A0A087Y007_POEFO Loading...

Rab3 GTPase-activating protein catalytic subunit

AlphaFold DB , UniProt , Accession A0A087Y007, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 967 aa.

						>A0A087Y007_POEFO|A0A087Y007
MAADNDPESEVFEITDFTTASEWERFVSRVEEVLNEWKLTENYVEKTSPEKGAYINGSWEEQSLDIHFADFKFYITHHFLKEDCKKENGKSEEDTLPLAMQDLLCMHNDFPPRAHCLVRWYGLREFVVISPGANCEAIISESKCNLLLSSVSMSLSNSGCQVPMFVQIQQKWRRIYAGECQGPGVRTDFEIVHLRKVPSQYNHLSGLLDIFKSKIGCNLLPLPPVNIAIRYTYILQDWQQSSWPQQPPDFDTLLGGEVGGVEFGNLPFGACEEPISELHLATTWPHLTEGIVVDNDVYSDLDPLQAPHWSIRVRTADNLQCLLGDFITEFFKLCCQKESAEEILGRVNAEEEGQENSDISSALSKLTEPAAPVPLSKLSVSSMVHSARRRIRRHRHIDESPLHVDMLNSILLYLFPDAAVEKSSDKEKTTQANSCRPSEQEKSPDDNLYLQLKSAPCNSLTYRLALCLCMVNYSYGGLAAVAHLWQEFVLELRYRWENNYLVYGLTGGSPDLRCCLLHQKFQMLNCCIERKRARDEARKVQEGNRERERKVSGGRASASTTRETPQGKSWDSWSDSEDEFFECLSDQGEMESSHSEAGKDSSKLKADGRLHPYNNMTLLHSAELLYVPVTQEPAPMTEDQLEEQSEVLAKLGTSAEGTHLRARMQSACLLSDMESFKAANPGCVLEDFVRWYSPRDYVEEEVVDEKGSTVIRGELSARMKIPGNMWVEAWDTARVIPARRQKRLFDDTKEAEKVLHYLAMMKPGDLAHHLLPCLLHAAIMKLKQEESVENIPSVEKSIQQAASQANKLLHSANYDYKKLEDFINQLVTMETVITEARSLKAKFAVDEEEENGEAADELEKFVTLLLEEPEVVVLGAGQARIGRIIHRLFINAQRAALLAPVDDDLEPAAESRKIPDFPPPAGREILLRTCVPRPAPYSKALPQRLFCVLMKDEFRLAGAFSADTSFF
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.7	Very low	43.1	Very low	251 Å²	251	147 Å²	147	100%	1.236	84%	0.839	S	S	*	*				0	133.1	0	-81.1	-161.5	-175.3	0	0	107.8
2	A	40.4	Very low	43.1	Very low	103 Å²	103	149.2 Å²	149.2	85%	0.851	83%	0.832	S	S	*	*			trans	70.5	128.2	163.9	0	0	0	0	0	120.9
3	A	42.8	Very low	43.7	Very low	85 Å²	85	150.5 Å²	150.5	70%	0.702	83%	0.828	S	S	*	*			trans	70.5	115.6	147.6	0	0	0	0	0	119.7
4	D	38.3	Very low	44.5	Very low	162 Å²	162	150.1 Å²	150.1	87%	0.866	82%	0.822	S	S	*	*				-163.5	130.8	96.3	-90.2	-23.4	0	0	0	111.5
5	N	44.1	Very low	44.5	Very low	157 Å²	157	145.9 Å²	145.9	84%	0.84	80%	0.803	S	S	*	*			trans	-74.7	139.2	158.3	-81.4	-30.7	0	0	0	107.8
6	D	42.5	Very low	44.9	Very low	162 Å²	162	143.8 Å²	143.8	87%	0.866	79%	0.79	S	S	*	*				-158.6	152.2	127.3	-110.1	-10.1	0	0	0	112
7	P	50.7	Low	45.5	Very low	104 Å²	104	146.1 Å²	146.1	68%	0.675	79%	0.791	S	S	*	*			trans	-97	-175.1	-162.6	41.8	-37.9	0	0	0	112.4
8	E	39.9	Very low	46.6	Very low	191 Å²	191	143.5 Å²	143.5	89%	0.893	78%	0.781	S	S	*	*			trans	120.9	109.6	173.7	-70.6	174	-171.5	0	0	109.8
9	S	44.8	Very low	47.9	Very low	105 Å²	105	142.5 Å²	142.5	73%	0.734	78%	0.78	S	S	*	*			cis	-145.8	119	32.6	39.2	0	0	0	0	109.4	V11	S9-V11 PolarHBondContact O-N 3.16Å
10	E	42.5	Very low	49.1	Very low	170 Å²	170	137.3 Å²	137.3	79%	0.794	76%	0.756	S	S	*	*			trans	-54.8	107.9	152.2	-75.2	173.6	154.3	0	0	106	F12	E10-F12 PolarHBondContact O-N 3Å
11	V	48.1	Very low	50.8	Low	127 Å²	127	132.9 Å²	132.9	77%	0.77	74%	0.736	S	S	*	*			trans	-56.9	103	157.5	175.9	0	0	0	0	103.3	S9 E13	S9-V11 PolarHBondContact O-N 3.16Å; V11-E13 PolarHBondContact O-N 3.15Å
12	F	43.9	Very low	53	Low	173 Å²	173	126.2 Å²	126.2	76%	0.759	70%	0.701	S	S	*	*			trans	-53.9	99.1	163.1	-77.3	-91.5	0	0	0	104.9	E10 I14	E10-F12 PolarHBondContact O-N 3Å; F12-I14 HydrophobicContact CB-CG1 4.38Å; F12-I14 PolarHBondContact O-N 3.11Å
13	E	50.5	Low	55.1	Low	166 Å²	166	125 Å²	125	78%	0.776	68%	0.675	S	S	*	*			trans	-57.3	91.6	148	-87.1	-175.9	160	0	0	103.7	V11 T15	V11-E13 PolarHBondContact O-N 3.15Å; E13-T15 PolarHBondContact O-N 2.73Å
14	I	54.6	Low	57.3	Low	146 Å²	146	125.6 Å²	125.6	75%	0.749	66%	0.663	S	S	*	*			trans	-60.2	90	157.5	-60.5	173.1	0	0	0	102.8	F12 D16	F12-I14 HydrophobicContact CB-CG1 4.38Å; F12-I14 PolarHBondContact O-N 3.11Å; I14-D16 PolarHBondContact O-N 3.24Å
15	T	45.3	Very low	59.7	Low	86 Å²	86	124.2 Å²	124.2	53%	0.528	65%	0.646	S	S	.	*			trans	-65.1	94.3	164.9	28.4	0	0	0	0	103.9	E13 F17	E13-T15 PolarHBondContact O-N 2.73Å; T15-F17 WeakPolarHBondContact O-CD2 3.45Å; T15-F17 WeakPolarHBondContact O-CE2 3.39Å; T15-F17 PolarHBondContact O-N 3.24Å; T15-F17 WeakPolarHBondContact OG1-CE2 3.41Å
16	D	50	Low	61.9	Low	112 Å²	112	116.9 Å²	116.9	60%	0.599	61%	0.607	S	S	*	*			trans	-67.1	101.5	178.7	-159.6	-14.7	0	0	0	107.2	I14 T18	I14-D16 PolarHBondContact O-N 3.24Å; D16-T18 PolarHBondContact O-N 3.05Å; D16-T18 VanDerWaalsContact OD1-CB 3.3Å; D16-T18 WeakPolarHBondContact OD1-CB 3.47Å; D16-T18 VanDerWaalsContact OD1-CG2 3.23Å; D16-T18 WeakPolarHBondContact OD1-CG2 3.48Å; D16-T18 PolarHBondContact OD1-N 2.87Å; D16-T18 VanDerWaalsContact OD1-N 3.15Å; D16-T18 PolarHBondContact OD1-OG1 3.29Å; D16-T18 PolarHBondContact OD2-OG1 3.11Å
17	F	54.7	Low	64.2	Low	184 Å²	184	109.6 Å²	109.6	81%	0.807	57%	0.568	S	S	*	*			trans	-78.4	5.4	175.9	-68	-81.3	0	0	0	111.6	T15 T19	T15-F17 WeakPolarHBondContact O-CD2 3.45Å; T15-F17 WeakPolarHBondContact O-CE2 3.39Å; T15-F17 PolarHBondContact O-N 3.24Å; T15-F17 WeakPolarHBondContact OG1-CE2 3.41Å; F17-T19 PolarHBondContact O-N 3.24Å
18	T	65.6	Low	66.1	Low	99 Å²	99	107.2 Å²	107.2	61%	0.607	55%	0.554	S	S	*	*			trans	-69.5	115.4	170.3	62.8	0	0	0	0	108.8	D16 A20	D16-T18 PolarHBondContact O-N 3.05Å; D16-T18 VanDerWaalsContact OD1-CB 3.3Å; D16-T18 WeakPolarHBondContact OD1-CB 3.47Å; D16-T18 VanDerWaalsContact OD1-CG2 3.23Å; D16-T18 WeakPolarHBondContact OD1-CG2 3.48Å; D16-T18 PolarHBondContact OD1-N 2.87Å; D16-T18 VanDerWaalsContact OD1-N 3.15Å; D16-T18 PolarHBondContact OD1-OG1 3.29Å; D16-T18 PolarHBondContact OD2-OG1 3.11Å; T18-A20 PolarHBondContact O-N 3.01Å; T18-A20 VanDerWaalsContact O-N 3.07Å
19	T	70.9	Confident	68.5	Low	124 Å²	124	102 Å²	102	76%	0.761	53%	0.526	S	S	*	.			trans	-67	109.8	168.1	50.3	0	0	0	0	107	F17 S21	F17-T19 PolarHBondContact O-N 3.24Å; T19-S21 PolarHBondContact O-N 2.99Å
20	A	73.8	Confident	70.8	Confident	38 Å²	38	97.1 Å²	97.1	31%	0.314	49%	0.491	S	S	.	.			trans	-44.3	132.1	175.1	0	0	0	0	0	109.8	T18 E24 R25	T18-A20 PolarHBondContact O-N 3.01Å; T18-A20 VanDerWaalsContact O-N 3.07Å; A20-E24 WeakPolarHBondContact CA-OE2 3.18Å; A20-E24 HydrophobicContact CB-CB 4.44Å; A20-R25 HydrophobicContact CB-CG 4.1Å; A20-R25 PolarHBondContact O-NH1 3.41Å; A20-R25 PolarHBondContact O-NH2 3.46Å
