 HydrophobicContact CE-CZ3 4.31Å; R281-W430 HydrophobicContact CB-CH2 3.97Å; R281-W430 HydrophobicContact CB-CZ3 4.04Å; R281-W430 HydrophobicContact CG-CH2 3.88Å; R281-W430 HydrophobicContact CG-CZ2 4.06Å; R281-W430 HydrophobicContact CG-CZ3 4.42Å; L339-W430 HydrophobicContact CD2-CE3 4.2Å; L339-W430 HydrophobicContact CG-CE3 3.89Å; L339-W430 HydrophobicContact CG-CZ3 4.26Å; L426-W430 WeakPolarHBondContact O-CB 3.45Å; L426-W430 PolarHBondContact O-N 3.4Å; E427-W430 WeakPolarHBondContact O-CB 3.5Å; E427-W430 PolarHBondContact O-N 3.41Å; W430-A432 VanDerWaalsContact C-N 3.27Å; W430-A432 PolarHBondContact O-N 3.39Å; W430-T433 PolarHBondContact O-N 3.07Å; W430-T433 PolarHBondContact O-OG1 3.49Å; W430-T433 VanDerWaalsContact O-OG1 3.09Å; W430-H434 AromaticContact CD2-CE1 3.86Å; W430-H434 AromaticContact CD2-ND1 3.51Å; W430-H434 AromaticContact CE2-CE1 3.87Å; W430-H434 AromaticContact CE2-CG 3.96Å; W430-H434 AromaticContact CE2-ND1 3.54Å; W430-H434 AromaticContact CE3-CE1 3.7Å; W430-H434 AromaticContact CE3-ND1 3.8Å; W430-H434 AromaticContact CG-ND1 3.98Å; W430-H434 AromaticContact CH2-CE1 3.58Å; W430-H434 AromaticContact CH2-NE2 3.93Å; W430-H434 AromaticContact CZ2-CE1 3.74Å; W430-H434 AromaticContact CZ2-ND1 3.85Å; W430-H434 AromaticContact CZ3-CE1 3.58Å; W430-H434 AromaticContact NE1-ND1 3.99Å; W430-H434 WeakPolarHBondContact O-CB 3.25Å; W430-H434 PolarHBondContact O-N 2.84Å; W430-H434 PolarHBondContact O-ND1 3.1Å; W430-H434 VanDerWaalsContact O-ND1 3.17Å
431	A	96	Very high	85.4	Confident	39 Å²	39	56.8 Å²	56.8	32%	0.322	31%	0.309	S	S	.	.	H	α-helix	trans	-68.1	-23	175.7	0	0	0	0	0	113.5	I93 E427 Y429	I93-A431 HydrophobicContact CD1-CB 4.11Å; I93-A431 HydrophobicContact CG1-CB 4.17Å; E427-A431 WeakPolarHBondContact O-CB 3.41Å; E427-A431 PolarHBondContact O-N 3.32Å; Y429-A431 PolarHBondContact O-N 2.71Å
432	A	96.2	Very high	83.4	Confident	10 Å²	10	58.1 Å²	58.1	8%	0.083	32%	0.32	C	S	.	.	H	α-helix	trans	-75.9	-35.6	173.4	0	0	0	0	0	112.3	R89 V91 I93 G428 Y429 W430	R89-A432 PolarHBondContact NH1-O 2.63Å; V91-A432 HydrophobicContact CG1-CB 4.32Å; I93-A432 HydrophobicContact CG1-CB 4.08Å; G428-A432 PolarHBondContact O-N 3.1Å; Y429-A432 WeakPolarHBondContact O-CB 3.21Å; Y429-A432 PolarHBondContact O-N 2.82Å; Y429-A432 VanDerWaalsContact O-N 3.08Å; W430-A432 VanDerWaalsContact C-N 3.27Å; W430-A432 PolarHBondContact O-N 3.39Å
433	T	96.4	Very high	81.3	Confident	3 Å²	3	62.2 Å²	62.2	2%	0.018	34%	0.339	C	S	.	.	H	α-helix	trans	-85.8	-28.7	177.6	53.3	0	0	0	0	113.7	V91 M247 Y429 W430 P435	V91-T433 HydrophobicContact CG1-CG2 3.45Å; V91-T433 VanDerWaalsContact CG1-CG2 3.45Å; M247-T433 HydrophobicContact CE-CG2 4.48Å; M247-T433 HydrophobicContact SD-CG2 3.61Å; M247-T433 PolarHBondContact SD-OG1 2.7Å; Y429-T433 HydrophobicContact CD2-CG2 4.37Å; Y429-T433 HydrophobicContact CE1-CG2 4.24Å; Y429-T433 HydrophobicContact CE2-CG2 3.68Å; Y429-T433 PolarHBondContact O-N 3.08Å; Y429-T433 VanDerWaalsContact O-N 3.08Å; Y429-T433 PolarHBondContact O-OG1 3.09Å; W430-T433 PolarHBondContact O-N 3.07Å; W430-T433 PolarHBondContact O-OG1 3.49Å; W430-T433 VanDerWaalsContact O-OG1 3.09Å; T433-P435 WeakPolarHBondContact O-CD 3.44Å
434	H	94.7	Very high	79.3	Confident	58 Å²	58	70.4 Å²	70.4	27%	0.269	37%	0.369	S	S	.	.	S	Bend	trans	-111.1	81.1	179.2	-61.1	87.2	0	0	0	110.9	M337 W430	M337-H434 PolarHBondContact O-CE1 2.88Å; M337-H434 PolarHBondContact O-NE2 2.82Å; M337-H434 VanDerWaalsContact O-NE2 3.15Å; W430-H434 AromaticContact CD2-CE1 3.86Å; W430-H434 AromaticContact CD2-ND1 3.51Å; W430-H434 AromaticContact CE2-CE1 3.87Å; W430-H434 AromaticContact CE2-CG 3.96Å; W430-H434 AromaticContact CE2-ND1 3.54Å; W430-H434 AromaticContact CE3-CE1 3.7Å; W430-H434 AromaticContact CE3-ND1 3.8Å; W430-H434 AromaticContact CG-ND1 3.98Å; W430-H434 AromaticContact CH2-CE1 3.58Å; W430-H434 AromaticContact CH2-NE2 3.93Å; W430-H434 AromaticContact CZ2-CE1 3.74Å; W430-H434 AromaticContact CZ2-ND1 3.85Å; W430-H434 AromaticContact CZ3-CE1 3.58Å; W430-H434 AromaticContact NE1-ND1 3.99Å; W430-H434 WeakPolarHBondContact O-CB 3.25Å; W430-H434 PolarHBondContact O-N 2.84Å; W430-H434 PolarHBondContact O-ND1 3.1Å; W430-H434 VanDerWaalsContact O-ND1 3.17Å
435	P	88.6	Confident	77.2	Confident	46 Å²	46	70.8 Å²	70.8	30%	0.299	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-63.8	141.1	174.1	29.1	-34.7	0	0	0	109.9	T433 L437	T433-P435 WeakPolarHBondContact O-CD 3.44Å; P435-L437 PolarHBondContact O-N 2.92Å
436	P	79.1	Confident	75.3	Confident	117 Å²	117	74.3 Å²	74.3	76%	0.76	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-63.4	122.2	176	26.5	-33.6	0	0	0	109.6	I438	P436-I438 PolarHBondContact O-N 3.2Å
437	L	67.4	Low	72.6	Confident	104 Å²	104	77 Å²	77	55%	0.545	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-64.7	122.2	172.4	-62.2	178.4	0	0	0	108.5	V37 P435 V439	V37-L437 HydrophobicContact CG1-CD2 4Å; P435-L437 PolarHBondContact O-N 2.92Å; L437-V439 HydrophobicContact CB-CG2 3.8Å; L437-V439 PolarHBondContact O-N 3.23Å
438	I	57.3	Low	69.9	Low	159 Å²	159	77.7 Å²	77.7	82%	0.815	44%	0.437	S	S	*	.			trans	-78.2	68.4	172.7	-52.4	-179.7	0	0	0	108.1	P436 S440	P436-I438 PolarHBondContact O-N 3.2Å; I438-S440 PolarHBondContact O-N 3.15Å
439	V	50.6	Low	67.3	Low	38 Å²	38	83.6 Å²	83.6	23%	0.23	45%	0.454	C	S	.	.			trans	-64.2	126.4	176.1	-177.5	0	0	0	0	108.1	L437 E443 R444	L437-V439 HydrophobicContact CB-CG2 3.8Å; L437-V439 PolarHBondContact O-N 3.23Å; V439-E443 HydrophobicContact CG1-CB 3.37Å; V439-E443 HydrophobicContact CG1-CG 4.46Å; V439-R444 HydrophobicContact CB-CG 4.21Å; V439-R444 HydrophobicContact CG1-CG 3.86Å; V439-R444 VanDerWaalsContact O-CZ 3.28Å; V439-R444 PolarHBondContact O-NE 3.19Å; V439-R444 PolarHBondContact O-NH2 3.36Å
440	S	48.5	Very low	64.2	Low	49 Å²	49	87.4 Å²	87.4	34%	0.343	49%	0.485	S	S	.	.			trans	-60.9	163.7	-178.7	70.5	0	0	0	0	111.6	I438 A442 E443 R444	I438-S440 PolarHBondContact O-N 3.15Å; S440-A442 PolarHBondContact O-N 3.29Å; S440-E443 WeakPolarHBondContact CB-OE2 3.23Å; S440-E443 PolarHBondContact N-OE2 2.94Å; S440-E443 PolarHBondContact O-N 3.16Å; S440-E443 WeakPolarHBondContact OG-CG 3.5Å; S440-E443 PolarHBondContact OG-N 2.85Å; S440-E443 PolarHBondContact OG-OE2 2.72Å; S440-R444 WeakPolarHBondContact O-CB 3.33Å; S440-R444 PolarHBondContact O-N 2.66Å
441	K	47.1	Very low	61.4	Low	167 Å²	167	88.5 Å²	88.5	73%	0.726	51%	0.505	S	S	*	.	H	α-helix	trans	-62.7	-29.6	176.1	-167.8	177	179.4	-177	0	111.7	L445	K441-L445 HydrophobicContact CG-CD1 4.25Å; K441-L445 WeakPolarHBondContact O-CD1 3.2Å; K441-L445 VanDerWaalsContact O-CG 3.25Å; K441-L445 WeakPolarHBondContact O-CG 3.39Å; K441-L445 PolarHBondContact O-N 3.43Å
442	A	54.4	Low	58.4	Low	59 Å²	59	92.1 Å²	92.1	49%	0.488	53%	0.525	S	S	.	.	H	α-helix	trans	-70.4	-50.6	176.8	0	0	0	0	0	111.8	S440 R444 L445 L446	S440-A442 PolarHBondContact O-N 3.29Å; A442-R444 VanDerWaalsContact C-N 3.3Å; A442-R444 PolarHBondContact O-N 2.92Å; A442-L445 PolarHBondContact O-N 2.81Å; A442-L446 WeakPolarHBondContact O-CG 3.17Å; A442-L446 PolarHBondContact O-N 3.22Å
443	E	53.4	Low	55.8	Low	85 Å²	85	96.6 Å²	96.6	40%	0.397	55%	0.551	S	S	.	*	H	α-helix	trans	-62.2	-36.9	178	-68.1	159.7	118.1	0	0	112.1	V439 S440 L445 L446 G447	V439-E443 HydrophobicContact CG1-CB 3.37Å; V439-E443 HydrophobicContact CG1-CG 4.46Å; S440-E443 WeakPolarHBondContact CB-OE2 3.23Å; S440-E443 PolarHBondContact N-OE2 2.94Å; S440-E443 PolarHBondContact O-N 3.16Å; S440-E443 WeakPolarHBondContact OG-CG 3.5Å; S440-E443 PolarHBondContact OG-N 2.85Å; S440-E443 PolarHBondContact OG-OE2 2.72Å; E443-L445 VanDerWaalsContact C-N 3.28Å; E443-L445 PolarHBondContact O-N 3.46Å; E443-L446 PolarHBondContact O-N 3.3Å; E443-G447 PolarHBondContact O-N 3.16Å
444	R	55.6	Low	52.9	Low	177 Å²	177	100.8 Å²	100.8	67%	0.668	58%	0.579	S	S	*	*	H	α-helix	trans	-64.5	-27.3	172.4	-92.6	-178.2	-82.9	177.8	-9.4	114	V439 S440 A442	V439-R444 HydrophobicContact CB-CG 4.21Å; V439-R444 HydrophobicContact CG1-CG 3.86Å; V439-R444 VanDerWaalsContact O-CZ 3.28Å; V439-R444 PolarHBondContact O-NE 3.19Å; V439-R444 PolarHBondContact O-NH2 3.36Å; S440-R444 WeakPolarHBondContact O-CB 3.33Å; S440-R444 PolarHBondContact O-N 2.66Å; A442-R444 VanDerWaalsContact C-N 3.3Å; A442-R444 PolarHBondContact O-N 2.92Å
445	L	52.5	Low	49.9	Very low	140 Å²	140	106.8 Å²	106.8	73%	0.733	61%	0.607	S	S	*	*	H	α-helix	trans	-88.5	-25.3	176.3	-72.5	168.9	0	0	0	112.8	K441 A442 E443 G447	K441-L445 HydrophobicContact CG-CD1 4.25Å; K441-L445 WeakPolarHBondContact O-CD1 3.2Å; K441-L445 VanDerWaalsContact O-CG 3.25Å; K441-L445 WeakPolarHBondContact O-CG 3.39Å; K441-L445 PolarHBondContact O-N 3.43Å; A442-L445 PolarHBondContact O-N 2.81Å; E443-L445 VanDerWaalsContact C-N 3.28Å; E443-L445 PolarHBondContact O-N 3.46Å; L445-G447 VanDerWaalsContact C-N 3.33Å
446	L	57.3	Low	47.4	Very low	133 Å²	133	109 Å²	109	70%	0.696	62%	0.619	S	S	*	*	H	α-helix	trans	-81.6	-8.3	177.6	-75.9	163	0	0	0	113.7	A442 E443 S448	A442-L446 WeakPolarHBondContact O-CG 3.17Å; A442-L446 PolarHBondContact O-N 3.22Å; E443-L446 PolarHBondContact O-N 3.3Å; L446-S448 PolarHBondContact O-N 3Å
447	G	41	Very low	45.4	Very low	61 Å²	61	113.2 Å²	113.2	63%	0.629	63%	0.626	S	S	*	*			trans	67	2.8	166.7	0	0	0	0	0	116.4	E443 L445 F449	E443-G447 PolarHBondContact O-N 3.16Å; L445-G447 VanDerWaalsContact C-N 3.33Å; G447-F449 VanDerWaalsContact C-N 3.27Å; G447-F449 PolarHBondContact O-N 3.48Å
448	S	41.1	Very low	43.9	Very low	78 Å²	78	114.3 Å²	114.3	55%	0.545	63%	0.628	S	S	.	*			trans	-80.9	7.4	-165.9	51.2	0	0	0	0	115.8	L446	L446-S448 PolarHBondContact O-N 3Å
449	F	41.8	Very low	42.9	Very low	152 Å²	152	112.4 Å²	112.4	67%	0.667	62%	0.624	S	S	*	*			trans	-136.5	71.1	175	-69	-70.9	0	0	0	112.5	G447 A451	G447-F449 VanDerWaalsContact C-N 3.27Å; G447-F449 PolarHBondContact O-N 3.48Å; F449-A451 PolarHBondContact O-N 3.24Å
450	S	32.7	Very low	42.5	Very low	109 Å²	109	115.5 Å²	115.5	76%	0.762	64%	0.639	S	S	*	*			trans	-66.6	111.8	133.2	-175.1	0	0	0	0	106	P452	S450-P452 WeakPolarHBondContact O-CD 3.36Å
451	A	37.3	Very low	42.3	Very low	74 Å²	74	117.2 Å²	117.2	61%	0.612	65%	0.651	S	S	*	*			trans	-62.1	119.3	175.3	0	0	0	0	0	107.5	F449 V453	F449-A451 PolarHBondContact O-N 3.24Å; A451-V453 VanDerWaalsContact C-N 3.35Å; A451-V453 PolarHBondContact O-N 2.99Å
452	P	34.2	Very low	42	Very low	115 Å²	115	115.8 Å²	115.8	75%	0.747	65%	0.652	S	S	*	*			trans	-70.5	96	-175.7	28	-33.5	0	0	0	108.9	S450 P454	S450-P452 WeakPolarHBondContact O-CD 3.36Å; P452-P454 VanDerWaalsContact O-CD 3.26Å; P452-P454 WeakPolarHBondContact O-CD 3.45Å
453	V	40.2	Very low	41.6	Very low	104 Å²	104	121.6 Å²	121.6	63%	0.63	66%	0.661	S	S	*	*			trans	-55.3	116.6	147.9	177.9	0	0	0	0	104.7	A451 E455	A451-V453 VanDerWaalsContact C-N 3.35Å; A451-V453 PolarHBondContact O-N 2.99Å; V453-E455 VanDerWaalsContact C-N 3.33Å; V453-E455 PolarHBondContact O-N 3.28Å
454	P	36.9	Very low	41.2	Very low	91 Å²	91	122.9 Å²	122.9	59%	0.591	68%	0.676	S	S	*	*			trans	-73.8	94	-179.4	30.3	-32.9	0	0	0	108.1	P452 T456	P452-P454 VanDerWaalsContact O-CD 3.26Å; P452-P454 WeakPolarHBondContact O-CD 3.45Å; P454-T456 HydrophobicContact CB-CG2 4.22Å; P454-T456 PolarHBondContact O-N 2.89Å; P454-T456 PolarHBondContact O-OG1 3.38Å
455	E	30.5	Very low	41.2	Very low	184 Å²	184	118.8 Å²	118.8	86%	0.86	67%	0.667	S	S	*	*			trans	-68.2	32.2	159.2	-68.5	-157.7	155.3	0	0	111.8	V453 K457	V453-E455 VanDerWaalsContact C-N 3.33Å; V453-E455 PolarHBondContact O-N 3.28Å; E455-K457 PolarHBondContact O-N 3.49Å
456	T	37.2	Very low	41.4	Very low	92 Å²	92	115.2 Å²	115.2	56%	0.564	65%	0.651	S	S	*	*			trans	-63.4	106.1	160.4	52.2	0	0	0	0	107.3	P454 E458	P454-T456 HydrophobicContact CB-CG2 4.22Å; P454-T456 PolarHBondContact O-N 2.89Å; P454-T456 PolarHBondContact O-OG1 3.38Å; T456-E458 PolarHBondContact O-N 2.99Å
457	K	36.3	Very low	41.4	Very low	206 Å²	206	113.8 Å²	113.8	90%	0.896	65%	0.65	S	S	*	*			trans	-68.4	52.2	159.9	-64.7	179.3	-179.5	174.3	0	110.1	E455 V459	E455-K457 PolarHBondContact O-N 3.49Å; K457-V459 PolarHBondContact O-N 2.78Å
458	E	35.8	Very low	42.8	Very low	127 Å²	127	113.5 Å²	113.5	59%	0.593	63%	0.633	S	S	*	*			trans	-67	129.2	164.2	-62.8	-127.3	129	0	0	106.9	T456 D460 R463	T456-E458 PolarHBondContact O-N 2.99Å; E458-D460 VanDerWaalsContact C-N 3.34Å; E458-D460 PolarHBondContact O-N 3.3Å; E458-R463 IonicContact OE2-NH1 2.73Å
459	V	36.7	Very low	44.3	Very low	120 Å²	120	111.5 Å²	111.5	73%	0.727	62%	0.617	S	S	*	*			trans	-77.5	91.3	177	-177.1	0	0	0	0	107.1	K457 S461	K457-V459 PolarHBondContact O-N 2.78Å; V459-S461 WeakPolarHBondContact CG1-OG 3.06Å; V459-S461 PolarHBondContact O-N 2.88Å
460	D	42.5	Very low	45.6	Very low	103 Å²	103	107.6 Å²	107.6	55%	0.551	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	26.5	-168.8	-156	45.5	0	0	0	114.1	K336 E458	K336-D460 IonicContact NZ-OD1 3.68Å; K336-D460 PolarHBondContact NZ-OD1 2.8Å; K336-D460 IonicContact NZ-OD2 3.18Å; K336-D460 PolarHBondContact NZ-OD2 3.39Å; E458-D460 VanDerWaalsContact C-N 3.34Å; E458-D460 PolarHBondContact O-N 3.3Å
461	S	43.1	Very low	47.4	Very low	84 Å²	84	102.8 Å²	102.8	59%	0.587	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	-31.6	-177.9	54.7	0	0	0	0	115	V459	V459-S461 WeakPolarHBondContact CG1-OG 3.06Å; V459-S461 PolarHBondContact O-N 2.88Å
462	D	42.5	Very low	49.4	Very low	138 Å²	138	100.9 Å²	100.9	74%	0.738	55%	0.553	S	S	*	*	S	Bend	trans	-123.9	13	-164	-68.7	-83.4	0	0	0	114.7	P464	D462-P464 WeakPolarHBondContact O-CD 3.34Å
463	R	44.7	Very low	51.7	Low	180 Å²	180	96.5 Å²	96.5	68%	0.679	53%	0.525	S	S	*	.	S	Bend	trans	-70.1	124.3	171.3	-162	176.4	-155.4	156.7	16.3	108.9	E458 L465	E458-R463 IonicContact OE2-NH1 2.73Å; R463-L465 PolarHBondContact O-N 2.84Å
464	P	45.4	Very low	53.8	Low	112 Å²	112	91.6 Å²	91.6	73%	0.727	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-58.7	128.7	178.1	23.5	-33.4	0	0	0	109.7	D462 V466	D462-P464 WeakPolarHBondContact O-CD 3.34Å; P464-V466 PolarHBondContact O-N 3.09Å
465	L	55	Low	56.1	Low	92 Å²	92	87.7 Å²	87.7	48%	0.482	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-53.4	138.7	174.8	-69.1	172.7	0	0	0	109.2	Q325 R463	Q325-L465 HydrophobicContact CG-CD1 4.33Å; R463-L465 PolarHBondContact O-N 2.84Å
466	V	57.9	Low	58.6	Low	64 Å²	64	79.3 Å²	79.3	39%	0.388	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-53.5	137.4	174.5	-177.6	0	0	0	0	108.1	P464 M468	P464-V466 PolarHBondContact O-N 3.09Å; V466-M468 PolarHBondContact O-N 3.29Å
467	P	57.3	Low	61	Low	103 Å²	103	76 Å²	76	67%	0.669	41%	0.411	S	S	*	.			trans	-47.2	111.9	179.3	-32.6	37.5	0	0	0	111.9
468	M	68.9	Low	63.6	Low	55 Å²	55	66.7 Å²	66.7	27%	0.271	37%	0.371	S	S	.	.			trans	-68.6	141.1	-168.3	-55.8	-171.4	80.1	0	0	110.1	Q324 Q325 E328 V466 P470	Q324-M468 HydrophobicContact CB-CE 4.46Å; Q324-M468 HydrophobicContact CG-CE 3.74Å; Q324-M468 WeakPolarHBondContact O-CE 3.39Å; Q325-M468 VanDerWaalsContact CA-CE 3.46Å; Q325-M468 HydrophobicContact CB-CE 4.14Å; Q325-M468 HydrophobicContact CG-CE 3.6Å; Q325-M468 HydrophobicContact CG-SD 3.58Å; Q325-M468 VanDerWaalsContact CG-SD 3.58Å; E328-M468 HydrophobicContact CB-CE 4.08Å; E328-M468 VanDerWaalsContact CD-CE 3.46Å; E328-M468 HydrophobicContact CG-CE 3.93Å; E328-M468 WeakPolarHBondContact OE1-CA 3.35Å; E328-M468 VanDerWaalsContact OE1-CB 3.3Å; E328-M468 WeakPolarHBondContact OE1-CB 3.39Å; E328-M468 WeakPolarHBondContact OE2-CA 3.31Å; V466-M468 PolarHBondContact O-N 3.29Å; M468-P470 WeakPolarHBondContact O-CD 3.49Å
469	T	74	Confident	66.2	Low	36 Å²	36	61.6 Å²	61.6	22%	0.221	35%	0.348	C	S	.	.			trans	-97.1	105.9	172.2	-50	0	0	0	0	108.7	Q324 E328 G471 H472 L475	Q324-T469 PolarHBondContact NE2-O 3.17Å; E328-T469 PolarHBondContact OE1-N 2.98Å; T469-G471 PolarHBondContact O-N 2.78Å; T469-H472 HydrophobicContact CG2-CB 4.09Å; T469-H472 PolarHBondContact O-N 2.69Å; T469-L475 HydrophobicContact CG2-CD2 3.99Å
470	P	69.5	Low	68.6	Low	71 Å²	71	63.5 Å²	63.5	46%	0.461	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	132.8	-174.1	-22.8	34.3	0	0	0	110.8	L300 L301 M468 H472	L300-P470 HydrophobicContact CB-CB 4.09Å; L301-P470 VanDerWaalsContact CD2-O 3.29Å; L301-P470 WeakPolarHBondContact CD2-O 3.4Å; M468-P470 WeakPolarHBondContact O-CD 3.49Å; P470-H472 VanDerWaalsContact C-N 3.27Å; P470-H472 PolarHBondContact O-N 3.04Å
471	G	69.9	Low	71	Confident	7 Å²	7	60.5 Å²	60.5	7%	0.072	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	-7.6	-178.5	0	0	0	0	0	116.4	V297 T469 P473	V297-G471 WeakPolarHBondContact O-CA 3.37Å; T469-G471 PolarHBondContact O-N 2.78Å; G471-P473 WeakPolarHBondContact O-CD 3.2Å
472	H	79.6	Confident	73.4	Confident	34 Å²	34	56.5 Å²	56.5	16%	0.157	31%	0.306	C	S	.	.			trans	-123.6	76.3	-177.7	-68.9	-32.6	0	0	0	111.7	T469 P470 G474 L475 T496	T469-H472 HydrophobicContact CG2-CB 4.09Å; T469-H472 PolarHBondContact O-N 2.69Å; P470-H472 VanDerWaalsContact C-N 3.27Å; P470-H472 PolarHBondContact O-N 3.04Å; H472-G474 PolarHBondContact O-N 2.96Å; H472-L475 HydrophobicContact CB-CB 3.88Å; H472-L475 HydrophobicContact CB-CD2 3.72Å; H472-L475 HydrophobicContact CB-CG 4.45Å; H472-L475 WeakPolarHBondContact O-CB 3.3Å; H472-L475 PolarHBondContact O-N 3.12Å; H472-T496 HydrophobicContact CB-CG2 4.37Å; H472-T496 PolarHBondContact NE2-OG1 2.85Å
473	P	81.8	Confident	75.9	Confident	24 Å²	24	53.3 Å²	53.3	16%	0.156	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	133.9	177.9	20.6	-32.8	0	0	0	112.7	Q324 L327 F331 C357 G471 L475	Q324-P473 VanDerWaalsContact OE1-CB 3.32Å; L327-P473 HydrophobicContact CB-CB 3.8Å; L327-P473 HydrophobicContact CD1-CB 3.78Å; L327-P473 HydrophobicContact CD1-CG 4.21Å; L327-P473 HydrophobicContact CG-CB 4.34Å; F331-P473 HydrophobicContact CE2-CB 4.4Å; C357-P473 VanDerWaalsContact SG-CG 3.54Å; G471-P473 WeakPolarHBondContact O-CD 3.2Å; P473-L475 PolarHBondContact O-N 2.87Å
474	G	84.4	Confident	78.2	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	-13.3	177.8	0	0	0	0	0	115.9	F331 H472 S476 V477 V478	F331-G474 VanDerWaalsContact CD2-CA 3.49Å; H472-G474 PolarHBondContact O-N 2.96Å; G474-S476 PolarHBondContact O-N 2.78Å; G474-V477 PolarHBondContact O-N 3.46Å; G474-V478 WeakPolarHBondContact O-CG2 3.41Å; G474-V478 PolarHBondContact O-N 3.15Å
475	L	85.9	Confident	80.5	Confident	10 Å²	10	45 Å²	45	5%	0.052	26%	0.261	C	S	.	.	H	α-helix	trans	-61.7	-41.2	-177.1	-177.6	61	0	0	0	112.6	I243 T469 H472 P473 V477 V478 T479 I492 T496	I243-L475 HydrophobicContact CD1-CD1 4.42Å; T469-L475 HydrophobicContact CG2-CD2 3.99Å; H472-L475 HydrophobicContact CB-CB 3.88Å; H472-L475 HydrophobicContact CB-CD2 3.72Å; H472-L475 HydrophobicContact CB-CG 4.45Å; H472-L475 WeakPolarHBondContact O-CB 3.3Å; H472-L475 PolarHBondContact O-N 3.12Å; P473-L475 PolarHBondContact O-N 2.87Å; L475-V477 VanDerWaalsContact C-N 3.34Å; L475-V477 PolarHBondContact O-N 2.98Å; L475-V478 PolarHBondContact O-N 2.72Å; L475-T479 VanDerWaalsContact O-CB 3.27Å; L475-T479 WeakPolarHBondContact O-CB 3.3Å; L475-T479 PolarHBondContact O-N 3.09Å; L475-T479 PolarHBondContact O-OG1 3Å; L475-I492 HydrophobicContact CD1-CG2 3.59Å; L475-T496 HydrophobicContact CB-CG2 4.27Å; L475-T496 HydrophobicContact CD1-CG2 3.73Å; L475-T496 HydrophobicContact CD2-CG2 3.94Å; L475-T496 HydrophobicContact CG-CG2 4.19Å
476	S	83.3	Confident	82.5	Confident	8 Å²	8	42.5 Å²	42.5	6%	0.056	26%	0.258	C	S	.	.	H	α-helix	trans	-55.5	-45.9	174.9	56.5	0	0	0	0	112.3	E328 G474	E328-S476 WeakPolarHBondContact OE2-CB 3.32Å; E328-S476 PolarHBondContact OE2-OG 2.62Å; G474-S476 PolarHBondContact O-N 2.78Å
477	V	87	Confident	84.3	Confident	23 Å²	23	39.8 Å²	39.8	14%	0.139	24%	0.241	C	C	.	.	H	α-helix	trans	-68.4	-48.1	179.3	-177.1	0	0	0	0	110.8	F331 H332 G474 L475	F331-V477 HydrophobicContact CB-CB 4.37Å; F331-V477 HydrophobicContact CB-CG2 4.19Å; H332-V477 HydrophobicContact CB-CG1 4.4Å; H332-V477 HydrophobicContact CB-CG2 4.22Å; G474-V477 PolarHBondContact O-N 3.46Å; L475-V477 VanDerWaalsContact C-N 3.34Å; L475-V477 PolarHBondContact O-N 2.98Å
478	V	90.9	Very high	86	Confident	10 Å²	10	37.4 Å²	37.4	6%	0.061	22%	0.224	C	C	.	.	H	α-helix	trans	-64.9	-43.1	-178.9	164	0	0	0	0	111.7	F43 I243 G474 L475 K480 S481 A482	F43-V478 HydrophobicContact CB-CB 4.43Å; F43-V478 HydrophobicContact CB-CG1 3.76Å; F43-V478 HydrophobicContact CB-CG2 3.99Å; F43-V478 HydrophobicContact CD1-CG1 4.29Å; F43-V478 HydrophobicContact CG-CG1 3.99Å; I243-V478 HydrophobicContact CD1-CG1 4.24Å; I243-V478 HydrophobicContact CG2-CG2 3.9Å; G474-V478 WeakPolarHBondContact O-CG2 3.41Å; G474-V478 PolarHBondContact O-N 3.15Å; L475-V478 PolarHBondContact O-N 2.72Å; V478-K480 PolarHBondContact O-N 2.8Å; V478-S481 PolarHBondContact O-N 2.86Å; V478-S481 VanDerWaalsContact O-N 3.1Å; V478-A482 HydrophobicContact CG1-CB 4.32Å; V478-A482 WeakPolarHBondContact O-CB 3.4Å; V478-A482 PolarHBondContact O-N 2.93Å
479	T	90.8	Very high	86.8	Confident	19 Å²	19	36.3 Å²	36.3	12%	0.117	22%	0.222	C	C	.	.	H	α-helix	trans	-56	-48	-173.7	-62.1	0	0	0	0	111.9	L475 S481 A482 L483 I492	L475-T479 VanDerWaalsContact O-CB 3.27Å; L475-T479 WeakPolarHBondContact O-CB 3.3Å; L475-T479 PolarHBondContact O-N 3.09Å; L475-T479 PolarHBondContact O-OG1 3Å; T479-S481 VanDerWaalsContact C-N 3.28Å; T479-S481 PolarHBondContact O-N 2.87Å; T479-A482 PolarHBondContact O-N 3.26Å; T479-L483 HydrophobicContact CG2-CD1 3.8Å; T479-L483 HydrophobicContact CG2-CG 4.1Å; T479-L483 WeakPolarHBondContact O-CB 3.31Å; T479-L483 VanDerWaalsContact O-CG 3.24Å; T479-L483 WeakPolarHBondContact O-CG 3.4Å; T479-L483 PolarHBondContact O-N 2.65Å; T479-I492 HydrophobicContact CG2-CD1 4.4Å; T479-I492 WeakPolarHBondContact OG1-CG2 3.31Å
480	K	86.5	Confident	87.5	Confident	161 Å²	161	40.4 Å²	40.4	70%	0.7	24%	0.239	S	C	*	.	H	α-helix	trans	-57.1	-42.6	179.3	-178.6	178.7	177.6	-179.2	0	112.4	V478	V478-K480 PolarHBondContact O-N 2.8Å
481	S	92.1	Very high	88.5	Confident	40 Å²	40	37.2 Å²	37.2	28%	0.28	22%	0.218	S	C	.	.	H	α-helix	trans	-74	-46.3	-178.6	-167.5	0	0	0	0	111.5	A42 V478 T479 L483 S484 A485	A42-S481 WeakPolarHBondContact CA-OG 3.28Å; A42-S481 WeakPolarHBondContact O-CB 3.42Å; A42-S481 PolarHBondContact O-OG 3.13Å; V478-S481 PolarHBondContact O-N 2.86Å; V478-S481 VanDerWaalsContact O-N 3.1Å; T479-S481 VanDerWaalsContact C-N 3.28Å; T479-S481 PolarHBondContact O-N 2.87Å; S481-L483 PolarHBondContact O-N 3.03Å; S481-S484 PolarHBondContact O-N 3.44Å; S481-S484 PolarHBondContact O-OG 2.8Å; S481-A485 PolarHBondContact O-N 3.35Å; S481-A485 VanDerWaalsContact O-N 3.11Å
482	A	94.3	Very high	89.4	Confident	0 Å²	0	37 Å²	37	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.8	-42.2	179.2	0	0	0	0	0	112.7	F43 V478 T479 S484 A485 G486 F487 I492	F43-A482 HydrophobicContact CD1-CB 3.8Å; F43-A482 HydrophobicContact CE1-CB 3.92Å; V478-A482 HydrophobicContact CG1-CB 4.32Å; V478-A482 WeakPolarHBondContact O-CB 3.4Å; V478-A482 PolarHBondContact O-N 2.93Å; T479-A482 PolarHBondContact O-N 3.26Å; A482-S484 VanDerWaalsContact C-N 3.3Å; A482-S484 PolarHBondContact O-N 3.09Å; A482-A485 CarbonylContact O-C 3.51Å; A482-A485 WeakPolarHBondContact O-CA 3.15Å; A482-A485 PolarHBondContact O-N 2.72Å; A482-G486 PolarHBondContact O-N 3.25Å; A482-F487 HydrophobicContact CB-CB 4.11Å; A482-F487 HydrophobicContact CB-CD2 4.25Å; A482-F487 HydrophobicContact CB-CG 4.3Å; A482-F487 WeakPolarHBondContact O-CB 3.42Å; A482-F487 VanDerWaalsContact O-CD2 3.3Å; A482-F487 WeakPolarHBondContact O-CD2 3.39Å; A482-F487 PolarHBondContact O-N 3.18Å; A482-F487 VanDerWaalsContact O-N 3.11Å; A482-I492 HydrophobicContact CB-CD1 3.53Å; A482-I492 HydrophobicContact CB-CG1 3.76Å
483	L	94.1	Very high	89.4	Confident	71 Å²	71	37.2 Å²	37.2	37%	0.372	22%	0.22	S	C	.	.	H	α-helix	trans	-57	-43.7	173.7	-70.4	174.4	0	0	0	111.3	T479 S481 A485 G486 F487 I492	T479-L483 HydrophobicContact CG2-CD1 3.8Å; T479-L483 HydrophobicContact CG2-CG 4.1Å; T479-L483 WeakPolarHBondContact O-CB 3.31Å; T479-L483 VanDerWaalsContact O-CG 3.24Å; T479-L483 WeakPolarHBondContact O-CG 3.4Å; T479-L483 PolarHBondContact O-N 2.65Å; S481-L483 PolarHBondContact O-N 3.03Å; L483-A485 PolarHBondContact O-N 2.81Å; L483-G486 PolarHBondContact O-N 3.29Å; L483-G486 VanDerWaalsContact O-N 3.14Å; L483-F487 WeakPolarHBondContact CD2-O 3.38Å; L483-I492 HydrophobicContact CD2-CD1 3.94Å; L483-I492 HydrophobicContact CG-CD1 4.03Å
484	S	93.2	Very high	89.4	Confident	104 Å²	104	37.2 Å²	37.2	73%	0.727	22%	0.218	S	C	*	.	H	α-helix	trans	-67.4	-20.8	176.4	78.2	0	0	0	0	113.9	S481 A482 G486	S481-S484 PolarHBondContact O-N 3.44Å; S481-S484 PolarHBondContact O-OG 2.8Å; A482-S484 VanDerWaalsContact C-N 3.3Å; A482-S484 PolarHBondContact O-N 3.09Å; S484-G486 VanDerWaalsContact C-N 3.34Å