21	S	84.9	Confident	73.1	Confident	46 Å²	46	91 Å²	91	32%	0.322	46%	0.463	S	S	.	.			trans	-64.6	157.2	175.3	66.9	0	0	0	0	110	T19 W23 E24 R25	T19-S21 PolarHBondContact O-N 2.99Å; S21-W23 PolarHBondContact O-N 2.67Å; S21-E24 PolarHBondContact N-OE2 3.35Å; S21-E24 PolarHBondContact O-N 3.43Å; S21-E24 VanDerWaalsContact OG-CG 3.29Å; S21-E24 WeakPolarHBondContact OG-CG 3.47Å; S21-E24 PolarHBondContact OG-N 3.09Å; S21-E24 PolarHBondContact OG-OE2 3.13Å; S21-R25 WeakPolarHBondContact O-CG 3.05Å; S21-R25 PolarHBondContact O-N 3.25Å
22	E	84.2	Confident	75.1	Confident	111 Å²	111	89.5 Å²	89.5	52%	0.519	45%	0.447	S	S	.	.	H	α-helix	trans	-57.7	-30.2	173.3	-65.5	178.4	161.1	0	0	111.8	F26 A69	E22-F26 WeakPolarHBondContact O-CB 3.38Å; E22-F26 PolarHBondContact O-N 3.45Å; E22-A69 WeakPolarHBondContact OE2-CB 3.38Å
23	W	86.1	Confident	77.3	Confident	76 Å²	76	81.2 Å²	81.2	29%	0.288	41%	0.411	S	S	.	.	H	α-helix	trans	-68.8	-46.6	175	179.9	58.9	0	0	0	112.9	S21 R25 F26 V27 F68 L146 S150 M153	S21-W23 PolarHBondContact O-N 2.67Å; W23-R25 VanDerWaalsContact C-N 3.34Å; W23-R25 PolarHBondContact O-N 3.23Å; W23-F26 WeakPolarHBondContact O-CB 3.43Å; W23-F26 PolarHBondContact O-N 3.41Å; W23-V27 WeakPolarHBondContact O-CG2 3.39Å; W23-V27 PolarHBondContact O-N 2.75Å; W23-F68 HydrophobicContact CB-CE2 4.22Å; W23-L146 HydrophobicContact CG-CD1 4.26Å; W23-S150 VanDerWaalsContact CD1-OG 3.27Å; W23-S150 PolarHBondContact NE1-OG 2.76Å; W23-M153 HydrophobicContact CH2-CE 4.36Å; W23-M153 HydrophobicContact CH2-SD 3.22Å; W23-M153 WeakPolarHBondContact CH2-SD 3.38Å; W23-M153 HydrophobicContact CZ2-SD 3.47Å; W23-M153 WeakPolarHBondContact CZ2-SD 3.43Å; W23-M153 HydrophobicContact CZ3-SD 4.22Å
24	E	87.8	Confident	79.2	Confident	99 Å²	99	73.3 Å²	73.3	46%	0.463	37%	0.374	S	S	.	.	H	α-helix	trans	-62.9	-39.9	174.8	-73.8	160.7	171	0	0	111.9	A20 S21 F26 V27 S28	A20-E24 WeakPolarHBondContact CA-OE2 3.18Å; A20-E24 HydrophobicContact CB-CB 4.44Å; S21-E24 PolarHBondContact N-OE2 3.35Å; S21-E24 PolarHBondContact O-N 3.43Å; S21-E24 VanDerWaalsContact OG-CG 3.29Å; S21-E24 WeakPolarHBondContact OG-CG 3.47Å; S21-E24 PolarHBondContact OG-N 3.09Å; S21-E24 PolarHBondContact OG-OE2 3.13Å; E24-F26 VanDerWaalsContact C-N 3.29Å; E24-F26 PolarHBondContact O-N 3.2Å; E24-V27 PolarHBondContact O-N 2.97Å; E24-S28 WeakPolarHBondContact O-CB 3.37Å; E24-S28 PolarHBondContact O-N 2.86Å
25	R	88.5	Confident	80.8	Confident	133 Å²	133	70.4 Å²	70.4	50%	0.502	36%	0.36	S	S	.	.	H	α-helix	trans	-60.6	-40.5	173.7	-70.1	-169.4	-169.9	83.1	11.8	111.8	A20 S21 W23 R29	A20-R25 HydrophobicContact CB-CG 4.1Å; A20-R25 PolarHBondContact O-NH1 3.41Å; A20-R25 PolarHBondContact O-NH2 3.46Å; S21-R25 WeakPolarHBondContact O-CG 3.05Å; S21-R25 PolarHBondContact O-N 3.25Å; W23-R25 VanDerWaalsContact C-N 3.34Å; W23-R25 PolarHBondContact O-N 3.23Å; R25-R29 WeakPolarHBondContact O-CB 3.31Å; R25-R29 PolarHBondContact O-N 3.36Å
26	F	90.1	Very high	82.9	Confident	3 Å²	3	72 Å²	72	1%	0.013	36%	0.362	C	S	.	.	H	α-helix	trans	-66	-46.2	177.5	-179.7	-102.6	0	0	0	112	E22 W23 E24 R29 V30 I66 F68 F73 L147	E22-F26 WeakPolarHBondContact O-CB 3.38Å; E22-F26 PolarHBondContact O-N 3.45Å; W23-F26 WeakPolarHBondContact O-CB 3.43Å; W23-F26 PolarHBondContact O-N 3.41Å; E24-F26 VanDerWaalsContact C-N 3.29Å; E24-F26 PolarHBondContact O-N 3.2Å; F26-R29 PolarHBondContact O-N 3.17Å; F26-V30 HydrophobicContact CD1-CG2 4.45Å; F26-V30 HydrophobicContact CE1-CG2 4.12Å; F26-V30 HydrophobicContact CZ-CG2 4.19Å; F26-V30 WeakPolarHBondContact O-CG2 3.4Å; F26-V30 PolarHBondContact O-N 3.39Å; F26-I66 HydrophobicContact CE2-CD1 3.79Å; F26-I66 HydrophobicContact CE2-CG1 4.47Å; F26-I66 HydrophobicContact CZ-CD1 3.96Å; F26-F68 HydrophobicContact CB-CD2 3.62Å; F26-F68 HydrophobicContact CB-CE2 4.22Å; F26-F68 AromaticContact CD1-CD2 3.99Å; F26-F68 HydrophobicContact CD1-CD2 3.99Å; F26-F68 HydrophobicContact CD2-CB 3.76Å; F26-F68 AromaticContact CD2-CD2 3.94Å; F26-F68 HydrophobicContact CD2-CD2 3.94Å; F26-F68 HydrophobicContact CD2-CG 4.37Å; F26-F68 HydrophobicContact CE2-CB 4.03Å; F26-F68 HydrophobicContact CG-CB 4.31Å; F26-F68 AromaticContact CG-CD2 3.59Å; F26-F68 HydrophobicContact CG-CD2 3.59Å; F26-F68 HydrophobicContact CG-CE2 4.46Å; F26-F68 HydrophobicContact CG-CG 4.45Å; F26-F73 AromaticContact CE2-CD2 3.92Å; F26-F73 HydrophobicContact CE2-CD2 3.92Å; F26-F73 HydrophobicContact CE2-CE2 4.47Å; F26-F73 HydrophobicContact CZ-CD2 4.23Å; F26-L147 HydrophobicContact CE1-CD2 3.96Å; F26-L147 HydrophobicContact CZ-CD2 4.06Å
27	V	91.4	Very high	84.7	Confident	9 Å²	9	68.2 Å²	68.2	6%	0.055	34%	0.339	C	S	.	.	H	α-helix	trans	-59.6	-48.3	176.4	172.9	0	0	0	0	110.7	W23 E24 R29 V30 E31 M153	W23-V27 WeakPolarHBondContact O-CG2 3.39Å; W23-V27 PolarHBondContact O-N 2.75Å; E24-V27 PolarHBondContact O-N 2.97Å; V27-R29 VanDerWaalsContact C-N 3.29Å; V27-R29 PolarHBondContact O-N 3.33Å; V27-V30 PolarHBondContact O-N 2.97Å; V27-V30 VanDerWaalsContact O-N 3.11Å; V27-E31 WeakPolarHBondContact CG1-OE1 3.15Å; V27-E31 WeakPolarHBondContact O-CG 3.37Å; V27-E31 PolarHBondContact O-N 2.87Å; V27-M153 HydrophobicContact CG1-CB 4.27Å
28	S	90.4	Very high	86	Confident	54 Å²	54	65.6 Å²	65.6	38%	0.378	33%	0.327	S	S	.	.	H	α-helix	trans	-58.7	-40.2	176.3	175.3	0	0	0	0	112	E24 E31 E32	E24-S28 WeakPolarHBondContact O-CB 3.37Å; E24-S28 PolarHBondContact O-N 2.86Å; S28-E31 WeakPolarHBondContact O-CB 3.47Å; S28-E31 PolarHBondContact O-N 2.59Å; S28-E32 WeakPolarHBondContact O-CG 3.31Å; S28-E32 PolarHBondContact O-N 3.17Å
29	R	91.2	Very high	86.8	Confident	81 Å²	81	61.6 Å²	61.6	31%	0.306	30%	0.302	S	S	.	.	H	α-helix	trans	-66.3	-37.5	176.2	-176.6	59.7	-173.9	147.1	8.8	112.7	R25 F26 V27 E32 V33 I66	R25-R29 WeakPolarHBondContact O-CB 3.31Å; R25-R29 PolarHBondContact O-N 3.36Å; F26-R29 PolarHBondContact O-N 3.17Å; V27-R29 VanDerWaalsContact C-N 3.29Å; V27-R29 PolarHBondContact O-N 3.33Å; R29-E32 VanDerWaalsContact CD-OE2 3.32Å; R29-E32 WeakPolarHBondContact CD-OE2 3.41Å; R29-E32 IonicContact CZ-OE2 3.41Å; R29-E32 IonicContact NE-OE2 2.71Å; R29-E32 IonicContact NH1-OE2 2.7Å; R29-E32 PolarHBondContact NH1-OE2 2.99Å; R29-E32 PolarHBondContact O-N 3.41Å; R29-V33 WeakPolarHBondContact O-CG2 3.17Å; R29-V33 PolarHBondContact O-N 3.25Å; R29-V33 VanDerWaalsContact O-N 3.16Å; R29-I66 HydrophobicContact CG-CB 4.48Å; R29-I66 HydrophobicContact CG-CG2 3.8Å