485	A	95.1	Very high	89.2	Confident	13 Å²	13	37.6 Å²	37.6	11%	0.107	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	10.9	175.7	0	0	0	0	0	113.6	A42 K79 R80 S481 A482 L483 F487	A42-A485 HydrophobicContact CB-CB 3.52Å; K79-A485 WeakPolarHBondContact CG-O 3.4Å; R80-A485 PolarHBondContact N-O 3.33Å; S481-A485 PolarHBondContact O-N 3.35Å; S481-A485 VanDerWaalsContact O-N 3.11Å; A482-A485 CarbonylContact O-C 3.51Å; A482-A485 WeakPolarHBondContact O-CA 3.15Å; A482-A485 PolarHBondContact O-N 2.72Å; L483-A485 PolarHBondContact O-N 2.81Å; A485-F487 HydrophobicContact CB-CD2 3.95Å; A485-F487 HydrophobicContact CB-CE2 4.01Å
486	G	95.1	Very high	88.4	Confident	39 Å²	39	38.8 Å²	38.8	40%	0.402	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.8	4.1	173.3	0	0	0	0	0	115.9	R80 A482 L483 S484	R80-G486 WeakPolarHBondContact CD-O 3.24Å; R80-G486 PolarHBondContact NH1-O 2.98Å; A482-G486 PolarHBondContact O-N 3.25Å; L483-G486 PolarHBondContact O-N 3.29Å; L483-G486 VanDerWaalsContact O-N 3.14Å; S484-G486 VanDerWaalsContact C-N 3.34Å
487	F	95.9	Very high	87.2	Confident	7 Å²	7	39 Å²	39	3%	0.031	23%	0.232	C	C	.	.			trans	-76.2	147.9	177.3	-65.3	-98.3	0	0	0	111.6	F43 I77 R80 W86 A482 L483 A485 I492	F43-F487 HydrophobicContact CE1-CD1 4.21Å; F43-F487 HydrophobicContact CE1-CD2 4.02Å; F43-F487 AromaticContact CE1-CE1 3.93Å; F43-F487 HydrophobicContact CE1-CE1 3.93Å; F43-F487 AromaticContact CE1-CE2 3.73Å; F43-F487 HydrophobicContact CE1-CE2 3.73Å; F43-F487 HydrophobicContact CE1-CG 4.26Å; F43-F487 AromaticContact CE1-CZ 3.71Å; F43-F487 HydrophobicContact CE1-CZ 3.71Å; F43-F487 HydrophobicContact CZ-CD1 4.33Å; F43-F487 AromaticContact CZ-CE1 3.85Å; F43-F487 HydrophobicContact CZ-CE1 3.85Å; F43-F487 HydrophobicContact CZ-CE2 4.4Å; F43-F487 AromaticContact CZ-CZ 3.91Å; F43-F487 HydrophobicContact CZ-CZ 3.91Å; I77-F487 HydrophobicContact CG2-CE1 4.48Å; I77-F487 HydrophobicContact CG2-CE2 4.08Å; I77-F487 HydrophobicContact CG2-CZ 3.52Å; R80-F487 HydrophobicContact CB-CD1 4.17Å; R80-F487 HydrophobicContact CB-CD2 3.99Å; R80-F487 HydrophobicContact CB-CE1 4.03Å; R80-F487 HydrophobicContact CB-CE2 3.87Å; R80-F487 HydrophobicContact CB-CG 4.14Å; R80-F487 HydrophobicContact CB-CZ 3.87Å; R80-F487 HydrophobicContact CG-CD1 4.49Å; R80-F487 HydrophobicContact CG-CE1 4.46Å; W86-F487 HydrophobicContact CB-CZ 4.42Å; W86-F487 AromaticContact CD1-CE1 3.7Å; W86-F487 AromaticContact CD2-CE1 3.78Å; W86-F487 HydrophobicContact CD2-CE1 3.78Å; W86-F487 HydrophobicContact CD2-CZ 4.25Å; W86-F487 AromaticContact CE2-CE1 3.59Å; W86-F487 HydrophobicContact CE3-CE1 4.47Å; W86-F487 AromaticContact CG-CE1 3.84Å; W86-F487 HydrophobicContact CG-CE1 3.84Å; W86-F487 HydrophobicContact CG-CZ 4.06Å; W86-F487 HydrophobicContact CZ2-CE1 4.09Å; W86-F487 AromaticContact NE1-CE1 3.57Å; A482-F487 HydrophobicContact CB-CB 4.11Å; A482-F487 HydrophobicContact CB-CD2 4.25Å; A482-F487 HydrophobicContact CB-CG 4.3Å; A482-F487 WeakPolarHBondContact O-CB 3.42Å; A482-F487 VanDerWaalsContact O-CD2 3.3Å; A482-F487 WeakPolarHBondContact O-CD2 3.39Å; A482-F487 PolarHBondContact O-N 3.18Å; A482-F487 VanDerWaalsContact O-N 3.11Å; L483-F487 WeakPolarHBondContact CD2-O 3.38Å; A485-F487 HydrophobicContact CB-CD2 3.95Å; A485-F487 HydrophobicContact CB-CE2 4.01Å; F487-I492 HydrophobicContact CB-CD1 3.94Å; F487-I492 HydrophobicContact CB-CG1 3.95Å
488	T	92.9	Very high	85.4	Confident	53 Å²	53	39.1 Å²	39.1	33%	0.325	24%	0.235	S	C	.	.			trans	-85.3	155.3	171.9	64	0	0	0	0	111.2	Q490 E491 I492	T488-Q490 PolarHBondContact O-N 3.36Å; T488-Q490 VanDerWaalsContact O-N 3.16Å; T488-E491 WeakPolarHBondContact CB-OE2 3.45Å; T488-E491 WeakPolarHBondContact CG2-OE2 3.14Å; T488-E491 PolarHBondContact N-OE2 3.49Å; T488-E491 PolarHBondContact O-N 3.11Å; T488-E491 VanDerWaalsContact OG1-CG 3.3Å; T488-E491 WeakPolarHBondContact OG1-CG 3.2Å; T488-E491 PolarHBondContact OG1-N 3.37Å; T488-E491 PolarHBondContact OG1-OE2 2.99Å; T488-I492 VanDerWaalsContact O-CD1 3.31Å; T488-I492 WeakPolarHBondContact O-CD1 3.47Å; T488-I492 VanDerWaalsContact O-CG1 3.24Å; T488-I492 WeakPolarHBondContact O-CG1 3.1Å; T488-I492 PolarHBondContact O-N 2.8Å; T488-I492 VanDerWaalsContact O-N 3.15Å
489	S	87.2	Confident	82.9	Confident	32 Å²	32	45.5 Å²	45.5	22%	0.224	26%	0.258	C	S	.	.	H	α-helix	trans	-59.6	-22.9	172.2	-177.1	0	0	0	0	113.2	S493 N513	S489-S493 WeakPolarHBondContact O-CB 3.48Å; S489-S493 PolarHBondContact O-N 3.29Å; S489-S493 PolarHBondContact O-OG 3.4Å; S489-N513 PolarHBondContact OG-ND2 2.86Å
490	Q	87.3	Confident	80.3	Confident	122 Å²	122	47.2 Å²	47.2	57%	0.57	27%	0.274	S	S	*	.	H	α-helix	trans	-73.1	-54.1	175	-174	-173.6	-37.2	0	0	110.9	T488 I492 S493 E494	T488-Q490 PolarHBondContact O-N 3.36Å; T488-Q490 VanDerWaalsContact O-N 3.16Å; Q490-I492 PolarHBondContact O-N 2.91Å; Q490-S493 CarbonylContact O-C 3.59Å; Q490-S493 WeakPolarHBondContact O-CA 3.37Å; Q490-S493 WeakPolarHBondContact O-CB 3.48Å; Q490-S493 PolarHBondContact O-N 3.5Å; Q490-E494 PolarHBondContact NE2-OE1 3.34Å; Q490-E494 PolarHBondContact O-N 2.9Å
491	E	90.6	Very high	77.7	Confident	5 Å²	5	43.4 Å²	43.4	2%	0.023	26%	0.264	C	S	.	.	H	α-helix	trans	-56.8	-36.2	178.6	-69	160.6	120.6	0	0	112.1	R80 Q83 T488 E494 L495	R80-E491 IonicContact CZ-OE1 2.86Å; R80-E491 IonicContact CZ-OE2 3.17Å; R80-E491 VanDerWaalsContact NE-CD 3.33Å; R80-E491 IonicContact NE-OE1 3.12Å; R80-E491 PolarHBondContact NE-OE1 2.7Å; R80-E491 IonicContact NE-OE2 2.8Å; R80-E491 PolarHBondContact NE-OE2 3.17Å; R80-E491 IonicContact NH1-OE2 3.36Å; R80-E491 IonicContact NH2-OE1 2.75Å; R80-E491 PolarHBondContact NH2-OE1 3.11Å; R80-E491 VanDerWaalsContact NH2-OE1 3.09Å; R80-E491 IonicContact NH2-OE2 3.23Å; R80-E491 PolarHBondContact NH2-OE2 3.35Å; Q83-E491 PolarHBondContact OE1-OE1 3.18Å; T488-E491 WeakPolarHBondContact CB-OE2 3.45Å; T488-E491 WeakPolarHBondContact CG2-OE2 3.14Å; T488-E491 PolarHBondContact N-OE2 3.49Å; T488-E491 PolarHBondContact O-N 3.11Å; T488-E491 VanDerWaalsContact OG1-CG 3.3Å; T488-E491 WeakPolarHBondContact OG1-CG 3.2Å; T488-E491 PolarHBondContact OG1-N 3.37Å; T488-E491 PolarHBondContact OG1-OE2 2.99Å; E491-E494 PolarHBondContact O-N 2.74Å; E491-L495 PolarHBondContact O-N 3.3Å
492	I	88.5	Confident	74.5	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-69.3	-33.3	176.4	-62.9	161.2	0	0	0	111.6	L475 T479 A482 L483 F487 T488 Q490	L475-I492 HydrophobicContact CD1-CG2 3.59Å; T479-I492 HydrophobicContact CG2-CD1 4.4Å; T479-I492 WeakPolarHBondContact OG1-CG2 3.31Å; A482-I492 HydrophobicContact CB-CD1 3.53Å; A482-I492 HydrophobicContact CB-CG1 3.76Å; L483-I492 HydrophobicContact CD2-CD1 3.94Å; L483-I492 HydrophobicContact CG-CD1 4.03Å; F487-I492 HydrophobicContact CB-CD1 3.94Å; F487-I492 HydrophobicContact CB-CG1 3.95Å; T488-I492 VanDerWaalsContact O-CD1 3.31Å; T488-I492 WeakPolarHBondContact O-CD1 3.47Å; T488-I492 VanDerWaalsContact O-CG1 3.24Å; T488-I492 WeakPolarHBondContact O-CG1 3.1Å; T488-I492 PolarHBondContact O-N 2.8Å; T488-I492 VanDerWaalsContact O-N 3.15Å; Q490-I492 PolarHBondContact O-N 2.91Å
493	S	81.1	Confident	71.3	Confident	38 Å²	38	53.7 Å²	53.7	27%	0.266	32%	0.315	S	S	.	.	H	α-helix	trans	-79.5	-28.3	175.9	-56.4	0	0	0	0	113.2	S489 Q490 L495 T496	S489-S493 WeakPolarHBondContact O-CB 3.48Å; S489-S493 PolarHBondContact O-N 3.29Å; S489-S493 PolarHBondContact O-OG 3.4Å; Q490-S493 CarbonylContact O-C 3.59Å; Q490-S493 WeakPolarHBondContact O-CA 3.37Å; Q490-S493 WeakPolarHBondContact O-CB 3.48Å; Q490-S493 PolarHBondContact O-N 3.5Å; S493-L495 VanDerWaalsContact C-N 3.26Å; S493-L495 PolarHBondContact O-N 3.11Å; S493-T496 PolarHBondContact O-N 3.06Å; S493-T496 PolarHBondContact O-OG1 3.31Å; S493-T496 VanDerWaalsContact O-OG1 3.14Å
494	E	81.1	Confident	68.2	Low	25 Å²	25	57.5 Å²	57.5	12%	0.117	34%	0.335	C	S	.	.	H	α-helix	trans	-63.9	-34.8	173.4	-72.8	178.2	-167.2	0	0	111.1	Q490 E491 T496 G497	Q490-E494 PolarHBondContact NE2-OE1 3.34Å; Q490-E494 PolarHBondContact O-N 2.9Å; E491-E494 PolarHBondContact O-N 2.74Å; E494-T496 VanDerWaalsContact C-N 3.25Å; E494-T496 PolarHBondContact O-N 3.46Å; E494-G497 PolarHBondContact O-N 3.15Å; E494-G497 VanDerWaalsContact O-N 3.13Å
495	L	80.6	Confident	65.2	Low	8 Å²	8	55.1 Å²	55.1	4%	0.042	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-18.3	175	-83.9	173.6	0	0	0	115.4	F43 V45 W86 P103 Y241 I243 E491 S493	F43-L495 HydrophobicContact CD2-CD1 4.47Å; F43-L495 HydrophobicContact CE2-CD1 3.67Å; F43-L495 HydrophobicContact CZ-CD1 3.98Å; V45-L495 HydrophobicContact CG1-CD2 4.19Å; W86-L495 HydrophobicContact CH2-CD1 3.94Å; W86-L495 HydrophobicContact CH2-CD2 4Å; W86-L495 HydrophobicContact CH2-CG 4.14Å; P103-L495 HydrophobicContact CG-CD2 4.3Å; Y241-L495 HydrophobicContact CD2-CD2 4.27Å; I243-L495 HydrophobicContact CD1-CB 3.71Å; I243-L495 HydrophobicContact CD1-CD1 4.19Å; I243-L495 HydrophobicContact CG1-CB 4.04Å; I243-L495 HydrophobicContact CG1-CD1 4.23Å; E491-L495 PolarHBondContact O-N 3.3Å; S493-L495 VanDerWaalsContact C-N 3.26Å; S493-L495 PolarHBondContact O-N 3.11Å
496	T	68.2	Low	62.2	Low	34 Å²	34	63.9 Å²	63.9	21%	0.209	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	9.6	174.6	62.3	0	0	0	0	113.7	I243 H472 L475 S493 E494 A498	I243-T496 HydrophobicContact CD1-CG2 4.12Å; H472-T496 HydrophobicContact CB-CG2 4.37Å; H472-T496 PolarHBondContact NE2-OG1 2.85Å; L475-T496 HydrophobicContact CB-CG2 4.27Å; L475-T496 HydrophobicContact CD1-CG2 3.73Å; L475-T496 HydrophobicContact CD2-CG2 3.94Å; L475-T496 HydrophobicContact CG-CG2 4.19Å; S493-T496 PolarHBondContact O-N 3.06Å; S493-T496 PolarHBondContact O-OG1 3.31Å; S493-T496 VanDerWaalsContact O-OG1 3.14Å; E494-T496 VanDerWaalsContact C-N 3.25Å; E494-T496 PolarHBondContact O-N 3.46Å; T496-A498 VanDerWaalsContact C-N 3.31Å; T496-A498 PolarHBondContact O-N 2.95Å
497	G	59.3	Low	58.9	Low	14 Å²	14	68.5 Å²	68.5	14%	0.144	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	9.3	175.2	0	0	0	0	0	114.8	E494 R499 A500	E494-G497 PolarHBondContact O-N 3.15Å; E494-G497 VanDerWaalsContact O-N 3.13Å; G497-R499 PolarHBondContact O-N 3.32Å; G497-A500 WeakPolarHBondContact O-CB 3.42Å; G497-A500 PolarHBondContact O-N 3.26Å
498	A	48.5	Very low	55.8	Low	25 Å²	25	72.2 Å²	72.2	21%	0.207	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-26.4	-179.3	0	0	0	0	0	113.5	T496 A500 T501	T496-A498 VanDerWaalsContact C-N 3.31Å; T496-A498 PolarHBondContact O-N 2.95Å; A498-A500 VanDerWaalsContact C-N 3.3Å; A498-A500 PolarHBondContact O-N 3.06Å; A498-T501 PolarHBondContact O-N 2.81Å; A498-T501 PolarHBondContact O-OG1 3.2Å; A498-T501 VanDerWaalsContact O-OG1 3.11Å
499	R	39.3	Very low	52.7	Low	143 Å²	143	72 Å²	72	54%	0.54	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-25.3	175.7	-149	178.7	-168	-148.9	5.8	113.6	E107 G497	E107-R499 IonicContact OE1-NH1 2.91Å; E107-R499 PolarHBondContact OE1-NH1 3.02Å; E107-R499 IonicContact OE2-CZ 3.6Å; E107-R499 IonicContact OE2-NH1 3.43Å; E107-R499 PolarHBondContact OE2-NH1 3.01Å; G497-R499 PolarHBondContact O-N 3.32Å
500	A	34.4	Very low	49.9	Very low	56 Å²	56	79.9 Å²	79.9	46%	0.463	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-21.3	179.7	0	0	0	0	0	113.4	F237 G497 A498 G502	F237-A500 HydrophobicContact CB-CB 4.1Å; F237-A500 HydrophobicContact CD1-CB 3.77Å; F237-A500 HydrophobicContact CG-CB 4.22Å; G497-A500 WeakPolarHBondContact O-CB 3.42Å; G497-A500 PolarHBondContact O-N 3.26Å; A498-A500 VanDerWaalsContact C-N 3.3Å; A498-A500 PolarHBondContact O-N 3.06Å; A500-G502 PolarHBondContact O-N 3.05Å
501	T	32.4	Very low	47.4	Very low	80 Å²	80	79.1 Å²	79.1	49%	0.491	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	19.9	179.9	49	0	0	0	0	114	A498 W503	A498-T501 PolarHBondContact O-N 2.81Å; A498-T501 PolarHBondContact O-OG1 3.2Å; A498-T501 VanDerWaalsContact O-OG1 3.11Å; T501-W503 PolarHBondContact O-N 2.91Å
502	G	25.7	Very low	44.6	Very low	58 Å²	58	87.3 Å²	87.3	60%	0.598	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	37.4	162.4	0	0	0	0	0	114.8	A500 L504	A500-G502 PolarHBondContact O-N 3.05Å; G502-L504 PolarHBondContact O-N 2.8Å
503	W	27.8	Very low	42.2	Very low	198 Å²	198	91.5 Å²	91.5	75%	0.75	52%	0.517	S	S	*	.			trans	-70	50.3	169.3	-73.4	99.6	0	0	0	112.5	T501 T505	T501-W503 PolarHBondContact O-N 2.91Å; W503-T505 PolarHBondContact O-N 3.31Å
504	L	27.5	Very low	40	Very low	152 Å²	152	99.3 Å²	99.3	80%	0.796	55%	0.549	S	S	*	.			trans	-82.9	93.3	163.6	-151.2	169.6	0	0	0	105.4	G502 E506	G502-L504 PolarHBondContact O-N 2.8Å; L504-E506 PolarHBondContact O-N 3.05Å