30	V	91.4	Very high	86.9	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.012	28%	0.278	C	S	.	.	H	α-helix	trans	-65.1	-42.9	174.2	174.3	0	0	0	0	110.3	F26 V27 E32 V33 L34 I66 I75 M164	F26-V30 HydrophobicContact CD1-CG2 4.45Å; F26-V30 HydrophobicContact CE1-CG2 4.12Å; F26-V30 HydrophobicContact CZ-CG2 4.19Å; F26-V30 WeakPolarHBondContact O-CG2 3.4Å; F26-V30 PolarHBondContact O-N 3.39Å; V27-V30 PolarHBondContact O-N 2.97Å; V27-V30 VanDerWaalsContact O-N 3.11Å; V30-E32 PolarHBondContact O-N 2.92Å; V30-V33 PolarHBondContact O-N 3.33Å; V30-L34 HydrophobicContact CG1-CD1 4.44Å; V30-L34 WeakPolarHBondContact O-CG 3.23Å; V30-L34 PolarHBondContact O-N 2.9Å; V30-I66 HydrophobicContact CG2-CD1 4.17Å; V30-I75 HydrophobicContact CG1-CD1 4.3Å; V30-M164 HydrophobicContact CG1-CE 3.95Å; V30-M164 HydrophobicContact CG1-SD 4.19Å
31	E	91.9	Very high	86.4	Confident	41 Å²	41	60.2 Å²	60.2	19%	0.192	28%	0.283	C	S	.	.	H	α-helix	trans	-61.4	-41.7	175.7	-68.9	169.3	-171.3	0	0	112.6	V27 S28 V33 L34 N35 N157	V27-E31 WeakPolarHBondContact CG1-OE1 3.15Å; V27-E31 WeakPolarHBondContact O-CG 3.37Å; V27-E31 PolarHBondContact O-N 2.87Å; S28-E31 WeakPolarHBondContact O-CB 3.47Å; S28-E31 PolarHBondContact O-N 2.59Å; E31-V33 VanDerWaalsContact C-N 3.32Å; E31-V33 PolarHBondContact O-N 2.63Å; E31-L34 PolarHBondContact O-N 2.86Å; E31-N35 WeakPolarHBondContact O-CB 3.5Å; E31-N35 PolarHBondContact O-N 3.47Å; E31-N35 PolarHBondContact O-ND2 3.09Å; E31-N157 WeakPolarHBondContact OE1-CB 3.47Å; E31-N157 PolarHBondContact OE1-ND2 3.09Å
32	E	90.1	Very high	85.1	Confident	96 Å²	96	62.4 Å²	62.4	45%	0.449	29%	0.291	S	S	.	.	H	α-helix	trans	-57.2	-45.2	173.4	-76.1	175.2	-177.6	0	0	111.6	S28 R29 V30 N35 E36	S28-E32 WeakPolarHBondContact O-CG 3.31Å; S28-E32 PolarHBondContact O-N 3.17Å; R29-E32 VanDerWaalsContact CD-OE2 3.32Å; R29-E32 WeakPolarHBondContact CD-OE2 3.41Å; R29-E32 IonicContact CZ-OE2 3.41Å; R29-E32 IonicContact NE-OE2 2.71Å; R29-E32 IonicContact NH1-OE2 2.7Å; R29-E32 PolarHBondContact NH1-OE2 2.99Å; R29-E32 PolarHBondContact O-N 3.41Å; V30-E32 PolarHBondContact O-N 2.92Å; E32-N35 PolarHBondContact O-N 2.92Å; E32-E36 WeakPolarHBondContact O-CB 3.33Å; E32-E36 PolarHBondContact O-N 3.25Å
33	V	90.7	Very high	83.6	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.7	-44.3	178.6	169.9	0	0	0	0	111.2	R29 V30 E31 N35 E36 W37 L64 I66 I75	R29-V33 WeakPolarHBondContact O-CG2 3.17Å; R29-V33 PolarHBondContact O-N 3.25Å; R29-V33 VanDerWaalsContact O-N 3.16Å; V30-V33 PolarHBondContact O-N 3.33Å; E31-V33 VanDerWaalsContact C-N 3.32Å; E31-V33 PolarHBondContact O-N 2.63Å; V33-N35 VanDerWaalsContact C-N 3.28Å; V33-N35 PolarHBondContact O-N 2.83Å; V33-E36 PolarHBondContact O-N 3.4Å; V33-W37 HydrophobicContact CG1-CD2 3.68Å; V33-W37 HydrophobicContact CG1-CE3 3.55Å; V33-W37 HydrophobicContact CG1-CH2 3.54Å; V33-W37 HydrophobicContact CG1-CZ2 3.63Å; V33-W37 HydrophobicContact CG1-CZ3 3.47Å; V33-W37 VanDerWaalsContact CG1-CZ3 3.47Å; V33-W37 PolarHBondContact O-N 3.48Å; V33-L64 HydrophobicContact CG1-CD1 4.02Å; V33-L64 HydrophobicContact CG2-CD1 3.99Å; V33-I66 HydrophobicContact CG2-CG2 4.2Å; V33-I75 HydrophobicContact CG1-CD1 4.01Å; V33-I75 HydrophobicContact CG1-CG2 3.92Å; V33-I75 HydrophobicContact CG2-CG2 4.39Å
34	L	89.2	Confident	81.9	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.4	-39	176.8	-67.7	177.8	0	0	0	112.2	V30 E31 K38 L39 C160 M164	V30-L34 HydrophobicContact CG1-CD1 4.44Å; V30-L34 WeakPolarHBondContact O-CG 3.23Å; V30-L34 PolarHBondContact O-N 2.9Å; E31-L34 PolarHBondContact O-N 2.86Å; L34-K38 PolarHBondContact O-N 3.27Å; L34-L39 HydrophobicContact CD2-CD1 3.92Å; L34-L39 PolarHBondContact O-N 3.5Å; L34-C160 HydrophobicContact CD1-CB 4.17Å; L34-M164 HydrophobicContact CD1-CE 3.86Å; L34-M164 HydrophobicContact CD2-CE 3.75Å; L34-M164 HydrophobicContact CG-CE 4.18Å
35	N	88.6	Confident	80.2	Confident	84 Å²	84	59 Å²	59	45%	0.449	28%	0.279	S	S	.	.	H	α-helix	trans	-72.2	-40	176.5	-73.7	-40.7	0	0	0	112.5	E31 E32 V33 W37 K38 T40	E31-N35 WeakPolarHBondContact O-CB 3.5Å; E31-N35 PolarHBondContact O-N 3.47Å; E31-N35 PolarHBondContact O-ND2 3.09Å; E32-N35 PolarHBondContact O-N 2.92Å; V33-N35 VanDerWaalsContact C-N 3.28Å; V33-N35 PolarHBondContact O-N 2.83Å; N35-W37 VanDerWaalsContact C-N 3.28Å; N35-W37 PolarHBondContact O-N 3.21Å; N35-K38 PolarHBondContact O-N 3.34Å; N35-T40 VanDerWaalsContact OD1-CG2 3.31Å; N35-T40 WeakPolarHBondContact OD1-CG2 3.46Å; N35-T40 PolarHBondContact OD1-OG1 3.3Å
36	E	88.9	Confident	78.4	Confident	121 Å²	121	60.5 Å²	60.5	57%	0.565	29%	0.289	S	S	*	.	H	α-helix	trans	-59.4	-40.8	175.9	-175.2	176.5	177.7	0	0	111.2	E32 V33 K38	E32-E36 WeakPolarHBondContact O-CB 3.33Å; E32-E36 PolarHBondContact O-N 3.25Å; V33-E36 PolarHBondContact O-N 3.4Å; E36-K38 VanDerWaalsContact C-N 3.26Å; E36-K38 PolarHBondContact O-N 2.97Å
37	W	87.8	Confident	76.8	Confident	31 Å²	31	64.4 Å²	64.4	12%	0.117	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-0.5	176.4	-63.1	-18.4	0	0	0	114.3	V33 N35 L39 Q62 L64 I75 H77 V127	V33-W37 HydrophobicContact CG1-CD2 3.68Å; V33-W37 HydrophobicContact CG1-CE3 3.55Å; V33-W37 HydrophobicContact CG1-CH2 3.54Å; V33-W37 HydrophobicContact CG1-CZ2 3.63Å; V33-W37 HydrophobicContact CG1-CZ3 3.47Å; V33-W37 VanDerWaalsContact CG1-CZ3 3.47Å; V33-W37 PolarHBondContact O-N 3.48Å; N35-W37 VanDerWaalsContact C-N 3.28Å; N35-W37 PolarHBondContact O-N 3.21Å; W37-L39 HydrophobicContact CB-CD1 4.12Å; W37-L39 HydrophobicContact CB-CD2 4.45Å; W37-L39 HydrophobicContact CB-CG 3.83Å; W37-L39 HydrophobicContact CE3-CD1 3.93Å; W37-L39 PolarHBondContact O-N 3.49Å; W37-Q62 HydrophobicContact CZ2-CB 4.4Å; W37-L64 HydrophobicContact CZ2-CB 4.14Å; W37-L64 HydrophobicContact CZ2-CD1 3.72Å; W37-L64 HydrophobicContact CZ2-CG 3.86Å; W37-I75 HydrophobicContact CH2-CB 4.35Å; W37-I75 HydrophobicContact CH2-CG1 3.97Å; W37-I75 HydrophobicContact CH2-CG2 3.87Å; W37-I75 HydrophobicContact CZ2-CG2 4.48Å; W37-I75 HydrophobicContact CZ3-CD1 4.29Å; W37-I75 HydrophobicContact CZ3-CG1 3.99Å; W37-H77 HydrophobicContact CD2-CB 4.28Å; W37-H77 HydrophobicContact CE3-CB 3.66Å; W37-H77 HydrophobicContact CH2-CB 3.95Å; W37-H77 HydrophobicContact CZ3-CB 3.49Å; W37-H77 VanDerWaalsContact CZ3-CB 3.49Å; W37-V127 HydrophobicContact CZ3-CG1 4.33Å
38	K	83.4	Confident	75.4	Confident	129 Å²	129	67.7 Å²	67.7	56%	0.561	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	30.5	-179.1	-54.4	-177.2	179	-175.8	0	114.4	L34 N35 E36 T40 E41	L34-K38 PolarHBondContact O-N 3.27Å; N35-K38 PolarHBondContact O-N 3.34Å; E36-K38 VanDerWaalsContact C-N 3.26Å; E36-K38 PolarHBondContact O-N 2.97Å; K38-T40 PolarHBondContact O-N 2.87Å; K38-E41 PolarHBondContact O-N 2.86Å
39	L	81.1	Confident	74.3	Confident	16 Å²	16	65.2 Å²	65.2	8%	0.084	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-0.8	179.6	-57	-179.3	0	0	0	113.3	L34 W37 H77 E125 V127 C160 V162	L34-L39 HydrophobicContact CD2-CD1 3.92Å; L34-L39 PolarHBondContact O-N 3.5Å; W37-L39 HydrophobicContact CB-CD1 4.12Å; W37-L39 HydrophobicContact CB-CD2 4.45Å; W37-L39 HydrophobicContact CB-CG 3.83Å; W37-L39 HydrophobicContact CE3-CD1 3.93Å; W37-L39 PolarHBondContact O-N 3.49Å; L39-H77 WeakPolarHBondContact CD2-NE2 3.29Å; L39-E125 WeakPolarHBondContact CD2-OE1 3.37Å; L39-V127 HydrophobicContact CD1-CG2 3.91Å; L39-C160 PolarHBondContact O-SG 2.92Å; L39-V162 HydrophobicContact CB-CG2 4.39Å; L39-V162 HydrophobicContact CD2-CG2 4.44Å
40	T	73.6	Confident	73.3	Confident	42 Å²	42	69.2 Å²	69.2	26%	0.258	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-11.6	175.6	52.2	0	0	0	0	112.9	N35 K38 N42 S158 C160	N35-T40 VanDerWaalsContact OD1-CG2 3.31Å; N35-T40 WeakPolarHBondContact OD1-CG2 3.46Å; N35-T40 PolarHBondContact OD1-OG1 3.3Å; K38-T40 PolarHBondContact O-N 2.87Å; T40-N42 PolarHBondContact O-N 3.44Å; T40-S158 VanDerWaalsContact CG2-O 3.22Å; T40-S158 WeakPolarHBondContact CG2-O 3.36Å; T40-C160 HydrophobicContact CG2-CB 4.47Å
41	E	64	Low	72.2	Confident	90 Å²	90	77 Å²	77	42%	0.421	38%	0.375	S	S	.	.	S	Bend	trans	-81.9	110.5	175.1	-67.6	-179.4	177.7	0	0	109.8	K38 Y43	K38-E41 PolarHBondContact O-N 2.86Å; E41-Y43 HydrophobicContact CB-CD2 4.28Å; E41-Y43 HydrophobicContact CB-CE2 3.63Å; E41-Y43 VanDerWaalsContact O-CD2 3.28Å; E41-Y43 WeakPolarHBondContact O-CD2 3.48Å; E41-Y43 PolarHBondContact O-N 3.11Å; E41-Y43 PolarHBondContact OE2-OH 3.48Å
42	N	56.2	Low	71.2	Confident	92 Å²	92	75.9 Å²	75.9	49%	0.492	38%	0.375	S	S	.	.			trans	-70	97.6	178.6	-71.4	-25.5	0	0	0	111.2	T40 Q161	T40-N42 PolarHBondContact O-N 3.44Å; N42-Q161 PolarHBondContact OD1-NE2 2.91Å
43	Y	53.5	Low	70.4	Confident	92 Å²	92	72.3 Å²	72.3	36%	0.361	36%	0.361	S	S	.	.			trans	-88.8	120.2	165.1	-64.2	-79.9	0	0	0	109.2	E41 E45 K86	E41-Y43 HydrophobicContact CB-CD2 4.28Å; E41-Y43 HydrophobicContact CB-CE2 3.63Å; E41-Y43 VanDerWaalsContact O-CD2 3.28Å; E41-Y43 WeakPolarHBondContact O-CD2 3.48Å; E41-Y43 PolarHBondContact O-N 3.11Å; E41-Y43 PolarHBondContact OE2-OH 3.48Å; Y43-E45 PolarHBondContact O-N 2.9Å; Y43-E45 VanDerWaalsContact O-N 3.17Å; Y43-K86 HydrophobicContact CD1-CD 4.1Å; Y43-K86 HydrophobicContact CE1-CD 3.76Å
44	V	49.5	Very low	69.7	Low	50 Å²	50	72.6 Å²	72.6	30%	0.303	36%	0.362	S	S	.	.			trans	-85.2	87.2	176.5	-173	0	0	0	0	108.7	K46	V44-K46 HydrophobicContact CG1-CG 3.84Å; V44-K46 PolarHBondContact O-N 2.96Å
45	E	52.8	Low	68.8	Low	72 Å²	72	76.2 Å²	76.2	34%	0.336	38%	0.381	S	S	.	.			trans	-78.6	111.4	165.8	-85.3	-177.7	163.4	0	0	109.7	Y43 L98	Y43-E45 PolarHBondContact O-N 2.9Å; Y43-E45 VanDerWaalsContact O-N 3.17Å; E45-L98 HydrophobicContact CB-CD1 4.37Å; E45-L98 HydrophobicContact CB-CD2 4.3Å; E45-L98 WeakPolarHBondContact O-CD2 3.49Å
46	K	49.9	Very low	68.1	Low	166 Å²	166	79 Å²	79	72%	0.722	40%	0.396	S	S	*	.			trans	-89.9	-1.1	-178	-72.8	-170	173.4	-179.8	0	114.4	V44	V44-K46 HydrophobicContact CG1-CG 3.84Å; V44-K46 PolarHBondContact O-N 2.96Å
47	T	57.7	Low	67.3	Low	85 Å²	85	74.4 Å²	74.4	52%	0.521	38%	0.382	S	S	.	.			trans	-98.6	114.1	-173.1	23.2	0	0	0	0	110.9	R124	T47-R124 PolarHBondContact O-NH1 3.06Å
48	S	61.8	Low	66.8	Low	78 Å²	78	76.1 Å²	76.1	55%	0.545	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-55.4	143.9	166	56.7	0	0	0	0	110	E50	S48-E50 PolarHBondContact O-N 3.3Å
49	P	67.5	Low	67	Low	2 Å²	2	73.3 Å²	73.3	1%	0.013	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-58	137.2	-179.4	21.3	-29.4	0	0	0	111.2	A53 Y54	P49-A53 HydrophobicContact CB-CB 4.06Å; P49-Y54 HydrophobicContact CB-CE1 3.96Å; P49-Y54 HydrophobicContact CG-CE1 4.11Å
50	E	69.4	Low	67.2	Low	165 Å²	165	75.8 Å²	75.8	77%	0.771	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-59.5	153.2	172.3	-65.9	-170.9	169.4	0	0	110.3	S48 G52 A53 N108	S48-E50 PolarHBondContact O-N 3.3Å; E50-G52 PolarHBondContact O-N 3.29Å; E50-A53 WeakPolarHBondContact O-CB 3.26Å; E50-A53 PolarHBondContact O-N 2.87Å; E50-N108 PolarHBondContact O-ND2 2.97Å; E50-N108 VanDerWaalsContact O-ND2 3.13Å; E50-N108 PolarHBondContact O-OD1 3.22Å
51	K	69.5	Low	68.1	Low	166 Å²	166	80 Å²	80	72%	0.722	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	122.6	176	-173.4	179.5	-178.6	-177.9	0	109.2	H107	K51-H107 HydrophobicContact CB-CB 4.28Å
52	G	69.4	Low	69.3	Low	17 Å²	17	79.6 Å²	79.6	18%	0.175	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.9	0.8	-175.4	0	0	0	0	0	114.9	E50 Y54 I55 N56 N108	E50-G52 PolarHBondContact O-N 3.29Å; G52-Y54 PolarHBondContact O-N 2.56Å; G52-I55 PolarHBondContact O-N 2.8Å; G52-N56 PolarHBondContact O-N 2.95Å; G52-N108 PolarHBondContact N-OD1 2.74Å
53	A	73.8	Confident	71	Confident	21 Å²	21	79.1 Å²	79.1	17%	0.174	41%	0.414	C	S	.	.	H	α-helix	trans	-58.7	-33.6	-178.3	0	0	0	0	0	113.2	P49 E50 I55 G57 L80	P49-A53 HydrophobicContact CB-CB 4.06Å; E50-A53 WeakPolarHBondContact O-CB 3.26Å; E50-A53 PolarHBondContact O-N 2.87Å; A53-I55 VanDerWaalsContact C-N 3.27Å; A53-I55 PolarHBondContact O-N 3.47Å; A53-G57 VanDerWaalsContact O-CA 3.29Å; A53-G57 WeakPolarHBondContact O-CA 3.27Å; A53-G57 PolarHBondContact O-N 2.81Å; A53-L80 HydrophobicContact CB-CD2 4.36Å