505	T	31	Very low	38	Very low	54 Å²	54	102.8 Å²	102.8	33%	0.331	57%	0.568	S	S	.	*			trans	-55.8	130.7	173.7	48.1	0	0	0	0	108.6	W503 N507 V511	W503-T505 PolarHBondContact O-N 3.31Å; T505-N507 CarbonylContact C-O 3.55Å; T505-N507 WeakPolarHBondContact CB-O 3.21Å; T505-N507 CarbonylContact O-C 3.56Å; T505-N507 VanDerWaalsContact O-C 3.22Å; T505-N507 PolarHBondContact O-N 2.8Å; T505-N507 PolarHBondContact OG1-O 2.72Å; T505-V511 HydrophobicContact CG2-CG2 4.12Å
506	E	31.1	Very low	35.6	Very low	196 Å²	196	106.1 Å²	106.1	92%	0.916	60%	0.604	S	S	*	*	S	Bend	trans	-63.3	-8.9	-171.8	-158.3	169.6	-159	0	0	113.2	L504	L504-E506 PolarHBondContact O-N 3.05Å
507	N	27.6	Very low	34.1	Very low	136 Å²	136	109.9 Å²	109.9	73%	0.727	62%	0.623	S	S	*	*	S	Bend	trans	-120.3	130.5	156.1	-63	-87	0	0	0	109.1	T505 G509	T505-N507 CarbonylContact C-O 3.55Å; T505-N507 WeakPolarHBondContact CB-O 3.21Å; T505-N507 CarbonylContact O-C 3.56Å; T505-N507 VanDerWaalsContact O-C 3.22Å; T505-N507 PolarHBondContact O-N 2.8Å; T505-N507 PolarHBondContact OG1-O 2.72Å; N507-G509 PolarHBondContact O-N 2.97Å
508	G	29.8	Very low	33	Very low	85 Å²	85	115.1 Å²	115.1	88%	0.876	65%	0.652	S	S	*	*			trans	-77.3	52.2	-174.7	0	0	0	0	0	115.1
509	G	28.4	Very low	32.2	Very low	50 Å²	50	116.9 Å²	116.9	52%	0.515	67%	0.672	S	S	.	*			trans	-84.6	151.4	171.1	0	0	0	0	0	112.1	N507 V511	N507-G509 PolarHBondContact O-N 2.97Å; G509-V511 PolarHBondContact O-N 3Å
510	Q	27.7	Very low	31.8	Very low	197 Å²	197	115.7 Å²	115.7	92%	0.921	68%	0.681	S	S	*	*			trans	-64.1	124.1	166.8	-70	178.2	-97.2	0	0	109.3	E512	Q510-E512 PolarHBondContact O-N 2.88Å
511	V	34.1	Very low	31.8	Very low	106 Å²	106	121.6 Å²	121.6	64%	0.642	70%	0.699	S	S	*	*			trans	-79.7	103.9	166	-179.2	0	0	0	0	107.2	T505 G509	T505-V511 HydrophobicContact CG2-CG2 4.12Å; G509-V511 PolarHBondContact O-N 3Å
512	E	32.1	Very low	31.7	Very low	177 Å²	177	126.5 Å²	126.5	83%	0.827	72%	0.716	S	S	*	*			trans	-62.7	135.1	161.1	-67.6	-165.9	130.9	0	0	108.6	Q510 E514	Q510-E512 PolarHBondContact O-N 2.88Å; E512-E514 PolarHBondContact O-N 3.41Å
513	N	39.2	Very low	32	Very low	90 Å²	90	128.6 Å²	128.6	48%	0.481	73%	0.727	S	S	.	*			trans	-68.6	98.6	-174.6	-82.1	-15.1	0	0	0	111.5	S489 L515	S489-N513 PolarHBondContact OG-ND2 2.86Å; N513-L515 PolarHBondContact O-N 3.21Å
514	E	35.1	Very low	32.3	Very low	202 Å²	202	122.8 Å²	122.8	94%	0.944	73%	0.728	S	S	*	*			trans	-69.2	25.1	160.1	-75.6	-138.8	122.9	0	0	113.2	E512	E512-E514 PolarHBondContact O-N 3.41Å
515	L	38.2	Very low	32.4	Very low	97 Å²	97	121 Å²	121	51%	0.508	73%	0.729	S	S	.	*	S	Bend	trans	-90.3	96.5	158.4	-64.4	177.6	0	0	0	107.1	N513 L517	N513-L515 PolarHBondContact O-N 3.21Å; L515-L517 PolarHBondContact O-N 3.14Å
516	G	31.1	Very low	32.6	Very low	78 Å²	78	125.2 Å²	125.2	80%	0.804	75%	0.754	S	S	*	*			trans	-67	62.7	-171.9	0	0	0	0	0	115.5
517	L	37.2	Very low	32.5	Very low	114 Å²	114	119.3 Å²	119.3	60%	0.597	75%	0.746	S	S	*	*			trans	-131.4	22.9	-175.6	-65.4	176.5	0	0	0	112.5	L515 G519	L515-L517 PolarHBondContact O-N 3.14Å; L517-G519 PolarHBondContact O-N 3.28Å
518	T	35.4	Very low	32.8	Very low	123 Å²	123	118.8 Å²	118.8	76%	0.755	75%	0.753	S	S	*	*			trans	-85.3	91.2	172.6	43.2	0	0	0	0	111	V520	T518-V520 PolarHBondContact O-N 3.35Å
519	G	30.9	Very low	33	Very low	62 Å²	62	122.2 Å²	122.2	64%	0.639	75%	0.746	S	S	*	*			trans	-63.9	122.7	169.4	0	0	0	0	0	111	L517 H521	L517-G519 PolarHBondContact O-N 3.28Å; G519-H521 PolarHBondContact O-N 3.02Å; G519-H521 VanDerWaalsContact O-N 3.14Å
520	V	31.5	Very low	33.3	Very low	118 Å²	118	127.3 Å²	127.3	72%	0.715	75%	0.754	S	S	*	*			trans	-71.2	107.4	-177.1	179.9	0	0	0	0	110.5	T518	T518-V520 PolarHBondContact O-N 3.35Å
521	H	33.6	Very low	33.6	Very low	181 Å²	181	125.8 Å²	125.8	84%	0.838	75%	0.747	S	S	*	*			trans	-95.8	103.4	164.8	-78.7	-88.1	0	0	0	109.8	G519 A523	G519-H521 PolarHBondContact O-N 3.02Å; G519-H521 VanDerWaalsContact O-N 3.14Å; H521-A523 PolarHBondContact O-N 3.14Å
522	H	30.6	Very low	33.3	Very low	183 Å²	183	128.3 Å²	128.3	85%	0.847	76%	0.757	S	S	*	*			trans	-73.3	109.8	166.5	-79.3	-53.7	0	0	0	110.1
523	A	33	Very low	33.7	Very low	101 Å²	101	125.3 Å²	125.3	84%	0.835	75%	0.751	S	S	*	*			trans	-103	101.6	157.5	0	0	0	0	0	107.9	H521	H521-A523 PolarHBondContact O-N 3.14Å
524	G	32.3	Very low	33.5	Very low	76 Å²	76	130 Å²	130	78%	0.784	77%	0.769	S	S	*	*			trans	-73.1	128.1	177.4	0	0	0	0	0	111
525	S	30.3	Very low	33.4	Very low	114 Å²	114	130.4 Å²	130.4	80%	0.797	77%	0.768	S	S	*	*			trans	-60.1	140.4	-177.9	-174.9	0	0	0	0	113.2
526	V	35.7	Very low	33.5	Very low	144 Å²	144	129.5 Å²	129.5	87%	0.873	78%	0.782	S	S	*	*			trans	-110.1	123.1	148.8	-74.2	0	0	0	0	107.4
527	G	29.1	Very low	33.7	Very low	72 Å²	72	129 Å²	129	74%	0.742	78%	0.777	S	S	*	*			trans	-84.6	150.9	-169.6	0	0	0	0	0	114.1
528	S	34.4	Very low	33.7	Very low	124 Å²	124	136.1 Å²	136.1	87%	0.867	80%	0.796	S	S	*	*			trans	-145.4	119.2	156.1	-174.4	0	0	0	0	107.1
529	E	33.6	Very low	33.8	Very low	157 Å²	157	139.1 Å²	139.1	73%	0.734	80%	0.799	S	S	*	*			trans	-104.5	166.7	-178.3	-63.5	-176.1	111.4	0	0	111.6
530	F	33.3	Very low	34.2	Very low	158 Å²	158	143.4 Å²	143.4	69%	0.693	81%	0.807	S	S	*	*			trans	78.6	111.6	162	-62.1	-68.5	0	0	0	120.8
531	H	34.3	Very low	34.6	Very low	165 Å²	165	146.6 Å²	146.6	76%	0.764	81%	0.811	S	S	*	*			trans	81.5	104.1	135.6	-72.1	-1.8	0	0	0	119.6
532	N	28	Very low	34.8	Very low	159 Å²	159	142.9 Å²	142.9	85%	0.85	80%	0.801	S	S	*	*			trans	-117.3	112	151.1	-178.6	7.8	0	0	0	108
533	T	39.9	Very low	35.2	Very low	114 Å²	114	140.1 Å²	140.1	70%	0.699	79%	0.792	S	S	*	*			trans	-136.2	114.3	172.7	37.2	0	0	0	0	111.1
534	H	36.2	Very low	35.7	Very low	187 Å²	187	142.7 Å²	142.7	87%	0.866	79%	0.787	S	S	*	*			trans	-10.8	121	172	-78.7	-86.1	0	0	0	118.9
535	F	32.7	Very low	36.1	Very low	211 Å²	211	145.2 Å²	145.2	93%	0.925	78%	0.782	S	S	*	*			trans	-81.7	135.3	147.7	-107.9	-98	0	0	0	110.5
536	G	39.7	Very low	36.5	Very low	78 Å²	78	146.4 Å²	146.4	80%	0.804	78%	0.78	S	S	*	*			trans	-167.7	66.9	-179.3	0	0	0	0	0	111.5
537	G	35	Very low	36.9	Very low	68 Å²	68	144.8 Å²	144.8	70%	0.701	78%	0.775	S	S	*	*			trans	-84.2	162.1	-165.5	0	0	0	0	0	116.2
538	R	38.5	Very low	38	Very low	263 Å²	263	146.1 Å²	146.1	99%	0.992	77%	0.77	S	S	*	*			trans	-142.4	175.2	152.3	-101	168.5	-153.3	-149.2	3.7	109.5
539	K	37.8	Very low	38.3	Very low	186 Å²	186	147.9 Å²	147.9	81%	0.809	77%	0.77	S	S	*	*			trans	-130.8	165.1	-149.9	-158	-176.3	-175.8	176.4	0	111.1
540	L	39.5	Very low	38.7	Very low	153 Å²	153	144.2 Å²	144.2	80%	0.801	77%	0.774	S	S	*	*			trans	78	142.7	168.4	-60.6	158	0	0	0	114.3
541	K	38.5	Very low	39.1	Very low	185 Å²	185	144.4 Å²	144.4	80%	0.804	78%	0.782	S	S	*	*			cis	-156.6	177.1	-4.2	-176.6	164.6	174.7	-172.5	0	110.2
542	T	38.5	Very low	39.2	Very low	102 Å²	102	143.3 Å²	143.3	63%	0.626	78%	0.781	S	S	*	*			trans	-58.5	173.7	-179.1	56.3	0	0	0	0	116
543	D	38.9	Very low	39.8	Very low	125 Å²	125	140.5 Å²	140.5	67%	0.668	77%	0.77	S	S	*	*			cis	-156.2	155.9	28.2	-100.5	-54.8	0	0	0	115.7
544	H	44.1	Very low	39.7	Very low	155 Å²	155	140.7 Å²	140.7	72%	0.718	77%	0.772	S	S	*	*			trans	41.7	130.7	145.4	-82	-69.2	0	0	0	128
545	N	39.9	Very low	39.8	Very low	130 Å²	130	139.6 Å²	139.6	70%	0.695	77%	0.766	S	S	*	*				100.4	115.2	127.1	-71	-8.4	0	0	0	125.8
546	N	38.3	Very low	39.9	Very low	139 Å²	139	140 Å²	140	74%	0.743	76%	0.763	S	S	*	*			trans	57.2	111.9	133.3	-73.7	6.4	0	0	0	125.2
547	S	45.2	Very low	39.8	Very low	109 Å²	109	141.2 Å²	141.2	76%	0.762	76%	0.759	S	S	*	*				55.8	157.3	110.3	-59.6	0	0	0	0	123.7
548	P	51.2	Low	40.2	Very low	101 Å²	101	146.1 Å²	146.1	66%	0.656	77%	0.77	S	S	*	*			cis	-143.7	-169.3	-40.1	42.3	-24.3	0	0	0	114.5
549	D	40.7	Very low	40.5	Very low	160 Å²	160	140.6 Å²	140.6	86%	0.856	76%	0.76	S	S	*	*			trans	72.7	134	154.9	-59.8	-24.7	0	0	0	122.5
550	G	42.2	Very low	40.6	Very low	80 Å²	80	140.1 Å²	140.1	83%	0.825	76%	0.76	S	S	*	*			trans	156.3	95.5	172.7	0	0	0	0	0	114.4
551	L	42.2	Very low	40.6	Very low	163 Å²	163	138.6 Å²	138.6	85%	0.853	75%	0.753	S	S	*	*			trans	-94.6	131	-177.1	-73.8	160.2	0	0	0	113.4
552	N	37.4	Very low	40.7	Very low	141 Å²	141	138 Å²	138	75%	0.754	75%	0.753	S	S	*	*				173.8	115.8	114.9	-96.9	-53.2	0	0	0	116.1
553	T	39.3	Very low	40.7	Very low	101 Å²	101	136.1 Å²	136.1	62%	0.62	76%	0.755	S	S	*	*				64.1	92.9	112.2	-47.9	0	0	0	0	121.2
554	T	38.1	Very low	40.7	Very low	118 Å²	118	136.2 Å²	136.2	72%	0.724	77%	0.765	S	S	*	*				96.7	140.9	128.5	61.3	0	0	0	0	125.5
555	H	38.2	Very low	40.3	Very low	164 Å²	164	140 Å²	140	76%	0.759	77%	0.773	S	S	*	*			trans	90.1	106.8	148	-86.1	-68.5	0	0	0	122
556	Y	35.1	Very low	40.4	Very low	218 Å²	218	139.1 Å²	139.1	86%	0.855	78%	0.775	S	S	*	*			trans	0.1	142	139.9	-67.8	-96.6	0	0	0	117.3
557	S	37.4	Very low	40.4	Very low	104 Å²	104	138.9 Å²	138.9	73%	0.727	77%	0.773	S	S	*	*			cis	-159.5	157.2	33.2	46.9	0	0	0	0	112.9
558	D	44.4	Very low	39.8	Very low	171 Å²	171	143.7 Å²	143.7	91%	0.914	78%	0.776	S	S	*	*			trans	-105.2	142.1	179.7	-68.2	-51.6	0	0	0	114.7
559	D	45	Very low	39.3	Very low	148 Å²	148	144.2 Å²	144.2	79%	0.791	78%	0.78	S	S	*	*			trans	-76.1	165.6	169.6	-71.9	-63.5	0	0	0	111.5
560	E	39.5	Very low	39.1	Very low	175 Å²	175	147.2 Å²	147.2	82%	0.818	78%	0.779	S	S	*	*				47.7	138.7	66.9	-86.3	-158.3	-137.3	0	0	113.9
561	N	38.6	Very low	38.9	Very low	121 Å²	121	150.6 Å²	150.6	65%	0.647	78%	0.778	S	S	*	*			cis	-165.7	178.4	-0.3	178	17.9	0	0	0	108.6
562	E	41.1	Very low	38.7	Very low	172 Å²	172	146.5 Å²	146.5	80%	0.804	78%	0.775	S	S	*	*			trans	69.6	157.3	165.5	-51.7	-151.1	154.4	0	0	118.8
563	G	37.5	Very low	38.6	Very low	64 Å²	64	150.5 Å²	150.5	66%	0.66	78%	0.78	S	S	*	*			cis	173.5	171.8	-10.4	0	0	0	0	0	115.4
564	S	40.4	Very low	38.3	Very low	127 Å²	127	152.4 Å²	152.4	89%	0.888	79%	0.785	S	S	*	*			trans	74.4	147.8	164.2	-64.8	0	0	0	0	121.7
565	R	34.4	Very low	38.2	Very low	233 Å²	233	156.5 Å²	156.5	88%	0.879	80%	0.796	S	S	*	*			trans	-122.1	172.1	178.1	-56.9	170.6	167.4	175.2	-4.9	109.6
566	P	42.3	Very low	38	Very low	113 Å²	113	158.5 Å²	158.5	73%	0.734	81%	0.808	S	S	*	*				-156.1	152.3	90.3	38.2	-18.1	0	0	0	119.3
567	N	37.6	Very low	37.9	Very low	133 Å²	133	151.3 Å²	151.3	71%	0.711	80%	0.8	S	S	*	*			trans	48.2	109.7	140.3	-58.7	-15.9	0	0	0	124.6
568	Y	33.4	Very low	37.7	Very low	211 Å²	211	151.6 Å²	151.6	83%	0.827	81%	0.809	S	S	*	*				44.5	157.8	107.1	-66.6	-57.4	0	0	0	123.4
569	P	41.7	Very low	37.1	Very low	112 Å²	112	148.4 Å²	148.4	73%	0.727	81%	0.806	S	S	*	*			cis	-139.8	179	-11.4	34	-12.6	0	0	0	117.6
570	R	36.7	Very low	36.5	Very low	222 Å²	222	146.7 Å²	146.7	84%	0.838	81%	0.806	S	S	*	*				119.5	136.7	128.9	-135.6	-171.4	-170.1	-179.3	4.5	119
571	N	37.7	Very low	36.1	Very low	152 Å²	152	143.6 Å²	143.6	81%	0.813	81%	0.81	S	S	*	*			trans	67.1	121.8	167.3	-63.4	-12.5	0	0	0	118.6
572	G	37.7	Very low	36	Very low	76 Å²	76	142.3 Å²	142.3	78%	0.784	82%	0.817	S	S	*	*			trans	-176	8.5	-179.1	0	0	0	0	0	122.8
573	R	34.1	Very low	35.7	Very low	226 Å²	226	137.8 Å²	137.8	85%	0.853	81%	0.808	S	S	*	*			trans	51	109.8	160.8	-165.4	-177.8	-165.1	-160.8	4.7	120.4
574	L	33.5	Very low	35.8	Very low	141 Å²	141	141.9 Å²	141.9	74%	0.738	81%	0.813	S	S	*	*			trans	56.4	104.9	148	-58.6	172.3	0	0	0	120
575	H	37.2	Very low	35.8	Very low	203 Å²	203	140.5 Å²	140.5	94%	0.94	81%	0.81	S	S	*	*				-158.1	132.2	126.6	-106.4	66.3	0	0	0	107.3
576	M	33.8	Very low	36.1	Very low	206 Å²	206	133.2 Å²	133.2	100%	1.015	80%	0.799	S	S	*	*			trans	-125.3	101.9	-176.4	-165.7	173.4	-169.7	0	0	110.9
577	G	33.2	Very low	36	Very low	67 Å²	67	133.9 Å²	133.9	69%	0.691	80%	0.801	S	S	*	*			trans	-152.1	153.5	175	0	0	0	0	0	110.8
578	A	32.6	Very low	36.1	Very low	111 Å²	111	132.4 Å²	132.4	92%	0.917	81%	0.808	S	S	*	*			trans	54.1	80.2	172.7	0	0	0	0	0	117.4
579	A	32	Very low	36.5	Very low	104 Å²	104	125.9 Å²	125.9	86%	0.86	80%	0.797	S	S	*	*			trans	-154.1	87.2	159.9	0	0	0	0	0	113
580	S	30.9	Very low	36.1	Very low	111 Å²	111	123.9 Å²	123.9	78%	0.776	80%	0.797	S	S	*	*			trans	174.7	54.9	145.1	-164.2	0	0	0	0	111.8
581	A	32.5	Very low	36.4	Very low	110 Å²	110	121.3 Å²	121.3	91%	0.909	80%	0.799	S	S	*	*			trans	-115.3	48.1	178.4	0	0	0	0	0	111.3
582	A	35	Very low	36.4	Very low	95 Å²	95	120.4 Å²	120.4	79%	0.785	80%	0.799	S	S	*	*	S	Bend	trans	-144.2	-8.9	-173	0	0	0	0	0	115.8
583	A	36.1	Very low	36.5	Very low	76 Å²	76	122.9 Å²	122.9	63%	0.628	80%	0.801	S	S	*	*	S	Bend	trans	-105.2	-9.1	-168.6	0	0	0	0	0	115.7
584	I	38.4	Very low	36.6	Very low	150 Å²	150	122.2 Å²	122.2	77%	0.769	81%	0.805	S	S	*	*	S	Bend	trans	-98.1	-20.7	-172.1	-66.1	172.1	0	0	0	112.5	A586	I584-A586 VanDerWaalsContact C-N 3.25Å; I584-A586 PolarHBondContact O-N 2.81Å; I584-A586 VanDerWaalsContact O-N 3.16Å
585	A	42.1	Very low	36.5	Very low	98 Å²	98	121.5 Å²	121.5	81%	0.81	81%	0.806	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-10.3	-174	0	0	0	0	0	115.6
586	A	40.3	Very low	36.5	Very low	80 Å²	80	120.4 Å²	120.4	66%	0.661	80%	0.801	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-17	-173.4	0	0	0	0	0	115	I584	I584-A586 VanDerWaalsContact C-N 3.25Å; I584-A586 PolarHBondContact O-N 2.81Å; I584-A586 VanDerWaalsContact O-N 3.16Å
587	V	39.7	Very low	36.4	Very low	127 Å²	127	114.8 Å²	114.8	77%	0.77	78%	0.782	S	S	*	*	G	3₁₀ helix	trans	-80	-20.8	-172.8	-178	0	0	0	0	112.5	A589	V587-A589 PolarHBondContact O-N 3.19Å
588	A	39.9	Very low	36.5	Very low	103 Å²	103	120.5 Å²	120.5	85%	0.851	80%	0.795	S	S	*	*	G	3₁₀ helix	trans	-70.9	-4.7	178.7	0	0	0	0	0	114.8
589	A	42.5	Very low	36.6	Very low	74 Å²	74	123.7 Å²	123.7	61%	0.612	79%	0.791	S	S	*	*	G	3₁₀ helix	trans	-90.8	-11	-172.7	0	0	0	0	0	115.5	V587 L591	V587-A589 PolarHBondContact O-N 3.19Å; A589-L591 VanDerWaalsContact C-N 3.3Å; A589-L591 PolarHBondContact O-N 3.09Å
590	G	31.5	Very low	37.2	Very low	69 Å²	69	123.4 Å²	123.4	71%	0.711	78%	0.78	S	S	*	*			trans	65.5	8	162.8	0	0	0	0	0	119.3
591	L	42.9	Very low	37.4	Very low	168 Å²	168	123.2 Å²	123.2	88%	0.88	78%	0.779	S	S	*	*			trans	-86.7	138.2	-179.2	-65.5	177.9	0	0	0	112.9	A589	A589-L591 VanDerWaalsContact C-N 3.3Å; A589-L591 PolarHBondContact O-N 3.09Å
592	T	39.1	Very low	37.6	Very low	133 Å²	133	124.6 Å²	124.6	82%	0.816	77%	0.77	S	S	*	*			trans	-107.8	140.9	-173.3	56.4	0	0	0	0	113.3
593	P	39.3	Very low	37.7	Very low	128 Å²	128	127.8 Å²	127.8	83%	0.831	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-103.6	158.8	160.4	33.2	-24.5	0	0	0	112.3
594	K	35.8	Very low	37.7	Very low	213 Å²	213	132.7 Å²	132.7	93%	0.926	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-93.3	161.9	-173.4	-84.9	178.7	175.8	173.9	0	114.5
595	V	31.5	Very low	37.6	Very low	126 Å²	126	128.7 Å²	128.7	76%	0.764	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-72.3	143.8	179	-178.1	0	0	0	0	112.7
596	H	37.2	Very low	37.4	Very low	180 Å²	180	132.5 Å²	132.5	83%	0.833	77%	0.773	S	S	*	*			trans	-174.2	109.3	138.1	-95.2	29.5	0	0	0	106.8
597	S	31.4	Very low	37.3	Very low	88 Å²	88	133.4 Å²	133.4	62%	0.615	77%	0.767	S	S	*	*				89.3	115.1	63.6	68.8	0	0	0	0	114.5
598	L	35.7	Very low	37.2	Very low	186 Å²	186	134.4 Å²	134.4	97%	0.974	76%	0.761	S	S	*	*			trans	-166.5	164.4	149.8	-103.9	165.7	0	0	0	110.2
599	H	35.6	Very low	37.1	Very low	179 Å²	179	139.2 Å²	139.2	83%	0.829	76%	0.757	S	S	*	*			trans	-124.4	-165.3	-158.3	-145.5	-144.8	0	0	0	112
600	P	43.6	Very low	36.8	Very low	98 Å²	98	143.2 Å²	143.2	64%	0.636	77%	0.768	S	S	*	*				-138	-162.5	-129	43.5	-19.6	0	0	0	116
601	S	36.2	Very low	36.9	Very low	107 Å²	107	143.6 Å²	143.6	75%	0.748	77%	0.773	S	S	*	*			trans	-177.4	168.7	161.1	35.9	0	0	0	0	108.7
602	L	36.8	Very low	36.6	Very low	139 Å²	139	141.4 Å²	141.4	73%	0.728	77%	0.771	S	S	*	*			cis	-161.7	161.8	-31.8	-88.3	167.7	0	0	0	104
603	F	36.2	Very low	36.2	Very low	161 Å²	161	141 Å²	141	71%	0.706	77%	0.768	S	S	*	*			cis	-130	173	8.3	-81	-80.6	0	0	0	108.2
604	Q	35.7	Very low	36.1	Very low	180 Å²	180	142.8 Å²	142.8	84%	0.841	77%	0.769	S	S	*	*				50.8	129.7	62.4	-62.2	176.7	-14.5	0	0	116.1
605	G	36.9	Very low	35.9	Very low	66 Å²	66	142.5 Å²	142.5	68%	0.68	76%	0.762	S	S	*	*			cis	173.7	-176	-8.1	0	0	0	0	0	114.1
606	E	37.2	Very low	36.2	Very low	177 Å²	177	143.3 Å²	143.3	83%	0.827	76%	0.762	S	S	*	*			trans	66.8	152.7	145.4	-68.7	-145.6	92.6	0	0	121.7
607	N	38.4	Very low	36.5	Very low	99 Å²	99	141.4 Å²	141.4	53%	0.529	76%	0.757	S	S	.	*			cis	-169.8	145.8	-27.7	-141	-26.5	0	0	0	111.4
608	K	38.4	Very low	36.8	Very low	149 Å²	149	145.2 Å²	145.2	65%	0.648	77%	0.77	S	S	*	*			trans	62.1	169.2	155.5	-67.9	146.7	-170.8	157.6	0	117.9
609	R	36.6	Very low	36.9	Very low	204 Å²	204	139.7 Å²	139.7	77%	0.77	76%	0.759	S	S	*	*			cis	-165.9	165.1	-24.6	-109	177.9	-178.8	178.7	-1.6	110.3
610	N	37.7	Very low	36.9	Very low	157 Å²	157	139.2 Å²	139.2	84%	0.84	76%	0.762	S	S	*	*			trans	68	154.4	165	-51.2	-14.4	0	0	0	116.6
611	G	32.3	Very low	36.5	Very low	78 Å²	78	141 Å²	141	80%	0.804	77%	0.771	S	S	*	*			cis	137	100	-13.6	0	0	0	0	0	115.1
612	S	36.3	Very low	36.5	Very low	121 Å²	121	142.3 Å²	142.3	85%	0.846	78%	0.775	S	S	*	*			trans	-162.5	166	163.8	-165.9	0	0	0	0	111.8
613	V	31	Very low	36.4	Very low	125 Å²	125	144.6 Å²	144.6	76%	0.758	78%	0.782	S	S	*	*			trans	-139.8	133.7	-174.4	174.9	0	0	0	0	111.1
614	I	36.4	Very low	36.3	Very low	165 Å²	165	145 Å²	145	85%	0.846	79%	0.786	S	S	*	*			trans	-135.6	149.8	161.1	-64.9	-175.4	0	0	0	108.2
615	R	31.8	Very low	36.2	Very low	207 Å²	207	141.7 Å²	141.7	78%	0.781	78%	0.782	S	S	*	*			trans	-107.2	158.9	177.8	-64.3	175.5	177.5	157.9	-2.1	110.6
616	D	39.6	Very low	36.3	Very low	143 Å²	143	144.5 Å²	144.5	77%	0.765	79%	0.789	S	S	*	*				172.9	114.1	127.8	-81	-16.4	0	0	0	108
617	I	42	Very low	36.3	Very low	140 Å²	140	139.2 Å²	139.2	72%	0.718	78%	0.782	S	S	*	*				61.3	76.1	85.8	-54.4	166.9	0	0	0	113
618	N	38.9	Very low	35.9	Very low	168 Å²	168	142.9 Å²	142.9	90%	0.898	80%	0.8	S	S	*	*				-166.2	156.1	113.8	-103.6	-29.2	0	0	0	110.2
619	G	36.9	Very low	35.7	Very low	71 Å²	71	142.5 Å²	142.5	73%	0.732	81%	0.811	S	S	*	*			trans	-121	147.5	-169.9	0	0	0	0	0	114.5
620	N	36.2	Very low	35.5	Very low	168 Å²	168	141.6 Å²	141.6	90%	0.898	82%	0.817	S	S	*	*			trans	-154.6	146.5	135.9	-132.8	-13.3	0	0	0	110.2
621	T	33.9	Very low	35.3	Very low	135 Å²	135	137.8 Å²	137.8	83%	0.828	82%	0.815	S	S	*	*			trans	-113.9	117.2	-169.6	51.8	0	0	0	0	113.2
622	T	36.4	Very low	35.4	Very low	136 Å²	136	142.5 Å²	142.5	83%	0.834	82%	0.821	S	S	*	*			trans	-130.4	119.7	163.3	49.3	0	0	0	0	109.2	E624	T622-E624 PolarHBondContact O-N 3.1Å
623	H	34.6	Very low	35.3	Very low	187 Å²	187	140.2 Å²	140.2	87%	0.866	82%	0.816	S	S	*	*			trans	-94	89.1	-167	-168.6	-56.8	0	0	0	112.1
624	E	35.1	Very low	35.4	Very low	169 Å²	169	142.3 Å²	142.3	79%	0.79	82%	0.822	S	S	*	*			trans	-70.3	169.4	172.2	-80.9	-90.7	106.7	0	0	112.9	T622	T622-E624 PolarHBondContact O-N 3.1Å
625	S	32.5	Very low	35.3	Very low	110 Å²	110	138 Å²	138	77%	0.769	82%	0.819	S	S	*	*			trans	-78.9	137.1	-174.8	-59.1	0	0	0	0	113.4	G627	S625-G627 PolarHBondContact O-N 3.19Å
626	P	40.9	Very low	35.3	Very low	125 Å²	125	135.9 Å²	135.9	81%	0.812	82%	0.821	S	S	*	*			trans	-76.7	112.3	169.5	30.1	-32	0	0	0	111.2
627	G	35.7	Very low	35.2	Very low	66 Å²	66	132.9 Å²	132.9	68%	0.68	82%	0.816	S	S	*	*			trans	-77.6	159.7	172.3	0	0	0	0	0	113.8	S625	S625-G627 PolarHBondContact O-N 3.19Å
628	L	31	Very low	34.8	Very low	177 Å²	177	133.9 Å²	133.9	93%	0.927	82%	0.823	S	S	*	*			trans	-28.4	135	173.9	-62.3	163.8	0	0	0	116.3
629	T	32.8	Very low	34.3	Very low	140 Å²	140	129.6 Å²	129.6	86%	0.859	82%	0.818	S	S	*	*			trans	-127.7	126.8	154.8	-70.1	0	0	0	0	108.3
630	M	32.7	Very low	34.1	Very low	186 Å²	186	133 Å²	133	92%	0.916	82%	0.824	S	S	*	*			trans	-81.7	136.4	174.4	-69.6	-165.6	-67.2	0	0	110.6
631	G	34.8	Very low	33.8	Very low	76 Å²	76	129.4 Å²	129.4	78%	0.784	82%	0.818	S	S	*	*			trans	-132.5	111	170.2	0	0	0	0	0	110.1
632	L	33	Very low	33.9	Very low	178 Å²	178	126 Å²	126	93%	0.932	80%	0.804	S	S	*	*			trans	-76.9	131.7	172.3	-79.7	164	0	0	0	109.8
633	G	34.3	Very low	33.7	Very low	72 Å²	72	125.5 Å²	125.5	74%	0.742	80%	0.801	S	S	*	*			trans	-162.5	100.6	175.2	0	0	0	0	0	111.6
634	L	32.8	Very low	33.7	Very low	169 Å²	169	124.2 Å²	124.2	89%	0.885	80%	0.799	S	S	*	*			trans	-73.3	130.3	168.9	-81.1	84.9	0	0	0	109.6
635	G	35.4	Very low	33.5	Very low	75 Å²	75	121.4 Å²	121.4	77%	0.773	80%	0.797	S	S	*	*			trans	-146.5	125.5	170.4	0	0	0	0	0	108.9
636	I	32.2	Very low	33.7	Very low	163 Å²	163	120.9 Å²	120.9	84%	0.836	80%	0.8	S	S	*	*			trans	-106.5	150	-165.9	-47.7	175.4	0	0	0	110.5
637	A	36.1	Very low	33.4	Very low	79 Å²	79	119.4 Å²	119.4	65%	0.653	80%	0.798	S	S	*	*			trans	108.2	138.6	148.6	0	0	0	0	0	119.5
638	N	34.6	Very low	33.2	Very low	162 Å²	162	124.1 Å²	124.1	87%	0.866	81%	0.807	S	S	*	*			trans	66.2	99	152.7	-57.7	-8.6	0	0	0	118.6
639	G	29.2	Very low	33.6	Very low	77 Å²	77	125.2 Å²	125.2	79%	0.794	81%	0.805	S	S	*	*			trans	-98.8	165.7	165.1	0	0	0	0	0	113.5
640	V	32.9	Very low	33.7	Very low	142 Å²	142	123.6 Å²	123.6	86%	0.861	80%	0.796	S	S	*	*			trans	-139	121.6	164.3	177	0	0	0	0	108.1
641	A	30	Very low	33.6	Very low	94 Å²	94	120.3 Å²	120.3	78%	0.777	79%	0.791	S	S	*	*			trans	-76	150.2	173.6	0	0	0	0	0	111.1
642	A	34.4	Very low	33.8	Very low	64 Å²	64	124.8 Å²	124.8	53%	0.529	79%	0.792	S	S	.	*			trans	-166.4	142.1	162.6	0	0	0	0	0	108.6	K305	K305-A642 WeakPolarHBondContact CE-O 3.19Å; K305-A642 PolarHBondContact NZ-O 3.06Å
643	T	33.2	Very low	33.9	Very low	125 Å²	125	124 Å²	124	77%	0.767	79%	0.789	S	S	*	*			trans	-128.1	136.4	-164.3	-23.2	0	0	0	0	111
644	I	34.5	Very low	33.9	Very low	160 Å²	160	125.5 Å²	125.5	82%	0.821	79%	0.787	S	S	*	*			trans	65.9	149.4	161.1	-70.4	154.6	0	0	0	117.9
645	S	30.2	Very low	33.8	Very low	109 Å²	109	123.6 Å²	123.6	76%	0.762	78%	0.783	S	S	*	*			trans	-97.5	153.2	-177.1	-50.3	0	0	0	0	112.4
646	A	37.2	Very low	33.9	Very low	100 Å²	100	127.6 Å²	127.6	83%	0.826	79%	0.787	S	S	*	*			trans	-139.7	118.9	150.1	0	0	0	0	0	108.4
647	A	33.4	Very low	34.2	Very low	93 Å²	93	127.1 Å²	127.1	77%	0.769	78%	0.781	S	S	*	*			trans	-111.6	120.1	174.6	0	0	0	0	0	108.4
648	L	33.4	Very low	34.3	Very low	165 Å²	165	132.4 Å²	132.4	86%	0.864	79%	0.791	S	S	*	*			trans	-124.9	119.5	174.1	-76	168.9	0	0	0	108.2
649	F	38.6	Very low	34.2	Very low	201 Å²	201	131.4 Å²	131.4	88%	0.882	78%	0.782	S	S	*	*			trans	-111.9	127.3	162.7	-82.6	-75.1	0	0	0	108.1
650	P	34.6	Very low	34.7	Very low	105 Å²	105	137.1 Å²	137.1	68%	0.682	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-76.9	150.7	-179.5	32.2	-34.8	0	0	0	111.3
651	S	31.5	Very low	34.8	Very low	117 Å²	117	137.5 Å²	137.5	82%	0.818	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-74.4	128.7	169.8	-171.8	0	0	0	0	110.4
652	H	38.2	Very low	35.1	Very low	171 Å²	171	138.7 Å²	138.7	79%	0.792	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-91.2	128.8	161.7	-85.7	-93.2	0	0	0	108.9
653	N	34.4	Very low	35.1	Very low	162 Å²	162	139.5 Å²	139.5	87%	0.866	79%	0.789	S	S	*	*			trans	-138.3	130.8	153.9	-161	10.4	0	0	0	109
654	S	35.5	Very low	35.2	Very low	102 Å²	102	142 Å²	142	71%	0.713	79%	0.792	S	S	*	*			trans	-100.1	144.7	-175.2	-75.8	0	0	0	0	111.4
655	T	31.2	Very low	35.3	Very low	130 Å²	130	140.4 Å²	140.4	80%	0.798	79%	0.785	S	S	*	*			trans	-55.5	144.7	175.1	48.3	0	0	0	0	113.5
656	N	37.2	Very low	35.7	Very low	159 Å²	159	144.1 Å²	144.1	85%	0.85	78%	0.783	S	S	*	*			trans	-152.4	158.3	131.8	-115.2	-25.2	0	0	0	112.9
657	H	36.8	Very low	35.8	Very low	153 Å²	153	147.5 Å²	147.5	71%	0.708	78%	0.782	S	S	*	*			trans	-79.6	150.8	-169.8	-70.9	-83.7	0	0	0	114.1
658	H	39.8	Very low	36	Very low	189 Å²	189	150.8 Å²	150.8	88%	0.875	78%	0.781	S	S	*	*				-162	148.5	100.2	-102.2	-71.1	0	0	0	112.5
659	Q	31.4	Very low	36.3	Very low	141 Å²	141	148.8 Å²	148.8	66%	0.659	78%	0.778	S	S	*	*			trans	-90.2	154.6	172.3	-62.5	161.9	-77.1	0	0	110.2
660	H	39.1	Very low	36.2	Very low	197 Å²	197	144.8 Å²	144.8	91%	0.912	77%	0.77	S	S	*	*				-151.9	156	126.5	-123.8	-89.8	0	0	0	111
661	H	35.5	Very low	36.4	Very low	151 Å²	151	145.5 Å²	145.5	70%	0.699	78%	0.778	S	S	*	*			trans	-97.6	163.6	-169.2	-83.3	-100.6	0	0	0	114.4
662	S	36	Very low	36.6	Very low	119 Å²	119	150.7 Å²	150.7	83%	0.832	78%	0.779	S	S	*	*			trans	119.7	146.9	144.3	-61.5	0	0	0	0	115.1
663	A	34.2	Very low	36.8	Very low	81 Å²	81	150.2 Å²	150.2	67%	0.669	78%	0.781	S	S	*	*			cis	-179.4	169.2	-28.4	0	0	0	0	0	106.7
664	E	36.9	Very low	37	Very low	178 Å²	178	147.8 Å²	147.8	83%	0.832	77%	0.774	S	S	*	*			trans	66.9	161.9	168.5	-55.5	-172.2	159.4	0	0	117.1
665	N	35.4	Very low	37.7	Very low	125 Å²	125	148.6 Å²	148.6	67%	0.668	78%	0.777	S	S	*	*				-168.6	145.7	-55.8	-110.1	-25.8	0	0	0	108
666	Y	38.8	Very low	38.4	Very low	187 Å²	187	148 Å²	148	73%	0.733	78%	0.776	S	S	*	*			trans	140.8	128.7	131.7	-81.9	-65.5	0	0	0	118.5
667	H	39.3	Very low	38.4	Very low	172 Å²	172	146.5 Å²	146.5	80%	0.796	77%	0.772	S	S	*	*			trans	62	125.6	146.6	-67.6	-41.1	0	0	0	123.8