54	Y	75.3	Confident	72.9	Confident	5 Å²	5	77 Å²	77	2%	0.02	41%	0.409	C	S	.	.	H	α-helix	trans	-75.2	-17	178.8	-61.1	-11.4	0	0	0	113.7	P49 G52 W59 L80 N108 V118 G122 R124	P49-Y54 HydrophobicContact CB-CE1 3.96Å; P49-Y54 HydrophobicContact CG-CE1 4.11Å; G52-Y54 PolarHBondContact O-N 2.56Å; Y54-W59 HydrophobicContact CD1-CZ2 4.37Å; Y54-W59 PolarHBondContact O-NE1 3.3Å; Y54-L80 HydrophobicContact CD1-CD2 3.87Å; Y54-L80 HydrophobicContact CE1-CD2 4.09Å; Y54-N108 HydrophobicContact CD2-CB 3.35Å; Y54-N108 HydrophobicContact CE2-CB 3.62Å; Y54-N108 HydrophobicContact CG-CB 3.96Å; Y54-V118 HydrophobicContact CD2-CG1 3.78Å; Y54-V118 HydrophobicContact CE2-CG1 4.16Å; Y54-V118 HydrophobicContact CG-CG1 4.16Å; Y54-G122 WeakPolarHBondContact CE2-O 3.44Å; Y54-G122 PolarHBondContact OH-O 3.38Å; Y54-R124 HydrophobicContact CE1-CG 3.68Å; Y54-R124 WeakPolarHBondContact OH-CG 3.29Å
55	I	71.9	Confident	74.9	Confident	76 Å²	76	78 Å²	78	39%	0.39	41%	0.413	S	S	.	.	H	α-helix	trans	-93.7	-45.5	-179.7	-55.5	177.1	0	0	0	109.8	G52 A53 P111 P112	G52-I55 PolarHBondContact O-N 2.8Å; A53-I55 VanDerWaalsContact C-N 3.27Å; A53-I55 PolarHBondContact O-N 3.47Å; I55-P111 HydrophobicContact CG1-CB 4.46Å; I55-P112 HydrophobicContact CD1-CG 4.07Å; I55-P112 HydrophobicContact CG1-CG 4.36Å
56	N	72.2	Confident	76.7	Confident	142 Å²	142	74.7 Å²	74.7	76%	0.759	40%	0.397	S	S	*	.	H	α-helix	trans	-95.2	-17.1	-173.2	-63.9	-6	0	0	0	113.3	G52	G52-N56 PolarHBondContact O-N 2.95Å
57	G	73.4	Confident	78.5	Confident	26 Å²	26	72 Å²	72	27%	0.268	39%	0.387	S	S	.	.	S	Bend	trans	-78.1	146.4	-178.3	0	0	0	0	0	112.8	A53	A53-G57 VanDerWaalsContact O-CA 3.29Å; A53-G57 WeakPolarHBondContact O-CA 3.27Å; A53-G57 PolarHBondContact O-N 2.81Å
58	S	77.9	Confident	79.8	Confident	67 Å²	67	70 Å²	70	47%	0.469	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-80.7	119.7	176.3	54.9	0	0	0	0	110.7	K81	S58-K81 VanDerWaalsContact O-CB 3.3Å; S58-K81 WeakPolarHBondContact O-CB 3.47Å; S58-K81 PolarHBondContact O-N 3.37Å; S58-K81 WeakPolarHBondContact OG-CB 3.4Å
59	W	85.9	Confident	80.7	Confident	70 Å²	70	68.4 Å²	68.4	27%	0.265	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	133.8	173.3	-71.2	82.7	0	0	0	110.4	Y54 L80 V118 R124 F126	Y54-W59 HydrophobicContact CD1-CZ2 4.37Å; Y54-W59 PolarHBondContact O-NE1 3.3Å; W59-L80 HydrophobicContact CD2-CD1 4.11Å; W59-L80 HydrophobicContact CG-CD1 4.25Å; W59-L80 HydrophobicContact CH2-CB 4.41Å; W59-L80 HydrophobicContact CZ2-CB 4.49Å; W59-L80 HydrophobicContact CZ2-CD1 4.15Å; W59-L80 HydrophobicContact CZ3-CB 4.48Å; W59-V118 HydrophobicContact CH2-CB 4.33Å; W59-V118 HydrophobicContact CH2-CG1 4.02Å; W59-V118 HydrophobicContact CH2-CG2 3.34Å; W59-V118 HydrophobicContact CZ2-CB 4.45Å; W59-V118 HydrophobicContact CZ2-CG1 3.87Å; W59-V118 HydrophobicContact CZ2-CG2 3.81Å; W59-V118 HydrophobicContact CZ3-CG2 3.92Å; W59-R124 WeakPolarHBondContact CZ3-O 3.33Å; W59-F126 HydrophobicContact CZ3-CE1 4.14Å
60	E	86.9	Confident	81.3	Confident	68 Å²	68	76.5 Å²	76.5	32%	0.318	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	147.4	171.5	-70.6	-173.8	-179.9	0	0	110.1	F79 K81	E60-F79 HydrophobicContact CB-CD1 4.47Å; E60-F79 HydrophobicContact CB-CD2 4.48Å; E60-F79 HydrophobicContact CB-CE1 3.87Å; E60-F79 HydrophobicContact CB-CE2 3.86Å; E60-F79 HydrophobicContact CB-CZ 3.52Å; E60-F79 HydrophobicContact CG-CE2 4.49Å; E60-F79 HydrophobicContact CG-CZ 4.39Å; E60-F79 PolarHBondContact N-O 2.9Å; E60-F79 PolarHBondContact O-N 3.37Å; E60-F79 VanDerWaalsContact O-N 3.16Å; E60-F79 VanDerWaalsContact OE2-CZ 3.29Å; E60-F79 WeakPolarHBondContact OE2-CZ 3.44Å; E60-K81 WeakPolarHBondContact OE1-CD 3.38Å; E60-K81 WeakPolarHBondContact OE1-CE 3.48Å; E60-K81 IonicContact OE1-NZ 3.71Å; E60-K81 PolarHBondContact OE1-NZ 2.98Å
61	E	90.9	Very high	82.1	Confident	131 Å²	131	71.2 Å²	71.2	61%	0.612	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.1	129.2	179.8	-54.8	-169.8	164.3	0	0	110	H77 H78	E61-H77 VanDerWaalsContact CA-O 3.3Å; E61-H77 WeakPolarHBondContact CA-O 3.41Å; E61-H78 WeakPolarHBondContact CG-ND1 3.4Å; E61-H78 IonicContact OE1-CE1 3.16Å; E61-H78 PolarHBondContact OE1-CE1 2.84Å; E61-H78 IonicContact OE1-ND1 3.93Å; E61-H78 PolarHBondContact OE1-ND1 2.64Å; E61-H78 IonicContact OE2-CE1 3.68Å; E61-H78 IonicContact OE2-ND1 3.74Å
62	Q	90.4	Very high	83	Confident	80 Å²	80	66 Å²	66	37%	0.374	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	128.4	172.8	-64.2	-176.4	13.4	0	0	109	W37 T76 H77 F79	W37-Q62 HydrophobicContact CZ2-CB 4.4Å; Q62-T76 CarbonylContact O-C 3.58Å; Q62-T76 VanDerWaalsContact O-CA 3.3Å; Q62-T76 WeakPolarHBondContact O-CA 3.36Å; Q62-H77 PolarHBondContact N-O 2.83Å; Q62-H77 PolarHBondContact O-N 3.36Å; Q62-F79 HydrophobicContact CG-CE1 4.32Å
63	S	91.9	Very high	84	Confident	83 Å²	83	65.6 Å²	65.6	58%	0.58	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.6	137.6	-174.9	64.8	0	0	0	0	112	I75	S63-I75 WeakPolarHBondContact CA-O 3.29Å
64	L	92.8	Very high	84.9	Confident	47 Å²	47	68 Å²	68	25%	0.246	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	151.9	175.9	-75	173.7	0	0	0	111.2	V33 W37 Y74 I75	V33-L64 HydrophobicContact CG1-CD1 4.02Å; V33-L64 HydrophobicContact CG2-CD1 3.99Å; W37-L64 HydrophobicContact CZ2-CB 4.14Å; W37-L64 HydrophobicContact CZ2-CD1 3.72Å; W37-L64 HydrophobicContact CZ2-CG 3.86Å; L64-Y74 WeakPolarHBondContact O-CA 3.28Å; L64-I75 HydrophobicContact CB-CG2 3.87Å; L64-I75 PolarHBondContact N-O 2.96Å; L64-I75 WeakPolarHBondContact O-CG2 3.29Å; L64-I75 PolarHBondContact O-N 3.39Å
65	D	91.3	Very high	85.8	Confident	72 Å²	72	67.8 Å²	67.8	39%	0.385	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	128.3	174.8	-75.2	-30.8	0	0	0	110.5	K72 Y74	D65-K72 WeakPolarHBondContact OD1-CE 3.32Å; D65-K72 IonicContact OD1-NZ 2.71Å; D65-K72 PolarHBondContact OD1-NZ 3.34Å; D65-K72 WeakPolarHBondContact OD2-CE 3.37Å; D65-K72 IonicContact OD2-NZ 3.61Å; D65-K72 PolarHBondContact OD2-NZ 3.2Å; D65-Y74 WeakPolarHBondContact OD1-CD1 3.44Å; D65-Y74 WeakPolarHBondContact OD1-CE1 3.44Å