668	Q	38.4	Very low	38.3	Very low	161 Å²	161	146.6 Å²	146.6	75%	0.752	78%	0.776	S	S	*	*			trans	-124.8	153.4	151.7	177.3	-168.6	91.5	0	0	106.6
669	P	39.5	Very low	38.1	Very low	124 Å²	124	142.6 Å²	142.6	81%	0.805	78%	0.776	S	S	*	*			trans	-132.9	178.2	143.9	35.8	-23.1	0	0	0	113.4
670	T	35.7	Very low	38	Very low	117 Å²	117	140.1 Å²	140.1	72%	0.718	78%	0.78	S	S	*	*			trans	-125.5	168.2	-161.7	57.7	0	0	0	0	113.7
671	S	39.5	Very low	37.6	Very low	119 Å²	119	135.4 Å²	135.4	83%	0.832	78%	0.775	S	S	*	*			trans	-143.7	159.4	160.2	60.5	0	0	0	0	111.2
672	R	35.8	Very low	37.5	Very low	226 Å²	226	133.2 Å²	133.2	85%	0.853	78%	0.782	S	S	*	*			trans	-134.6	-169.3	-171.1	-78.7	-178.9	165.7	-173	-2.6	110.4
673	I	41.6	Very low	37.2	Very low	162 Å²	162	134.4 Å²	134.4	83%	0.831	79%	0.785	S	S	*	*			trans	103.9	133.4	152.2	-57.1	149.1	0	0	0	114.4
674	P	39.7	Very low	37.2	Very low	110 Å²	110	135.1 Å²	135.1	71%	0.714	79%	0.79	S	S	*	*				-138	-168.7	-50.3	43.4	-24.2	0	0	0	112.5
675	P	50.5	Low	36.9	Very low	119 Å²	119	132.1 Å²	132.1	77%	0.773	79%	0.789	S	S	*	*			trans	-122.6	154.1	167	39.2	-28.6	0	0	0	115.3
676	P	45.8	Very low	37	Very low	119 Å²	119	132.5 Å²	132.5	77%	0.773	80%	0.796	S	S	*	*			trans	-131.8	174.9	155.7	39.9	-27.7	0	0	0	112.7
677	T	37	Very low	36.8	Very low	127 Å²	127	129.5 Å²	129.5	78%	0.779	80%	0.797	S	S	*	*			cis	-162.7	143.1	-35.9	-83	0	0	0	0	107.6
678	I	33.7	Very low	36.8	Very low	154 Å²	154	126.3 Å²	126.3	79%	0.79	79%	0.793	S	S	*	*			trans	-31.4	138.7	175.4	-60.6	155.7	0	0	0	117.1	A680	I678-A680 HydrophobicContact CG2-CB 4.28Å
679	A	35.4	Very low	37	Very low	105 Å²	105	122.6 Å²	122.6	87%	0.868	78%	0.783	S	S	*	*			trans	-133.7	153.5	144.1	0	0	0	0	0	108.6
680	A	29.9	Very low	37.3	Very low	90 Å²	90	120.6 Å²	120.6	74%	0.744	77%	0.77	S	S	*	*			trans	-146.2	173	-159.7	0	0	0	0	0	115.8	I678	I678-A680 HydrophobicContact CG2-CB 4.28Å
681	A	30.4	Very low	38	Very low	98 Å²	98	119.6 Å²	119.6	81%	0.81	76%	0.76	S	S	*	*			trans	75.6	107.5	160.7	0	0	0	0	0	119.9
682	A	33.6	Very low	38.6	Very low	104 Å²	104	122.2 Å²	122.2	86%	0.86	76%	0.756	S	S	*	*				-147.4	138.8	123.5	0	0	0	0	0	108.1
683	V	30.5	Very low	39.3	Very low	145 Å²	145	117.3 Å²	117.3	88%	0.879	75%	0.747	S	S	*	*			trans	-120	127.7	-174.1	-176.5	0	0	0	0	110.1
684	A	33.8	Very low	39.6	Very low	95 Å²	95	115.1 Å²	115.1	79%	0.785	74%	0.736	S	S	*	*			trans	-129.9	132	169.2	0	0	0	0	0	108.9
685	S	31.3	Very low	40	Very low	115 Å²	115	110.8 Å²	110.8	80%	0.804	71%	0.712	S	S	*	*			trans	-78.1	125.1	-170.9	-171.1	0	0	0	0	112.1
686	V	35.8	Very low	40	Very low	134 Å²	134	107.7 Å²	107.7	81%	0.812	69%	0.689	S	S	*	*			trans	-130.7	121.3	162.5	-178.3	0	0	0	0	107.4	S688	V686-S688 PolarHBondContact O-N 3.28Å
687	V	36.2	Very low	40.5	Very low	124 Å²	124	106 Å²	106	75%	0.752	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-76.6	118.2	-177.6	177.7	0	0	0	0	109.5
688	S	38.1	Very low	41.6	Very low	104 Å²	104	105.4 Å²	105.4	73%	0.727	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-61.9	129.6	172.3	-57.8	0	0	0	0	110.7	V686	V686-S688 PolarHBondContact O-N 3.28Å
689	P	42.6	Very low	43	Very low	83 Å²	83	100.3 Å²	100.3	54%	0.539	64%	0.635	S	S	.	*	P	Polyproline II helix	trans	-65.1	151.7	175.1	28.1	-34.6	0	0	0	111
690	P	45.8	Very low	44.3	Very low	82 Å²	82	102.1 Å²	102.1	53%	0.532	63%	0.625	S	S	.	*	P	Polyproline II helix	trans	-65.8	139.4	-177.7	27.8	-34	0	0	0	111.3	K692 D693	P690-K692 PolarHBondContact O-N 3.28Å; P690-D693 WeakPolarHBondContact CG-OD2 3.33Å; P690-D693 PolarHBondContact O-N 2.84Å
691	L	50.1	Low	45.9	Very low	96 Å²	96	98.9 Å²	98.9	50%	0.503	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-51.6	-17.7	-175.5	-79.2	155	0	0	0	115.9	D693 L694 I696	L691-D693 VanDerWaalsContact C-N 3.33Å; L691-L694 PolarHBondContact O-N 3.06Å; L691-I696 HydrophobicContact CD2-CD1 4.27Å
692	K	51.9	Low	47.8	Very low	174 Å²	174	100.9 Å²	100.9	76%	0.757	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-36.2	174.7	-67.4	179.9	178.1	176.8	0	112.5	P690 L694 G695	P690-K692 PolarHBondContact O-N 3.28Å; K692-L694 VanDerWaalsContact C-N 3.27Å; K692-L694 PolarHBondContact O-N 2.8Å; K692-G695 PolarHBondContact O-N 2.53Å
693	D	52.2	Low	49.6	Very low	123 Å²	123	101.3 Å²	101.3	66%	0.658	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-18.9	-175.6	-59.5	-27.5	0	0	0	112.4	P690 L691 G695	P690-D693 WeakPolarHBondContact CG-OD2 3.33Å; P690-D693 PolarHBondContact O-N 2.84Å; L691-D693 VanDerWaalsContact C-N 3.33Å; D693-G695 VanDerWaalsContact C-N 3.28Å; D693-G695 PolarHBondContact O-N 3.06Å
694	L	46.9	Very low	51.6	Low	116 Å²	116	96.6 Å²	96.6	61%	0.607	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	2.8	174.2	-66.2	172	0	0	0	113.4	L691 K692 I696	L691-L694 PolarHBondContact O-N 3.06Å; K692-L694 VanDerWaalsContact C-N 3.27Å; K692-L694 PolarHBondContact O-N 2.8Å; L694-I696 HydrophobicContact CB-CD1 4.14Å; L694-I696 HydrophobicContact CB-CG1 4.16Å; L694-I696 PolarHBondContact O-N 3.04Å
695	G	48.3	Very low	52.5	Low	20 Å²	20	95.5 Å²	95.5	21%	0.206	56%	0.56	C	S	.	*	T	Hydrogen-bonded Turn	trans	65.6	22.4	-179.9	0	0	0	0	0	114.1	K692 D693 R711	K692-G695 PolarHBondContact O-N 2.53Å; D693-G695 VanDerWaalsContact C-N 3.28Å; D693-G695 PolarHBondContact O-N 3.06Å; G695-R711 PolarHBondContact O-N 2.81Å
696	I	49.8	Very low	53.5	Low	54 Å²	54	94.6 Å²	94.6	28%	0.277	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	121.3	176	-55.9	175.5	0	0	0	107.6	L691 L694 Y708	L691-I696 HydrophobicContact CD2-CD1 4.27Å; L694-I696 HydrophobicContact CB-CD1 4.14Å; L694-I696 HydrophobicContact CB-CG1 4.16Å; L694-I696 PolarHBondContact O-N 3.04Å; I696-Y708 HydrophobicContact CG2-CD1 3.92Å; I696-Y708 HydrophobicContact CG2-CG 4.38Å
697	H	57.9	Low	54.3	Low	84 Å²	84	91.2 Å²	91.2	39%	0.389	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	115.6	-179.4	-65	-86.3	0	0	0	110.7	V699 Q709 R714	H697-V699 PolarHBondContact O-N 3.04Å; H697-Q709 PolarHBondContact N-O 3.37Å; H697-R714 VanDerWaalsContact CB-CZ 3.43Å; H697-R714 PolarHBondContact O-NH2 3.32Å
698	Q	59.4	Low	55.1	Low	114 Å²	114	92 Å²	92	53%	0.533	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-45.9	132.4	172.1	-166.2	171	2.5	0	0	111.9	R714	Q698-R714 PolarHBondContact O-NH2 2.94Å
699	V	63.1	Low	56.2	Low	47 Å²	47	89.6 Å²	89.6	29%	0.285	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	132.1	173.2	-177.7	0	0	0	0	107.5	H697 V707 Q709	H697-V699 PolarHBondContact O-N 3.04Å; V699-V707 PolarHBondContact N-O 3.47Å; V699-V707 PolarHBondContact O-N 3.06Å; V699-Q709 HydrophobicContact CG2-CB 4.1Å; V699-Q709 HydrophobicContact CG2-CG 4.26Å
700	E	62	Low	57.3	Low	143 Å²	143	87.7 Å²	87.7	67%	0.668	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	125.6	171.1	-169.5	166.7	-161	0	0	109.4
701	G	64.1	Low	58	Low	22 Å²	22	91.9 Å²	91.9	23%	0.227	49%	0.485	C	S	.	.			trans	-72.7	161.1	174.6	0	0	0	0	0	112.1	D703 G704 T705	G701-D703 WeakPolarHBondContact CA-OD1 3.47Å; G701-D703 PolarHBondContact O-N 3.21Å; G701-G704 PolarHBondContact O-N 3.41Å; G701-T705 PolarHBondContact N-O 3.45Å
702	S	69.2	Low	59	Low	140 Å²	140	91.1 Å²	91.1	98%	0.979	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-7.4	175.3	49.3	0	0	0	0	114.1
703	D	73	Confident	59.9	Low	113 Å²	113	84.4 Å²	84.4	60%	0.604	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	3.4	177.9	60.4	-25.7	0	0	0	112.8	G701 T705	G701-D703 WeakPolarHBondContact CA-OD1 3.47Å; G701-D703 PolarHBondContact O-N 3.21Å; D703-T705 PolarHBondContact O-N 3.44Å; D703-T705 WeakPolarHBondContact OD1-CB 3.42Å; D703-T705 PolarHBondContact OD1-N 3.13Å; D703-T705 WeakPolarHBondContact OD2-CB 3.26Å; D703-T705 PolarHBondContact OD2-OG1 3.03Å
704	G	71.5	Confident	60.7	Low	46 Å²	46	82.9 Å²	82.9	47%	0.474	45%	0.449	S	S	.	.	S	Bend	trans	77.2	1.4	-173.3	0	0	0	0	0	114.2	G701	G701-G704 PolarHBondContact O-N 3.41Å
705	T	52.7	Low	62.1	Low	71 Å²	71	81.7 Å²	81.7	44%	0.436	44%	0.441	S	S	.	.			trans	-72.3	131.6	-179.9	-62	0	0	0	0	110.5	G701 D703 V707	G701-T705 PolarHBondContact N-O 3.45Å; D703-T705 PolarHBondContact O-N 3.44Å; D703-T705 WeakPolarHBondContact OD1-CB 3.42Å; D703-T705 PolarHBondContact OD1-N 3.13Å; D703-T705 WeakPolarHBondContact OD2-CB 3.26Å; D703-T705 PolarHBondContact OD2-OG1 3.03Å; T705-V707 HydrophobicContact CG2-CG2 4.14Å; T705-V707 PolarHBondContact O-N 2.93Å
706	Q	53.7	Low	63.3	Low	96 Å²	96	83.5 Å²	83.5	45%	0.449	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	98.5	177.8	-68.6	-70	-15.1	0	0	110.7
707	V	52.4	Low	64.7	Low	64 Å²	64	86.2 Å²	86.2	39%	0.388	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	117.8	-176.9	-176.9	0	0	0	0	111	V699 T705 Q709	V699-V707 PolarHBondContact N-O 3.47Å; V699-V707 PolarHBondContact O-N 3.06Å; T705-V707 HydrophobicContact CG2-CG2 4.14Å; T705-V707 PolarHBondContact O-N 2.93Å; V707-Q709 HydrophobicContact CG1-CG 4.31Å; V707-Q709 PolarHBondContact O-N 3.08Å
708	Y	51.7	Low	65.9	Low	139 Å²	139	87.6 Å²	87.6	55%	0.545	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	95.8	174.8	-69.6	-87.4	0	0	0	110.7	I696	I696-Y708 HydrophobicContact CG2-CD1 3.92Å; I696-Y708 HydrophobicContact CG2-CG 4.38Å
709	Q	60.8	Low	66.8	Low	54 Å²	54	89.8 Å²	89.8	25%	0.252	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	131.1	172.1	-77.7	-160.9	-20.2	0	0	112	H697 V699 V707 A713 R714	H697-Q709 PolarHBondContact N-O 3.37Å; V699-Q709 HydrophobicContact CG2-CB 4.1Å; V699-Q709 HydrophobicContact CG2-CG 4.26Å; V707-Q709 HydrophobicContact CG1-CG 4.31Å; V707-Q709 PolarHBondContact O-N 3.08Å; Q709-A713 HydrophobicContact CB-CB 4.14Å; Q709-A713 HydrophobicContact CG-CB 4.14Å; Q709-R714 HydrophobicContact CB-CG 4.23Å
710	S	66.3	Low	67.6	Low	44 Å²	44	94.2 Å²	94.2	31%	0.308	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	159.1	165.4	64.3	0	0	0	0	111.4	S712 A713 R714	S710-S712 PolarHBondContact O-N 2.86Å; S710-S712 PolarHBondContact OG-OG 2.75Å; S710-A713 PolarHBondContact O-N 3.12Å; S710-A713 VanDerWaalsContact O-N 3.09Å; S710-A713 PolarHBondContact OG-N 3.28Å; S710-A713 VanDerWaalsContact OG-N 3.1Å; S710-R714 PolarHBondContact O-N 3.05Å
711	R	61.6	Low	68.7	Low	170 Å²	170	91.8 Å²	91.8	64%	0.642	48%	0.479	S	S	*	.	H	α-helix	trans	-53.5	-34.1	170	-149.6	175.3	-170.4	-141.2	3.6	112.8	G695 Q715	G695-R711 PolarHBondContact O-N 2.81Å; R711-Q715 WeakPolarHBondContact O-CG 3.03Å; R711-Q715 PolarHBondContact O-N 3.2Å; R711-Q715 VanDerWaalsContact O-N 3.11Å
712	S	69.5	Low	69.5	Low	80 Å²	80	96.6 Å²	96.6	56%	0.559	50%	0.496	S	S	*	.	H	α-helix	trans	-69.6	-39.4	176	53	0	0	0	0	113.4	S710 Q715 A716	S710-S712 PolarHBondContact O-N 2.86Å; S710-S712 PolarHBondContact OG-OG 2.75Å; S712-Q715 PolarHBondContact O-N 2.92Å; S712-A716 PolarHBondContact O-N 3.49Å
713	A	70.6	Confident	70	Confident	32 Å²	32	95.9 Å²	95.9	26%	0.264	48%	0.481	S	S	.	.	H	α-helix	trans	-64.7	-40.9	176.1	0	0	0	0	0	111.8	Q709 S710 A716 K717	Q709-A713 HydrophobicContact CB-CB 4.14Å; Q709-A713 HydrophobicContact CG-CB 4.14Å; S710-A713 PolarHBondContact O-N 3.12Å; S710-A713 VanDerWaalsContact O-N 3.09Å; S710-A713 PolarHBondContact OG-N 3.28Å; S710-A713 VanDerWaalsContact OG-N 3.1Å; A713-A716 PolarHBondContact O-N 3.06Å; A713-K717 PolarHBondContact O-N 2.89Å
714	R	70.8	Confident	70.6	Confident	92 Å²	92	93 Å²	93	35%	0.347	47%	0.473	S	S	.	.	H	α-helix	trans	-63.4	-41.4	173.4	-69.4	-170.4	-179.9	-151.4	2.5	112.3	H697 Q698 Q709 S710 K717 Q718	H697-R714 VanDerWaalsContact CB-CZ 3.43Å; H697-R714 PolarHBondContact O-NH2 3.32Å; Q698-R714 PolarHBondContact O-NH2 2.94Å; Q709-R714 HydrophobicContact CB-CG 4.23Å; S710-R714 PolarHBondContact O-N 3.05Å; R714-K717 PolarHBondContact O-N 2.87Å; R714-Q718 WeakPolarHBondContact O-CB 3.06Å; R714-Q718 WeakPolarHBondContact O-CG 3.47Å; R714-Q718 PolarHBondContact O-N 2.61Å
715	Q	76	Confident	71.4	Confident	91 Å²	91	99.8 Å²	99.8	43%	0.425	48%	0.484	S	S	.	.	H	α-helix	trans	-66.7	-35.6	175.6	-75.6	179.5	0.5	0	0	113.1	R711 S712 R719	R711-Q715 WeakPolarHBondContact O-CG 3.03Å; R711-Q715 PolarHBondContact O-N 3.2Å; R711-Q715 VanDerWaalsContact O-N 3.11Å; S712-Q715 PolarHBondContact O-N 2.92Å; Q715-R719 WeakPolarHBondContact O-CG 3.33Å; Q715-R719 PolarHBondContact O-N 3.25Å
716	A	73.1	Confident	73	Confident	57 Å²	57	100.3 Å²	100.3	47%	0.471	49%	0.487	S	S	.	.	H	α-helix	trans	-62.4	-50.8	173.7	0	0	0	0	0	110.9	S712 A713 Q718 R719 E720	S712-A716 PolarHBondContact O-N 3.49Å; A713-A716 PolarHBondContact O-N 3.06Å; A716-Q718 VanDerWaalsContact C-N 3.35Å; A716-Q718 PolarHBondContact O-N 3.17Å; A716-R719 PolarHBondContact O-N 3.41Å; A716-R719 VanDerWaalsContact O-N 3.16Å; A716-E720 PolarHBondContact O-N 3.4Å