66	I	90.7	Very high	86.9	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.005	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	146.3	174.8	48.9	158.7	0	0	0	110.4	F26 R29 V30 V33 F73 I75 I129	F26-I66 HydrophobicContact CE2-CD1 3.79Å; F26-I66 HydrophobicContact CE2-CG1 4.47Å; F26-I66 HydrophobicContact CZ-CD1 3.96Å; R29-I66 HydrophobicContact CG-CB 4.48Å; R29-I66 HydrophobicContact CG-CG2 3.8Å; V30-I66 HydrophobicContact CG2-CD1 4.17Å; V33-I66 HydrophobicContact CG2-CG2 4.2Å; I66-F73 HydrophobicContact CD1-CB 3.96Å; I66-F73 HydrophobicContact CG1-CB 3.69Å; I66-F73 PolarHBondContact N-O 2.9Å; I66-F73 PolarHBondContact O-N 3.12Å; I66-F73 VanDerWaalsContact O-O 3.04Å; I66-I75 HydrophobicContact CD1-CB 3.94Å; I66-I75 HydrophobicContact CD1-CG2 4.28Å; I66-I75 HydrophobicContact CG1-CB 4.18Å; I66-I75 HydrophobicContact CG1-CG2 4.14Å; I66-I75 HydrophobicContact CG2-CG2 4Å; I66-I129 HydrophobicContact CD1-CG2 4.27Å
67	H	87.6	Confident	87.9	Confident	109 Å²	109	59 Å²	59	51%	0.505	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	129.8	-173.9	-70.7	-81.3	0	0	0	111	F71	H67-F71 WeakPolarHBondContact CA-O 3.42Å
68	F	84.7	Confident	88.8	Confident	43 Å²	43	58.3 Å²	58.3	19%	0.189	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	102.2	165.3	-174.3	-85	0	0	0	107.7	W23 F26 D70 F71 F73 L146	W23-F68 HydrophobicContact CB-CE2 4.22Å; F26-F68 HydrophobicContact CB-CD2 3.62Å; F26-F68 HydrophobicContact CB-CE2 4.22Å; F26-F68 AromaticContact CD1-CD2 3.99Å; F26-F68 HydrophobicContact CD1-CD2 3.99Å; F26-F68 HydrophobicContact CD2-CB 3.76Å; F26-F68 AromaticContact CD2-CD2 3.94Å; F26-F68 HydrophobicContact CD2-CD2 3.94Å; F26-F68 HydrophobicContact CD2-CG 4.37Å; F26-F68 HydrophobicContact CE2-CB 4.03Å; F26-F68 HydrophobicContact CG-CB 4.31Å; F26-F68 AromaticContact CG-CD2 3.59Å; F26-F68 HydrophobicContact CG-CD2 3.59Å; F26-F68 HydrophobicContact CG-CE2 4.46Å; F26-F68 HydrophobicContact CG-CG 4.45Å; F68-D70 PolarHBondContact O-N 3.3Å; F68-F71 PolarHBondContact N-O 3.31Å; F68-F71 WeakPolarHBondContact O-CB 3.32Å; F68-F71 PolarHBondContact O-N 2.97Å; F68-F73 HydrophobicContact CB-CD2 4.09Å; F68-F73 HydrophobicContact CB-CE2 3.76Å; F68-L146 HydrophobicContact CE1-CD2 4.4Å; F68-L146 HydrophobicContact CE2-CD2 4.27Å; F68-L146 HydrophobicContact CZ-CD2 3.76Å
69	A	82	Confident	89.3	Confident	46 Å²	46	56.9 Å²	56.9	38%	0.38	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	-123.1	-168.7	0	0	0	0	0	110.9	E22 F71	E22-A69 WeakPolarHBondContact OE2-CB 3.38Å; A69-F71 VanDerWaalsContact C-N 3.31Å; A69-F71 PolarHBondContact O-N 3.45Å
70	D	80	Confident	89.2	Confident	171 Å²	171	54.3 Å²	54.3	91%	0.914	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-5.3	177.6	-63	-34.2	0	0	0	113.9	F68	F68-D70 PolarHBondContact O-N 3.3Å
71	F	85.6	Confident	88.8	Confident	54 Å²	54	56 Å²	56	24%	0.237	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	127	-174.8	-160.9	-82.4	0	0	0	111.4	H67 F68 A69 F73 P131 C135 E136	H67-F71 WeakPolarHBondContact CA-O 3.42Å; F68-F71 PolarHBondContact N-O 3.31Å; F68-F71 WeakPolarHBondContact O-CB 3.32Å; F68-F71 PolarHBondContact O-N 2.97Å; A69-F71 VanDerWaalsContact C-N 3.31Å; A69-F71 PolarHBondContact O-N 3.45Å; F71-F73 HydrophobicContact CD1-CD1 4.22Å; F71-F73 AromaticContact CD1-CD2 3.85Å; F71-F73 HydrophobicContact CD1-CD2 3.85Å; F71-F73 AromaticContact CD1-CE1 3.78Å; F71-F73 HydrophobicContact CD1-CE1 3.78Å; F71-F73 AromaticContact CD1-CE2 3.41Å; F71-F73 HydrophobicContact CD1-CE2 3.41Å; F71-F73 VanDerWaalsContact CD1-CE2 3.41Å; F71-F73 HydrophobicContact CD1-CG 4.24Å; F71-F73 AromaticContact CD1-CZ 3.35Å; F71-F73 HydrophobicContact CD1-CZ 3.35Å; F71-F73 AromaticContact CE1-CD1 3.98Å; F71-F73 HydrophobicContact CE1-CD1 3.98Å; F71-F73 HydrophobicContact CE1-CD2 4.43Å; F71-F73 AromaticContact CE1-CE1 3.43Å; F71-F73 HydrophobicContact CE1-CE1 3.43Å; F71-F73 VanDerWaalsContact CE1-CE1 3.43Å; F71-F73 AromaticContact CE1-CE2 3.97Å; F71-F73 HydrophobicContact CE1-CE2 3.97Å; F71-F73 HydrophobicContact CE1-CG 4.43Å; F71-F73 AromaticContact CE1-CZ 3.43Å; F71-F73 HydrophobicContact CE1-CZ 3.43Å; F71-F73 VanDerWaalsContact CE1-CZ 3.43Å; F71-F73 HydrophobicContact CG-CE2 4.33Å; F71-F73 HydrophobicContact CG-CZ 4.39Å; F71-P131 HydrophobicContact CE1-CB 3.82Å; F71-P131 HydrophobicContact CZ-CB 3.9Å; F71-C135 HydrophobicContact CD2-CB 4.42Å; F71-C135 HydrophobicContact CE1-CB 3.89Å; F71-C135 HydrophobicContact CE2-CB 3.72Å; F71-C135 HydrophobicContact CZ-CB 3.44Å; F71-C135 VanDerWaalsContact CZ-CB 3.44Å; F71-E136 VanDerWaalsContact CZ-O 3.27Å; F71-E136 WeakPolarHBondContact CZ-O 3.46Å
72	K	88.4	Confident	87.6	Confident	57 Å²	57	52.3 Å²	52.3	25%	0.248	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	131.7	-179.1	-171.9	176.9	-178.5	179.5	0	111.5	D65 G132	D65-K72 WeakPolarHBondContact OD1-CE 3.32Å; D65-K72 IonicContact OD1-NZ 2.71Å; D65-K72 PolarHBondContact OD1-NZ 3.34Å; D65-K72 WeakPolarHBondContact OD2-CE 3.37Å; D65-K72 IonicContact OD2-NZ 3.61Å; D65-K72 PolarHBondContact OD2-NZ 3.2Å; K72-G132 PolarHBondContact O-N 3.24Å
73	F	90.9	Very high	85.5	Confident	8 Å²	8	56.4 Å²	56.4	4%	0.035	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	147.9	174.3	-72.2	-72.2	0	0	0	110.1	F26 I66 F68 F71 I129 S130 P131 I138 L147	F26-F73 AromaticContact CE2-CD2 3.92Å; F26-F73 HydrophobicContact CE2-CD2 3.92Å; F26-F73 HydrophobicContact CE2-CE2 4.47Å; F26-F73 HydrophobicContact CZ-CD2 4.23Å; I66-F73 HydrophobicContact CD1-CB 3.96Å; I66-F73 HydrophobicContact CG1-CB 3.69Å; I66-F73 PolarHBondContact N-O 2.9Å; I66-F73 PolarHBondContact O-N 3.12Å; I66-F73 VanDerWaalsContact O-O 3.04Å; F68-F73 HydrophobicContact CB-CD2 4.09Å; F68-F73 HydrophobicContact CB-CE2 3.76Å; F71-F73 HydrophobicContact CD1-CD1 4.22Å; F71-F73 AromaticContact CD1-CD2 3.85Å; F71-F73 HydrophobicContact CD1-CD2 3.85Å; F71-F73 AromaticContact CD1-CE1 3.78Å; F71-F73 HydrophobicContact CD1-CE1 3.78Å; F71-F73 AromaticContact CD1-CE2 3.41Å; F71-F73 HydrophobicContact CD1-CE2 3.41Å; F71-F73 VanDerWaalsContact CD1-CE2 3.41Å; F71-F73 HydrophobicContact CD1-CG 4.24Å; F71-F73 AromaticContact CD1-CZ 3.35Å; F71-F73 HydrophobicContact CD1-CZ 3.35Å; F71-F73 AromaticContact CE1-CD1 3.98Å; F71-F73 HydrophobicContact CE1-CD1 3.98Å; F71-F73 HydrophobicContact CE1-CD2 4.43Å; F71-F73 AromaticContact CE1-CE1 3.43Å; F71-F73 HydrophobicContact CE1-CE1 3.43Å; F71-F73 VanDerWaalsContact CE1-CE1 3.43Å; F71-F73 AromaticContact CE1-CE2 3.97Å; F71-F73 HydrophobicContact CE1-CE2 3.97Å; F71-F73 HydrophobicContact CE1-CG 4.43Å; F71-F73 AromaticContact CE1-CZ 3.43Å; F71-F73 HydrophobicContact CE1-CZ 3.43Å; F71-F73 VanDerWaalsContact CE1-CZ 3.43Å; F71-F73 HydrophobicContact CG-CE2 4.33Å; F71-F73 HydrophobicContact CG-CZ 4.39Å; F73-I129 HydrophobicContact CB-CG2 4.1Å; F73-I129 HydrophobicContact CD1-CG2 3.94Å; F73-I129 HydrophobicContact CG-CG2 4.16Å; F73-S130 CarbonylContact C-O 3.56Å; F73-S130 WeakPolarHBondContact CA-O 3.45Å; F73-P131 HydrophobicContact CE1-CB 4.4Å; F73-I138 HydrophobicContact CE1-CD1 3.61Å; F73-I138 HydrophobicContact CE1-CG1 4.45Å; F73-I138 HydrophobicContact CZ-CD1 4.11Å; F73-L147 HydrophobicContact CE1-CD1 4.22Å; F73-L147 HydrophobicContact CE2-CD2 4.12Å; F73-L147 HydrophobicContact CZ-CD1 3.89Å; F73-L147 HydrophobicContact CZ-CD2 3.98Å
74	Y	92.2	Very high	83.1	Confident	73 Å²	73	55.7 Å²	55.7	29%	0.286	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	123.9	166.8	-69.8	-75.6	0	0	0	108	L64 D65 I129 S130	L64-Y74 WeakPolarHBondContact O-CA 3.28Å; D65-Y74 WeakPolarHBondContact OD1-CD1 3.44Å; D65-Y74 WeakPolarHBondContact OD1-CE1 3.44Å; Y74-I129 CarbonylContact O-C 3.57Å; Y74-I129 WeakPolarHBondContact O-CA 3.32Å; Y74-S130 PolarHBondContact N-O 2.95Å; Y74-S130 PolarHBondContact O-N 3.45Å
75	I	94.5	Very high	80.5	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	122	167.4	-171.2	167.3	0	0	0	107.8	V30 V33 W37 S63 L64 I66 V127 V128 I129	V30-I75 HydrophobicContact CG1-CD1 4.3Å; V33-I75 HydrophobicContact CG1-CD1 4.01Å; V33-I75 HydrophobicContact CG1-CG2 3.92Å; V33-I75 HydrophobicContact CG2-CG2 4.39Å; W37-I75 HydrophobicContact CH2-CB 4.35Å; W37-I75 HydrophobicContact CH2-CG1 3.97Å; W37-I75 HydrophobicContact CH2-CG2 3.87Å; W37-I75 HydrophobicContact CZ2-CG2 4.48Å; W37-I75 HydrophobicContact CZ3-CD1 4.29Å; W37-I75 HydrophobicContact CZ3-CG1 3.99Å; S63-I75 WeakPolarHBondContact CA-O 3.29Å; L64-I75 HydrophobicContact CB-CG2 3.87Å; L64-I75 PolarHBondContact N-O 2.96Å; L64-I75 WeakPolarHBondContact O-CG2 3.29Å; L64-I75 PolarHBondContact O-N 3.39Å; I66-I75 HydrophobicContact CD1-CB 3.94Å; I66-I75 HydrophobicContact CD1-CG2 4.28Å; I66-I75 HydrophobicContact CG1-CB 4.18Å; I66-I75 HydrophobicContact CG1-CG2 4.14Å; I66-I75 HydrophobicContact CG2-CG2 4Å; I75-V127 HydrophobicContact CD1-CG1 3.81Å; I75-V127 HydrophobicContact CG1-CG1 3.5Å; I75-V128 WeakPolarHBondContact CA-O 3.44Å; I75-I129 HydrophobicContact CB-CG1 4.37Å; I75-I129 HydrophobicContact CD1-CD1 4.4Å; I75-I129 HydrophobicContact CD1-CG1 4.17Å; I75-I129 HydrophobicContact CG1-CG1 4.01Å
76	T	94	Very high	78.1	Confident	23 Å²	23	66.9 Å²	66.9	14%	0.141	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	124.1	-177.8	61.4	0	0	0	0	110.1	Q62 H78 V127 V128	Q62-T76 CarbonylContact O-C 3.58Å; Q62-T76 VanDerWaalsContact O-CA 3.3Å; Q62-T76 WeakPolarHBondContact O-CA 3.36Å; T76-H78 PolarHBondContact OG1-NE2 2.93Å; T76-V127 CarbonylContact O-C 3.6Å; T76-V127 VanDerWaalsContact O-CA 3.31Å; T76-V127 WeakPolarHBondContact O-CA 3.47Å; T76-V128 PolarHBondContact N-O 3.24Å; T76-V128 PolarHBondContact O-N 2.87Å; T76-V128 PolarHBondContact OG1-O 3.24Å
77	H	93.9	Very high	75.6	Confident	9 Å²	9	75.3 Å²	75.3	4%	0.042	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	123	172	173.8	-130.6	0	0	0	109	W37 L39 E61 Q62 F79 E125 V127	W37-H77 HydrophobicContact CD2-CB 4.28Å; W37-H77 HydrophobicContact CE3-CB 3.66Å; W37-H77 HydrophobicContact CH2-CB 3.95Å; W37-H77 HydrophobicContact CZ3-CB 3.49Å; W37-H77 VanDerWaalsContact CZ3-CB 3.49Å; L39-H77 WeakPolarHBondContact CD2-NE2 3.29Å; E61-H77 VanDerWaalsContact CA-O 3.3Å; E61-H77 WeakPolarHBondContact CA-O 3.41Å; Q62-H77 PolarHBondContact N-O 2.83Å; Q62-H77 PolarHBondContact O-N 3.36Å; H77-F79 AromaticContact CE1-CD1 3.19Å; H77-F79 WeakPolarHBondContact CE1-CD1 3.49Å; H77-F79 AromaticContact CE1-CE1 3.8Å; H77-F79 AromaticContact CE1-CG 3.82Å; H77-F79 AromaticContact ND1-CD1 3.34Å; H77-F79 VanDerWaalsContact ND1-CD1 3.34Å; H77-F79 WeakPolarHBondContact ND1-CD1 3.35Å; H77-F79 AromaticContact ND1-CE1 3.68Å; H77-F79 AromaticContact NE2-CD1 3.91Å; H77-E125 IonicContact CD2-OE1 3.17Å; H77-E125 IonicContact CE1-OE1 3.99Å; H77-E125 PolarHBondContact CE1-OE1 2.83Å; H77-E125 WeakPolarHBondContact NE2-CG 3.31Å; H77-E125 IonicContact NE2-OE1 3.33Å; H77-E125 PolarHBondContact NE2-OE1 2.89Å; H77-V127 HydrophobicContact CB-CG2 4.29Å
78	H	91.9	Very high	73.2	Confident	12 Å²	12	77.4 Å²	77.4	6%	0.056	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	125.7	178.3	-59.7	-94.6	0	0	0	108.4	E61 T76 E125 F126	E61-H78 WeakPolarHBondContact CG-ND1 3.4Å; E61-H78 IonicContact OE1-CE1 3.16Å; E61-H78 PolarHBondContact OE1-CE1 2.84Å; E61-H78 IonicContact OE1-ND1 3.93Å; E61-H78 PolarHBondContact OE1-ND1 2.64Å; E61-H78 IonicContact OE2-CE1 3.68Å; E61-H78 IonicContact OE2-ND1 3.74Å; T76-H78 PolarHBondContact OG1-NE2 2.93Å; H78-E125 WeakPolarHBondContact O-CA 3.42Å; H78-F126 HydrophobicContact CB-CD1 4.36Å; H78-F126 HydrophobicContact CB-CD2 4.29Å; H78-F126 HydrophobicContact CB-CE1 3.84Å; H78-F126 HydrophobicContact CB-CE2 3.77Å; H78-F126 HydrophobicContact CB-CZ 3.51Å; H78-F126 AromaticContact CD2-CE2 3.51Å; H78-F126 AromaticContact CG-CE2 3.73Å; H78-F126 AromaticContact CG-CZ 3.77Å; H78-F126 PolarHBondContact N-O 3.06Å; H78-F126 PolarHBondContact O-N 3.46Å