717	K	80	Confident	74.5	Confident	112 Å²	112	102.7 Å²	102.7	49%	0.487	50%	0.496	S	S	.	.	H	α-helix	trans	-60.5	-41	177	-167.5	-179.5	-178.5	-171	0	112.5	A713 R714 R719 E720 E721	A713-K717 PolarHBondContact O-N 2.89Å; R714-K717 PolarHBondContact O-N 2.87Å; K717-R719 PolarHBondContact O-N 2.88Å; K717-E720 WeakPolarHBondContact O-CB 3.2Å; K717-E720 PolarHBondContact O-N 2.76Å; K717-E721 WeakPolarHBondContact CE-OE1 3.4Å; K717-E721 IonicContact NZ-OE1 3.19Å; K717-E721 WeakPolarHBondContact O-CG 3.25Å; K717-E721 PolarHBondContact O-N 3.17Å
718	Q	82.2	Confident	76.1	Confident	113 Å²	113	106.2 Å²	106.2	53%	0.528	51%	0.508	S	S	.	.	H	α-helix	trans	-64.5	-37.1	175.4	-77.4	-177.8	-21.5	0	0	113.2	R714 A716 Q722	R714-Q718 WeakPolarHBondContact O-CB 3.06Å; R714-Q718 WeakPolarHBondContact O-CG 3.47Å; R714-Q718 PolarHBondContact O-N 2.61Å; A716-Q718 VanDerWaalsContact C-N 3.35Å; A716-Q718 PolarHBondContact O-N 3.17Å; Q718-Q722 WeakPolarHBondContact O-CB 3.48Å; Q718-Q722 VanDerWaalsContact O-CG 3.25Å; Q718-Q722 WeakPolarHBondContact O-CG 3.22Å; Q718-Q722 PolarHBondContact O-N 3.27Å
719	R	79.2	Confident	77.6	Confident	160 Å²	160	104.5 Å²	104.5	60%	0.604	51%	0.505	S	S	*	.	H	α-helix	trans	-65.2	-40.3	172.3	-78	-178.4	175.2	126.2	-4.7	111.7	Q715 A716 K717 Q722 L723	Q715-R719 WeakPolarHBondContact O-CG 3.33Å; Q715-R719 PolarHBondContact O-N 3.25Å; A716-R719 PolarHBondContact O-N 3.41Å; A716-R719 VanDerWaalsContact O-N 3.16Å; K717-R719 PolarHBondContact O-N 2.88Å; R719-Q722 PolarHBondContact O-N 2.99Å; R719-L723 WeakPolarHBondContact O-CB 3.29Å; R719-L723 VanDerWaalsContact O-CG 3.27Å; R719-L723 WeakPolarHBondContact O-CG 3.45Å; R719-L723 PolarHBondContact O-N 3.31Å
720	E	79.6	Confident	78.7	Confident	139 Å²	139	106.3 Å²	106.3	65%	0.65	52%	0.519	S	S	*	.	H	α-helix	trans	-64.2	-45.4	176.7	-170.2	172	-158.3	0	0	112	A716 K717 Q722 L723 A724	A716-E720 PolarHBondContact O-N 3.4Å; K717-E720 WeakPolarHBondContact O-CB 3.2Å; K717-E720 PolarHBondContact O-N 2.76Å; E720-Q722 VanDerWaalsContact C-N 3.35Å; E720-Q722 PolarHBondContact O-N 2.97Å; E720-L723 PolarHBondContact O-N 2.99Å; E720-A724 WeakPolarHBondContact O-CB 3.44Å; E720-A724 PolarHBondContact O-N 3.35Å
721	E	83.8	Confident	79.6	Confident	92 Å²	92	109.5 Å²	109.5	43%	0.43	53%	0.529	S	S	.	.	H	α-helix	trans	-62.4	-37.7	173.7	-72.5	173.5	-166.6	0	0	112.6	K717 R725	K717-E721 WeakPolarHBondContact CE-OE1 3.4Å; K717-E721 IonicContact NZ-OE1 3.19Å; K717-E721 WeakPolarHBondContact O-CG 3.25Å; K717-E721 PolarHBondContact O-N 3.17Å; E721-R725 WeakPolarHBondContact O-CG 3.49Å; E721-R725 PolarHBondContact O-N 3.43Å; E721-R725 VanDerWaalsContact O-N 3.09Å
722	Q	82.8	Confident	80.6	Confident	124 Å²	124	104.1 Å²	104.1	58%	0.579	52%	0.522	S	S	*	.	H	α-helix	trans	-67.3	-44.7	173.7	-76	175.3	4.6	0	0	112	Q718 R719 E720 A724 R725 V726	Q718-Q722 WeakPolarHBondContact O-CB 3.48Å; Q718-Q722 VanDerWaalsContact O-CG 3.25Å; Q718-Q722 WeakPolarHBondContact O-CG 3.22Å; Q718-Q722 PolarHBondContact O-N 3.27Å; R719-Q722 PolarHBondContact O-N 2.99Å; E720-Q722 VanDerWaalsContact C-N 3.35Å; E720-Q722 PolarHBondContact O-N 2.97Å; Q722-A724 VanDerWaalsContact C-N 3.31Å; Q722-A724 PolarHBondContact O-N 3.26Å; Q722-R725 PolarHBondContact O-N 2.98Å; Q722-V726 WeakPolarHBondContact O-CG2 2.98Å; Q722-V726 PolarHBondContact O-N 3.16Å
723	L	79.2	Confident	81.3	Confident	125 Å²	125	105.8 Å²	105.8	65%	0.654	52%	0.519	S	S	*	.	H	α-helix	trans	-61.6	-39	175.6	-75	166.1	0	0	0	111.6	R719 E720 V726 K727	R719-L723 WeakPolarHBondContact O-CB 3.29Å; R719-L723 VanDerWaalsContact O-CG 3.27Å; R719-L723 WeakPolarHBondContact O-CG 3.45Å; R719-L723 PolarHBondContact O-N 3.31Å; E720-L723 PolarHBondContact O-N 2.99Å; L723-V726 PolarHBondContact O-N 3.48Å; L723-K727 WeakPolarHBondContact O-CB 3.4Å; L723-K727 PolarHBondContact O-N 3.04Å
724	A	85.8	Confident	81.7	Confident	53 Å²	53	106.9 Å²	106.9	44%	0.438	53%	0.528	S	S	.	.	H	α-helix	trans	-62.7	-44	174.5	0	0	0	0	0	112.3	E720 Q722 K727 Q728	E720-A724 WeakPolarHBondContact O-CB 3.44Å; E720-A724 PolarHBondContact O-N 3.35Å; Q722-A724 VanDerWaalsContact C-N 3.31Å; Q722-A724 PolarHBondContact O-N 3.26Å; A724-K727 PolarHBondContact O-N 3.2Å; A724-Q728 PolarHBondContact O-N 3.47Å
725	R	88	Confident	82.2	Confident	187 Å²	187	107.6 Å²	107.6	71%	0.706	54%	0.538	S	S	*	.	H	α-helix	trans	-62.8	-46.5	174.4	-73.9	-178.7	-178	-163.5	1.8	112.3	E721 Q722 K727 Q728 E729	E721-R725 WeakPolarHBondContact O-CG 3.49Å; E721-R725 PolarHBondContact O-N 3.43Å; E721-R725 VanDerWaalsContact O-N 3.09Å; Q722-R725 PolarHBondContact O-N 2.98Å; R725-K727 VanDerWaalsContact C-N 3.31Å; R725-K727 PolarHBondContact O-N 3.04Å; R725-Q728 PolarHBondContact O-N 3.01Å; R725-E729 PolarHBondContact O-N 3.48Å
726	V	85.1	Confident	82.3	Confident	82 Å²	82	105.9 Å²	105.9	50%	0.497	54%	0.54	S	S	.	.	H	α-helix	trans	-61.9	-39.9	177.8	171.6	0	0	0	0	110.9	Q722 L723 E729 V730	Q722-V726 WeakPolarHBondContact O-CG2 2.98Å; Q722-V726 PolarHBondContact O-N 3.16Å; L723-V726 PolarHBondContact O-N 3.48Å; V726-E729 PolarHBondContact O-N 2.92Å; V726-V730 HydrophobicContact CG1-CG2 4.42Å; V726-V730 WeakPolarHBondContact O-CB 3.22Å; V726-V730 VanDerWaalsContact O-CG2 3.31Å; V726-V730 WeakPolarHBondContact O-CG2 3.41Å; V726-V730 PolarHBondContact O-N 3.41Å
727	K	86.7	Confident	82.3	Confident	146 Å²	146	109 Å²	109	64%	0.635	55%	0.548	S	S	*	.	H	α-helix	trans	-60	-49.4	174.2	-173.7	-176.7	176.7	-173.3	0	111.6	L723 A724 R725 E729 V730 E731	L723-K727 WeakPolarHBondContact O-CB 3.4Å; L723-K727 PolarHBondContact O-N 3.04Å; A724-K727 PolarHBondContact O-N 3.2Å; R725-K727 VanDerWaalsContact C-N 3.31Å; R725-K727 PolarHBondContact O-N 3.04Å; K727-E729 VanDerWaalsContact C-N 3.33Å; K727-E729 PolarHBondContact O-N 2.91Å; K727-V730 PolarHBondContact O-N 3.39Å; K727-E731 WeakPolarHBondContact O-CB 3.38Å; K727-E731 PolarHBondContact O-N 2.92Å
728	Q	84.4	Confident	82	Confident	138 Å²	138	110.4 Å²	110.4	65%	0.645	56%	0.556	S	S	*	*	H	α-helix	trans	-60.6	-39.9	176.5	-74.7	-177.6	-15.8	0	0	112.4	A724 R725 E731 A732	A724-Q728 PolarHBondContact O-N 3.47Å; R725-Q728 PolarHBondContact O-N 3.01Å; Q728-E731 PolarHBondContact O-N 3.46Å; Q728-A732 VanDerWaalsContact O-CB 3.31Å; Q728-A732 WeakPolarHBondContact O-CB 3.33Å; Q728-A732 PolarHBondContact O-N 3.29Å
729	E	83.5	Confident	81.5	Confident	104 Å²	104	108.4 Å²	108.4	49%	0.486	56%	0.559	S	S	.	*	H	α-helix	trans	-68	-39.4	178.8	-161.1	-168.1	152	0	0	112.2	R725 V726 K727 K733	R725-E729 PolarHBondContact O-N 3.48Å; V726-E729 PolarHBondContact O-N 2.92Å; K727-E729 VanDerWaalsContact C-N 3.33Å; K727-E729 PolarHBondContact O-N 2.91Å; E729-K733 HydrophobicContact CG-CD 4.37Å; E729-K733 WeakPolarHBondContact O-CB 3.25Å; E729-K733 WeakPolarHBondContact O-CD 3.29Å; E729-K733 VanDerWaalsContact O-CG 3.25Å; E729-K733 WeakPolarHBondContact O-CG 3.43Å; E729-K733 PolarHBondContact O-N 2.93Å; E729-K733 VanDerWaalsContact OE1-CE 3.28Å; E729-K733 WeakPolarHBondContact OE1-CE 3.46Å; E729-K733 IonicContact OE1-NZ 2.7Å; E729-K733 PolarHBondContact OE1-NZ 3.34Å
730	V	85.4	Confident	80.9	Confident	91 Å²	91	104.4 Å²	104.4	55%	0.552	55%	0.552	S	S	*	*	H	α-helix	trans	-65.9	-41.7	174	169.6	0	0	0	0	111.2	V726 K727 K733 A734	V726-V730 HydrophobicContact CG1-CG2 4.42Å; V726-V730 WeakPolarHBondContact O-CB 3.22Å; V726-V730 VanDerWaalsContact O-CG2 3.31Å; V726-V730 WeakPolarHBondContact O-CG2 3.41Å; V726-V730 PolarHBondContact O-N 3.41Å; K727-V730 PolarHBondContact O-N 3.39Å; V730-K733 PolarHBondContact O-N 3.43Å; V730-A734 WeakPolarHBondContact O-CB 3.48Å; V730-A734 PolarHBondContact O-N 3.31Å
731	E	83.8	Confident	80	Confident	111 Å²	111	100.6 Å²	100.6	52%	0.519	55%	0.545	S	S	.	.	H	α-helix	trans	-66	-43.9	177.8	-170.9	164.2	-170.4	0	0	111.8	K727 Q728 K733 A734 L735	K727-E731 WeakPolarHBondContact O-CB 3.38Å; K727-E731 PolarHBondContact O-N 2.92Å; Q728-E731 PolarHBondContact O-N 3.46Å; E731-K733 PolarHBondContact O-N 2.89Å; E731-A734 WeakPolarHBondContact O-CB 3.4Å; E731-A734 PolarHBondContact O-N 2.94Å; E731-L735 WeakPolarHBondContact O-CG 3.34Å; E731-L735 PolarHBondContact O-N 3.03Å
732	A	83.6	Confident	78.7	Confident	58 Å²	58	97.9 Å²	97.9	48%	0.479	54%	0.541	S	S	.	.	H	α-helix	trans	-61.4	-41.5	172.5	0	0	0	0	0	112.3	Q728 L735 A736	Q728-A732 VanDerWaalsContact O-CB 3.31Å; Q728-A732 WeakPolarHBondContact O-CB 3.33Å; Q728-A732 PolarHBondContact O-N 3.29Å; A732-L735 PolarHBondContact O-N 2.89Å; A732-A736 WeakPolarHBondContact O-CB 3.49Å; A732-A736 PolarHBondContact O-N 3.24Å
733	K	83.6	Confident	77.4	Confident	114 Å²	114	93.7 Å²	93.7	50%	0.496	53%	0.531	S	S	.	.	H	α-helix	trans	-65.2	-38	174.4	-77.9	168.2	173.6	172.3	0	112.3	E729 V730 E731 A736 L737	E729-K733 HydrophobicContact CG-CD 4.37Å; E729-K733 WeakPolarHBondContact O-CB 3.25Å; E729-K733 WeakPolarHBondContact O-CD 3.29Å; E729-K733 VanDerWaalsContact O-CG 3.25Å; E729-K733 WeakPolarHBondContact O-CG 3.43Å; E729-K733 PolarHBondContact O-N 2.93Å; E729-K733 VanDerWaalsContact OE1-CE 3.28Å; E729-K733 WeakPolarHBondContact OE1-CE 3.46Å; E729-K733 IonicContact OE1-NZ 2.7Å; E729-K733 PolarHBondContact OE1-NZ 3.34Å; V730-K733 PolarHBondContact O-N 3.43Å; E731-K733 PolarHBondContact O-N 2.89Å; K733-A736 PolarHBondContact O-N 2.84Å; K733-L737 WeakPolarHBondContact O-CB 3.34Å; K733-L737 VanDerWaalsContact O-CG 3.32Å; K733-L737 WeakPolarHBondContact O-CG 3.49Å; K733-L737 PolarHBondContact O-N 3.1Å
734	A	80.1	Confident	76.1	Confident	55 Å²	55	96.4 Å²	96.4	46%	0.455	53%	0.533	S	S	.	.	H	α-helix	trans	-64.2	-46.2	175.1	0	0	0	0	0	111.7	V730 E731 L737 Q738	V730-A734 WeakPolarHBondContact O-CB 3.48Å; V730-A734 PolarHBondContact O-N 3.31Å; E731-A734 WeakPolarHBondContact O-CB 3.4Å; E731-A734 PolarHBondContact O-N 2.94Å; A734-L737 PolarHBondContact O-N 3.29Å; A734-Q738 WeakPolarHBondContact O-CB 3.37Å; A734-Q738 PolarHBondContact O-N 2.99Å
735	L	79.8	Confident	74.5	Confident	107 Å²	107	103 Å²	103	56%	0.56	55%	0.547	S	S	*	.	H	α-helix	trans	-61.7	-43.9	175.1	-71.7	169	0	0	0	112.1	E731 A732 L737 Q738 A739	E731-L735 WeakPolarHBondContact O-CG 3.34Å; E731-L735 PolarHBondContact O-N 3.03Å; A732-L735 PolarHBondContact O-N 2.89Å; L735-L737 PolarHBondContact O-N 3.4Å; L735-Q738 PolarHBondContact O-N 3.48Å; L735-A739 WeakPolarHBondContact O-CB 3.49Å; L735-A739 PolarHBondContact O-N 3.24Å
736	A	78.3	Confident	73.1	Confident	56 Å²	56	104 Å²	104	46%	0.463	55%	0.55	S	S	.	*	H	α-helix	trans	-62.7	-40.3	176.6	0	0	0	0	0	112.8	A732 K733 T740	A732-A736 WeakPolarHBondContact O-CB 3.49Å; A732-A736 PolarHBondContact O-N 3.24Å; K733-A736 PolarHBondContact O-N 2.84Å; A736-T740 WeakPolarHBondContact O-CB 3.33Å; A736-T740 PolarHBondContact O-N 3.26Å; A736-T740 PolarHBondContact O-OG1 3.4Å
737	L	74.3	Confident	71.7	Confident	122 Å²	122	108.6 Å²	108.6	64%	0.639	56%	0.559	S	S	*	*	H	α-helix	trans	-65.8	-41.5	173.1	-76.2	169.5	0	0	0	112	K733 A734 L735 T740 A741	K733-L737 WeakPolarHBondContact O-CB 3.34Å; K733-L737 VanDerWaalsContact O-CG 3.32Å; K733-L737 WeakPolarHBondContact O-CG 3.49Å; K733-L737 PolarHBondContact O-N 3.1Å; A734-L737 PolarHBondContact O-N 3.29Å; L735-L737 PolarHBondContact O-N 3.4Å; L737-T740 PolarHBondContact O-N 3.4Å; L737-A741 WeakPolarHBondContact O-CB 3.38Å; L737-A741 PolarHBondContact O-N 3.48Å
738	Q	71.9	Confident	70.3	Confident	142 Å²	142	109.3 Å²	109.3	66%	0.664	56%	0.557	S	S	*	*	H	α-helix	trans	-66.6	-42.1	179.2	-161	177.3	42.6	0	0	111.5	A734 L735 A741 G742	A734-Q738 WeakPolarHBondContact O-CB 3.37Å; A734-Q738 PolarHBondContact O-N 2.99Å; L735-Q738 PolarHBondContact O-N 3.48Å; Q738-A741 PolarHBondContact O-N 2.98Å; Q738-G742 PolarHBondContact O-N 3.04Å
739	A	72.6	Confident	69	Low	71 Å²	71	107 Å²	107	59%	0.587	55%	0.549	S	S	*	.	H	α-helix	trans	-60.8	-44	172	0	0	0	0	0	111.8	L735 G743	L735-A739 WeakPolarHBondContact O-CB 3.49Å; L735-A739 PolarHBondContact O-N 3.24Å; A739-G743 PolarHBondContact O-N 3.42Å
740	T	66.9	Low	68	Low	76 Å²	76	108.6 Å²	108.6	47%	0.466	56%	0.555	S	S	.	*	H	α-helix	trans	-65.6	-40.5	177.8	-57.9	0	0	0	0	112	A736 L737 R744	A736-T740 WeakPolarHBondContact O-CB 3.33Å; A736-T740 PolarHBondContact O-N 3.26Å; A736-T740 PolarHBondContact O-OG1 3.4Å; L737-T740 PolarHBondContact O-N 3.4Å; T740-R744 WeakPolarHBondContact O-CB 3.28Å; T740-R744 WeakPolarHBondContact O-CG 3.41Å; T740-R744 PolarHBondContact O-N 2.59Å
741	A	59.7	Low	66.7	Low	59 Å²	59	108.4 Å²	108.4	49%	0.488	55%	0.548	S	S	.	.	H	α-helix	trans	-69.3	-42.9	177.6	0	0	0	0	0	112.2	L737 Q738 R744 R745	L737-A741 WeakPolarHBondContact O-CB 3.38Å; L737-A741 PolarHBondContact O-N 3.48Å; Q738-A741 PolarHBondContact O-N 2.98Å; A741-R744 PolarHBondContact O-N 3.3Å; A741-R745 PolarHBondContact O-N 2.81Å; A741-R745 VanDerWaalsContact O-N 3.14Å
742	G	56.3	Low	65.4	Low	35 Å²	35	112.5 Å²	112.5	36%	0.361	56%	0.559	S	S	.	*	H	α-helix	trans	-61.6	-42.7	173	0	0	0	0	0	112.1	Q738 R745 R746	Q738-G742 PolarHBondContact O-N 3.04Å; G742-R745 PolarHBondContact O-N 3.18Å; G742-R746 PolarHBondContact O-N 3.31Å
743	G	56.3	Low	64.2	Low	36 Å²	36	120.1 Å²	120.1	37%	0.371	58%	0.575	S	S	.	*	H	α-helix	trans	-58.6	-45.3	171.7	0	0	0	0	0	112.8	A739 R745 R746 R747	A739-G743 PolarHBondContact O-N 3.42Å; G743-R745 VanDerWaalsContact C-N 3.26Å; G743-R745 PolarHBondContact O-N 3.37Å; G743-R746 PolarHBondContact O-N 3.34Å; G743-R747 WeakPolarHBondContact O-CB 3.49Å; G743-R747 PolarHBondContact O-N 3.39Å
744	R	52.2	Low	63.2	Low	182 Å²	182	120.8 Å²	120.8	69%	0.687	58%	0.58	S	S	*	*	H	α-helix	trans	-70	-12.9	177.7	-75.8	-176.8	-178.7	-157.1	1.9	115.1	T740 A741	T740-R744 WeakPolarHBondContact O-CB 3.28Å; T740-R744 WeakPolarHBondContact O-CG 3.41Å; T740-R744 PolarHBondContact O-N 2.59Å; A741-R744 PolarHBondContact O-N 3.3Å
745	R	53.1	Low	62	Low	192 Å²	192	128.7 Å²	128.7	73%	0.725	60%	0.598	S	S	*	*	H	α-helix	trans	-83.6	-62.7	163.5	-76.9	-173.7	171.2	-171.7	-3.5	110.3	A741 G742 G743 R747 R748 D749	A741-R745 PolarHBondContact O-N 2.81Å; A741-R745 VanDerWaalsContact O-N 3.14Å; G742-R745 PolarHBondContact O-N 3.18Å; G743-R745 VanDerWaalsContact C-N 3.26Å; G743-R745 PolarHBondContact O-N 3.37Å; R745-R747 PolarHBondContact O-N 2.87Å; R745-R747 VanDerWaalsContact O-N 3.09Å; R745-R748 WeakPolarHBondContact O-CA 3.12Å; R745-R748 WeakPolarHBondContact O-CB 3.36Å; R745-R748 PolarHBondContact O-N 3.29Å; R745-D749 PolarHBondContact O-N 3.21Å; R745-D749 VanDerWaalsContact O-N 3.09Å
746	R	57.1	Low	60.4	Low	207 Å²	207	128.9 Å²	128.9	78%	0.781	60%	0.599	S	S	*	*	H	α-helix	trans	-53.7	-36.4	-177.3	-73.3	-174.7	171	-172.9	-2.7	114	G742 G743 K750	G742-R746 PolarHBondContact O-N 3.31Å; G743-R746 PolarHBondContact O-N 3.34Å; R746-K750 WeakPolarHBondContact O-CB 3.32Å; R746-K750 PolarHBondContact O-N 3.19Å
747	R	55.6	Low	59.1	Low	179 Å²	179	131.5 Å²	131.5	68%	0.675	61%	0.611	S	S	*	*	H	α-helix	trans	-68.4	-38.2	176.7	-167.2	175.4	-174.3	144.7	4.9	112.3	G743 R745 K750 E751	G743-R747 WeakPolarHBondContact O-CB 3.49Å; G743-R747 PolarHBondContact O-N 3.39Å; R745-R747 PolarHBondContact O-N 2.87Å; R745-R747 VanDerWaalsContact O-N 3.09Å; R747-K750 PolarHBondContact O-N 2.71Å; R747-E751 VanDerWaalsContact CG-OE1 3.31Å; R747-E751 WeakPolarHBondContact CG-OE1 3.28Å; R747-E751 IonicContact NE-OE1 3.81Å; R747-E751 PolarHBondContact NE-OE1 2.66Å; R747-E751 WeakPolarHBondContact O-CB 3.49Å; R747-E751 VanDerWaalsContact O-CG 3.24Å; R747-E751 WeakPolarHBondContact O-CG 3.33Å; R747-E751 PolarHBondContact O-N 3.4Å
748	R	56.8	Low	57.7	Low	160 Å²	160	132.9 Å²	132.9	60%	0.604	62%	0.62	S	S	*	*	H	α-helix	trans	-70.3	-36.1	178.3	-153.6	-174.5	-49.4	-163.8	3.1	112	R745 R752	R745-R748 WeakPolarHBondContact O-CA 3.12Å; R745-R748 WeakPolarHBondContact O-CB 3.36Å; R745-R748 PolarHBondContact O-N 3.29Å; R748-R752 WeakPolarHBondContact O-CB 3.41Å; R748-R752 PolarHBondContact O-N 3.18Å
749	D	58.6	Low	56.2	Low	89 Å²	89	128.7 Å²	128.7	48%	0.476	62%	0.615	S	S	.	*	H	α-helix	trans	-70.9	-37.3	174.4	-57.7	-42.4	0	0	0	111.4	R745 R753	R745-D749 PolarHBondContact O-N 3.21Å; R745-D749 VanDerWaalsContact O-N 3.09Å; D749-R753 WeakPolarHBondContact O-CG 3.34Å; D749-R753 PolarHBondContact O-N 2.97Å; D749-R753 VanDerWaalsContact O-N 3.08Å
750	K	61.4	Low	54.5	Low	138 Å²	138	134.4 Å²	134.4	60%	0.6	62%	0.623	S	S	*	*	H	α-helix	trans	-68.7	-41.4	173.2	-162.9	172.9	-175.3	178.4	0	112.2	R746 R747 R753 Q754	R746-K750 WeakPolarHBondContact O-CB 3.32Å; R746-K750 PolarHBondContact O-N 3.19Å; R747-K750 PolarHBondContact O-N 2.71Å; K750-R753 CarbonylContact O-C 3.54Å; K750-R753 PolarHBondContact O-N 2.81Å; K750-Q754 WeakPolarHBondContact O-CB 3.46Å; K750-Q754 WeakPolarHBondContact O-CG 3.41Å; K750-Q754 PolarHBondContact O-N 3.26Å
751	E	59.5	Low	53.2	Low	87 Å²	87	141 Å²	141	41%	0.407	64%	0.639	S	S	.	*	H	α-helix	trans	-65.9	-36.8	175.1	-75.7	164.3	-175.3	0	0	112	R747 Q754 R755	R747-E751 VanDerWaalsContact CG-OE1 3.31Å; R747-E751 WeakPolarHBondContact CG-OE1 3.28Å; R747-E751 IonicContact NE-OE1 3.81Å; R747-E751 PolarHBondContact NE-OE1 2.66Å; R747-E751 WeakPolarHBondContact O-CB 3.49Å; R747-E751 VanDerWaalsContact O-CG 3.24Å; R747-E751 WeakPolarHBondContact O-CG 3.33Å; R747-E751 PolarHBondContact O-N 3.4Å; E751-Q754 PolarHBondContact O-N 2.91Å; E751-R755 WeakPolarHBondContact O-CB 3.25Å; E751-R755 WeakPolarHBondContact O-CG 3.48Å; E751-R755 PolarHBondContact O-N 3.02Å
752	R	55.7	Low	52.1	Low	198 Å²	198	144.8 Å²	144.8	75%	0.747	65%	0.651	S	S	*	*	H	α-helix	trans	-61.9	-41	169.5	-90	-177.5	156.2	-171.4	-9.6	112.5	R748 Q754	R748-R752 WeakPolarHBondContact O-CB 3.41Å; R748-R752 PolarHBondContact O-N 3.18Å; R752-Q754 VanDerWaalsContact C-N 3.33Å
753	R	58.7	Low	51	Low	217 Å²	217	148.4 Å²	148.4	82%	0.819	67%	0.671	S	S	*	*	H	α-helix	trans	-75.4	-16	176.7	-70.9	179.9	179.4	-156.9	-1.7	114.4	D749 K750	D749-R753 WeakPolarHBondContact O-CG 3.34Å; D749-R753 PolarHBondContact O-N 2.97Å; D749-R753 VanDerWaalsContact O-N 3.08Å; K750-R753 CarbonylContact O-C 3.54Å; K750-R753 PolarHBondContact O-N 2.81Å
754	Q	61.8	Low	50.2	Low	129 Å²	129	155 Å²	155	60%	0.603	69%	0.691	S	S	*	*	H	α-helix	trans	-98.1	-14.8	176.5	-73.9	-177.8	-46.3	0	0	113.8	K750 E751 R752	K750-Q754 WeakPolarHBondContact O-CB 3.46Å; K750-Q754 WeakPolarHBondContact O-CG 3.41Å; K750-Q754 PolarHBondContact O-N 3.26Å; E751-Q754 PolarHBondContact O-N 2.91Å; R752-Q754 VanDerWaalsContact C-N 3.33Å
755	R	54.4	Low	49.5	Very low	221 Å²	221	153.1 Å²	153.1	83%	0.834	70%	0.695	S	S	*	*	S	Bend	trans	-89.9	3.6	177.7	-79.1	-176.6	176.9	-111.9	1.3	114.9	E751	E751-R755 WeakPolarHBondContact O-CB 3.25Å; E751-R755 WeakPolarHBondContact O-CG 3.48Å; E751-R755 PolarHBondContact O-N 3.02Å
756	N	48.1	Very low	48.7	Very low	110 Å²	110	153.6 Å²	153.6	59%	0.588	71%	0.706	S	S	*	*			trans	-141.6	76.7	174.6	-159.1	53.1	0	0	0	110.1
757	P	49.9	Very low	47.6	Very low	111 Å²	111	154.9 Å²	154.9	72%	0.721	71%	0.71	S	S	*	*	S	Bend	trans	-70.8	-41.1	-178.3	-16.2	31.8	0	0	0	112.3
758	D	44.6	Very low	46.8	Very low	151 Å²	151	157.8 Å²	157.8	81%	0.807	72%	0.723	S	S	*	*	S	Bend	trans	-128.1	117.5	-177.5	-60.6	-77.6	0	0	0	108.3
759	G	41.3	Very low	46	Very low	55 Å²	55	158.9 Å²	158.9	57%	0.567	74%	0.735	S	S	*	*			trans	-172	51.3	-166.8	0	0	0	0	0	113.4	W761	G759-W761 PolarHBondContact O-N 3.41Å
760	Y	35.8	Very low	45.1	Very low	191 Å²	191	159.3 Å²	159.3	75%	0.749	75%	0.751	S	S	*	*			trans	-59.5	124.3	168.9	-178.5	-87.5	0	0	0	110
761	W	39.4	Very low	44.1	Very low	214 Å²	214	161.8 Å²	161.8	81%	0.811	76%	0.764	S	S	*	*			trans	-177.5	125.3	136.8	-91.7	116	0	0	0	111.5	G759	G759-W761 PolarHBondContact O-N 3.41Å
762	D	38.1	Very low	43	Very low	139 Å²	139	161.5 Å²	161.5	74%	0.743	79%	0.785	S	S	*	*			trans	57.4	153.7	165.6	-119.1	-44.1	0	0	0	120.7
763	S	33.2	Very low	42.3	Very low	111 Å²	111	158 Å²	158	78%	0.776	79%	0.786	S	S	*	*			trans	-154.2	100.9	-176.1	-73.9	0	0	0	0	111.7
764	H	37.9	Very low	41.3	Very low	173 Å²	173	154.4 Å²	154.4	80%	0.801	78%	0.783	S	S	*	*			trans	-138.8	159.1	169.2	-116.7	-91.6	0	0	0	111.2
765	D	38.7	Very low	40.2	Very low	144 Å²	144	154 Å²	154	77%	0.77	79%	0.785	S	S	*	*			trans	62.3	71.1	169.7	-59.1	-1	0	0	0	117.9
766	E	35.9	Very low	39.4	Very low	201 Å²	201	150.8 Å²	150.8	94%	0.939	78%	0.783	S	S	*	*				-158	100.7	121.1	-117.1	-179.3	-166.1	0	0	111
767	R	35	Very low	38.9	Very low	234 Å²	234	149.3 Å²	149.3	88%	0.883	78%	0.782	S	S	*	*			trans	-154.2	75.8	172.8	-160.1	-166	-63.1	-177.8	3.5	114.1
768	Y	36.9	Very low	38.4	Very low	240 Å²	240	151.4 Å²	151.4	94%	0.941	78%	0.782	S	S	*	*			trans	-129.9	70	162.5	-90.9	-75.6	0	0	0	111.7
769	H	41.6	Very low	38.2	Very low	183 Å²	183	152 Å²	152	85%	0.847	78%	0.78	S	S	*	*			trans	-92.5	123.9	157.2	-92	-62.9	0	0	0	108.9
770	A	38.4	Very low	38.1	Very low	99 Å²	99	153.2 Å²	153.2	82%	0.818	78%	0.779	S	S	*	*			trans	-110.8	94.5	175.7	0	0	0	0	0	110.7
771	H	41	Very low	38.4	Very low	189 Å²	189	151.4 Å²	151.4	88%	0.875	78%	0.777	S	S	*	*			trans	-133.2	138	161.8	-78.9	-68.9	0	0	0	107.5
772	G	37.6	Very low	38.5	Very low	82 Å²	82	147.2 Å²	147.2	85%	0.845	77%	0.766	S	S	*	*			trans	137.4	92.6	179.4	0	0	0	0	0	112.3
773	T	40.3	Very low	38.5	Very low	125 Å²	125	150.4 Å²	150.4	77%	0.767	77%	0.768	S	S	*	*			trans	-96.7	143.8	167.8	47.1	0	0	0	0	109.6
774	N	37.5	Very low	38.9	Very low	140 Å²	140	152.1 Å²	152.1	75%	0.749	77%	0.769	S	S	*	*			trans	70.5	147.7	167	-62.2	44.3	0	0	0	115
775	D	38	Very low	39	Very low	121 Å²	121	146.7 Å²	146.7	65%	0.647	76%	0.76	S	S	*	*			cis	-157.4	166.4	-5	-131.6	-46.3	0	0	0	111.9
776	L	38.3	Very low	39.5	Very low	153 Å²	153	145.9 Å²	145.9	80%	0.801	76%	0.762	S	S	*	*			trans	61.2	150.9	160.2	-60.7	159.5	0	0	0	118.1
777	S	37.5	Very low	40.3	Very low	80 Å²	80	142.1 Å²	142.1	56%	0.559	76%	0.755	S	S	*	*			cis	-167.7	175.3	-22.2	60.4	0	0	0	0	110.5
778	Q	39.8	Very low	40.9	Very low	154 Å²	154	137.9 Å²	137.9	72%	0.72	76%	0.755	S	S	*	*			trans	82.7	123.4	154.6	-73.7	173.5	63.5	0	0	122.3
779	H	39.3	Very low	41.1	Very low	165 Å²	165	137.6 Å²	137.6	76%	0.764	75%	0.752	S	S	*	*			trans	63.1	144.8	144.1	-62.9	-55	0	0	0	121.6
780	S	40.8	Very low	41.2	Very low	79 Å²	79	133.1 Å²	133.1	55%	0.552	74%	0.742	S	S	*	*			cis	-168.3	167.7	-17	47.3	0	0	0	0	113.4
781	H	42.3	Very low	41.4	Very low	153 Å²	153	137.1 Å²	137.1	71%	0.708	75%	0.745	S	S	*	*			trans	84.9	119.3	167.7	-56.4	-68.2	0	0	0	118
782	Q	40.7	Very low	41.6	Very low	126 Å²	126	132.4 Å²	132.4	59%	0.589	74%	0.739	S	S	*	*				80.6	126.6	67.7	-101.1	175	-32.6	0	0	112.9
783	W	38.7	Very low	41.8	Very low	207 Å²	207	139.9 Å²	139.9	78%	0.784	74%	0.742	S	S	*	*			cis	-132.9	-170.9	2.7	-56.8	76.2	0	0	0	109.2
784	N	41.5	Very low	41.9	Very low	147 Å²	147	138.1 Å²	138.1	79%	0.786	74%	0.74	S	S	*	*			cis	-148.5	-159.9	1.9	-137	-14.8	0	0	0	107.8
785	G	40.3	Very low	42.2	Very low	59 Å²	59	137.2 Å²	137.2	61%	0.608	74%	0.743	S	S	*	*			cis	115.3	134.8	5.3	0	0	0	0	0	112.7
786	P	49.1	Very low	42.8	Very low	127 Å²	127	136.9 Å²	136.9	83%	0.825	75%	0.748	S	S	*	*			cis	-117.2	173.8	7.2	42.1	-30	0	0	0	115.8
787	P	51.8	Low	43.4	Very low	121 Å²	121	135.1 Å²	135.1	79%	0.786	75%	0.745	S	S	*	*			trans	-126	173.5	-168.9	42.8	-30	0	0	0	116.6
788	V	46.7	Very low	44	Very low	146 Å²	146	139.1 Å²	139.1	89%	0.885	76%	0.761	S	S	*	*			trans	-133.9	141.3	161.7	-177	0	0	0	0	112.5
789	R	42.1	Very low	44.4	Very low	233 Å²	233	143.6 Å²	143.6	88%	0.879	79%	0.79	S	S	*	*			trans	-47.1	164.4	174.9	-78.3	178.5	170.1	168	-5.2	117.4
790	S	44.3	Very low	44.7	Very low	90 Å²	90	142.6 Å²	142.6	63%	0.629	79%	0.791	S	S	*	*			cis	-179.2	161.3	-13.2	53.4	0	0	0	0	113.3
791	M	42.3	Very low	44.9	Very low	182 Å²	182	145.9 Å²	145.9	90%	0.897	80%	0.803	S	S	*	*			trans	70	119.7	158	-73.9	172.1	175.4	0	0	116.9
792	A	43.8	Very low	45	Very low	90 Å²	90	145.5 Å²	145.5	74%	0.744	81%	0.809	S	S	*	*				96.2	139.5	62.5	0	0	0	0	0	111.4
793	R	41.9	Very low	45.3	Very low	240 Å²	240	146.6 Å²	146.6	91%	0.906	82%	0.822	S	S	*	*			cis	-153.4	166.3	15.5	-131.2	173.6	-160.9	177.4	4.6	111.6
794	A	43.5	Very low	45.7	Very low	87 Å²	87	142.9 Å²	142.9	72%	0.719	82%	0.824	S	S	*	*			trans	-4.1	153.8	147.4	0	0	0	0	0	120.2
795	C	43.8	Very low	45.9	Very low	121 Å²	121	142.6 Å²	142.6	82%	0.818	83%	0.826	S	S	*	*			cis	-157.5	-177.6	13	-121.3	0	0	0	0	112.4
796	P	49.8	Very low	46.4	Very low	115 Å²	115	148.6 Å²	148.6	75%	0.747	84%	0.842	S	S	*	*			trans	-89.5	179.1	-165	39	-39.1	0	0	0	115.7
797	P	51.8	Low	46.1	Very low	115 Å²	115	150.2 Å²	150.2	75%	0.747	84%	0.843	S	S	*	*			trans	-103.9	165.2	-169.3	40.2	-34.3	0	0	0	115.5
798	D	50.6	Low	45.7	Very low	165 Å²	165	152.7 Å²	152.7	88%	0.882	85%	0.848	S	S	*	*			trans	-147.2	108.7	159.4	-86	-51.5	0	0	0	109.3
799	D	47.4	Very low	45.6	Very low	248 Å²	248	153.3 Å²	153.3	100%	1.326	85%	0.845	S	S	*	*			trans	177.4	0	151.9	-112.5	-5.7	0	0	0	109.7

Retrieved 799 of 799 residues in 1543.9 ms (Link to these results)

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