79	F	89.2	Confident	71.3	Confident	37 Å²	37	77.9 Å²	77.9	16%	0.162	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	149.1	178.1	64.1	-83	0	0	0	112.2	E60 Q62 H77 R124 E125	E60-F79 HydrophobicContact CB-CD1 4.47Å; E60-F79 HydrophobicContact CB-CD2 4.48Å; E60-F79 HydrophobicContact CB-CE1 3.87Å; E60-F79 HydrophobicContact CB-CE2 3.86Å; E60-F79 HydrophobicContact CB-CZ 3.52Å; E60-F79 HydrophobicContact CG-CE2 4.49Å; E60-F79 HydrophobicContact CG-CZ 4.39Å; E60-F79 PolarHBondContact N-O 2.9Å; E60-F79 PolarHBondContact O-N 3.37Å; E60-F79 VanDerWaalsContact O-N 3.16Å; E60-F79 VanDerWaalsContact OE2-CZ 3.29Å; E60-F79 WeakPolarHBondContact OE2-CZ 3.44Å; Q62-F79 HydrophobicContact CG-CE1 4.32Å; H77-F79 AromaticContact CE1-CD1 3.19Å; H77-F79 WeakPolarHBondContact CE1-CD1 3.49Å; H77-F79 AromaticContact CE1-CE1 3.8Å; H77-F79 AromaticContact CE1-CG 3.82Å; H77-F79 AromaticContact ND1-CD1 3.34Å; H77-F79 VanDerWaalsContact ND1-CD1 3.34Å; H77-F79 WeakPolarHBondContact ND1-CD1 3.35Å; H77-F79 AromaticContact ND1-CE1 3.68Å; H77-F79 AromaticContact NE2-CD1 3.91Å; F79-R124 WeakPolarHBondContact CA-O 3.33Å; F79-E125 HydrophobicContact CB-CB 4.28Å; F79-E125 HydrophobicContact CB-CG 3.95Å
80	L	84.4	Confident	69.4	Low	16 Å²	16	85.7 Å²	85.7	8%	0.084	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	123.8	173.3	-169.5	65.1	0	0	0	109.8	A53 Y54 W59 E82 R124	A53-L80 HydrophobicContact CB-CD2 4.36Å; Y54-L80 HydrophobicContact CD1-CD2 3.87Å; Y54-L80 HydrophobicContact CE1-CD2 4.09Å; W59-L80 HydrophobicContact CD2-CD1 4.11Å; W59-L80 HydrophobicContact CG-CD1 4.25Å; W59-L80 HydrophobicContact CH2-CB 4.41Å; W59-L80 HydrophobicContact CZ2-CB 4.49Å; W59-L80 HydrophobicContact CZ2-CD1 4.15Å; W59-L80 HydrophobicContact CZ3-CB 4.48Å; L80-E82 PolarHBondContact O-N 2.97Å; L80-R124 PolarHBondContact N-O 3.22Å
81	K	78.4	Confident	67.8	Low	104 Å²	104	80.8 Å²	80.8	45%	0.452	40%	0.403	S	S	.	.			trans	-77	118.3	177.3	-171.9	-172.5	-162.9	148.3	0	110	S58 E60	S58-K81 VanDerWaalsContact O-CB 3.3Å; S58-K81 WeakPolarHBondContact O-CB 3.47Å; S58-K81 PolarHBondContact O-N 3.37Å; S58-K81 WeakPolarHBondContact OG-CB 3.4Å; E60-K81 WeakPolarHBondContact OE1-CD 3.38Å; E60-K81 WeakPolarHBondContact OE1-CE 3.48Å; E60-K81 IonicContact OE1-NZ 3.71Å; E60-K81 PolarHBondContact OE1-NZ 2.98Å
82	E	65.6	Low	66.2	Low	54 Å²	54	85 Å²	85	25%	0.252	42%	0.424	S	S	.	.			trans	-116.4	133.4	176.8	-73.3	175.3	-154.5	0	0	111.6	L80 C84 R124	L80-E82 PolarHBondContact O-N 2.97Å; E82-C84 PolarHBondContact O-N 2.83Å; E82-R124 IonicContact OE1-CZ 2.74Å; E82-R124 IonicContact OE1-NE 3.94Å; E82-R124 PolarHBondContact OE1-NE 3.08Å; E82-R124 IonicContact OE1-NH2 3.97Å; E82-R124 PolarHBondContact OE1-NH2 3.22Å; E82-R124 IonicContact OE2-CZ 2.85Å; E82-R124 IonicContact OE2-NH2 3.18Å; E82-R124 PolarHBondContact OE2-NH2 2.7Å
83	D	45.3	Very low	64.3	Low	166 Å²	166	91.3 Å²	91.3	89%	0.888	45%	0.454	S	S	*	.			trans	-77.8	62.4	175.4	-73.2	-29.1	0	0	0	110.4
84	C	42.5	Very low	62.7	Low	68 Å²	68	97 Å²	97	46%	0.459	49%	0.485	S	S	.	.			trans	-113.1	133.5	179	-84.4	0	0	0	0	113.4	E82 K86	E82-C84 PolarHBondContact O-N 2.83Å; C84-K86 PolarHBondContact O-N 3.41Å
85	K	37.2	Very low	61.7	Low	205 Å²	205	96 Å²	96	89%	0.891	49%	0.486	S	S	*	.			trans	-68.3	111.9	172.6	-68.8	175.3	-178.3	172.3	0	108.4	E87	K85-E87 PolarHBondContact O-N 3.24Å
86	K	41	Very low	61	Low	149 Å²	149	98.1 Å²	98.1	65%	0.648	50%	0.497	S	S	*	.			trans	-60.8	103.5	174.8	-61.1	-174.5	175.6	-162.6	0	110	Y43 C84	Y43-K86 HydrophobicContact CD1-CD 4.1Å; Y43-K86 HydrophobicContact CE1-CD 3.76Å; C84-K86 PolarHBondContact O-N 3.41Å
87	E	38.8	Very low	60.5	Low	177 Å²	177	97.1 Å²	97.1	83%	0.827	49%	0.491	S	S	*	.			trans	-91.2	121	166.4	-76.8	-166.6	167	0	0	109.4	K85 G89	K85-E87 PolarHBondContact O-N 3.24Å; E87-G89 VanDerWaalsContact C-N 3.28Å; E87-G89 PolarHBondContact O-N 3.4Å
88	N	36.3	Very low	60	Low	153 Å²	153	99.4 Å²	99.4	82%	0.818	50%	0.503	S	S	*	.			trans	-74.2	80.6	175.4	-77.2	-7.1	0	0	0	110.2
89	G	44.8	Very low	59.7	Low	53 Å²	53	99.1 Å²	99.1	55%	0.546	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-82.9	136.2	166.8	0	0	0	0	0	111	E87 S91	E87-G89 VanDerWaalsContact C-N 3.28Å; E87-G89 PolarHBondContact O-N 3.4Å; G89-S91 PolarHBondContact O-N 3.34Å
90	K	42.6	Very low	59.6	Low	210 Å²	210	97.5 Å²	97.5	91%	0.913	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-62.9	122.7	167.4	-69.7	-179.6	177.6	-178.9	0	108.6	E92	K90-E92 PolarHBondContact O-N 3.13Å
91	S	45.7	Very low	59.7	Low	68 Å²	68	100.6 Å²	100.6	48%	0.476	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-63.4	125.3	175.1	52.1	0	0	0	0	110.5	G89	G89-S91 PolarHBondContact O-N 3.34Å
92	E	51.8	Low	60.1	Low	144 Å²	144	96.2 Å²	96.2	67%	0.673	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-67	133.5	164.3	-68.3	177.4	176.2	0	0	108.4	K90 D94 T95	K90-E92 PolarHBondContact O-N 3.13Å; E92-D94 PolarHBondContact O-N 2.92Å; E92-T95 PolarHBondContact O-N 2.85Å; E92-T95 PolarHBondContact O-OG1 3.39Å
93	E	50.2	Low	61.1	Low	189 Å²	189	93.7 Å²	93.7	88%	0.883	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-12.1	-174.7	-73.3	-179.2	159	0	0	114.2
94	D	57	Low	63.1	Low	128 Å²	128	88.8 Å²	88.8	68%	0.684	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	2	-175.4	-94.1	-41	0	0	0	115.9	E92 K939	E92-D94 PolarHBondContact O-N 2.92Å; D94-K939 PolarHBondContact O-NZ 2.92Å; D94-K939 IonicContact OD1-NZ 3.2Å
95	T	70.8	Confident	65.1	Low	51 Å²	51	86.5 Å²	86.5	31%	0.313	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-74.7	129.1	-174.2	-41	0	0	0	0	111.5	E92	E92-T95 PolarHBondContact O-N 2.85Å; E92-T95 PolarHBondContact O-OG1 3.39Å
96	L	79.9	Confident	67.3	Low	45 Å²	45	79.9 Å²	79.9	24%	0.236	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-69.3	144.9	175.5	-67.5	171.8	0	0	0	111.1	M100 Q101 V185 L941	L96-M100 HydrophobicContact CB-CB 4.4Å; L96-M100 HydrophobicContact CD2-SD 4.06Å; L96-Q101 PolarHBondContact O-NE2 2.85Å; L96-V185 HydrophobicContact CD2-CG1 4.44Å; L96-L941 HydrophobicContact CD2-CD2 3.64Å
97	P	83.8	Confident	69.1	Low	1 Å²	1	77.7 Å²	77.7	1%	0.006	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-49.3	145.8	172.3	-28.7	34.4	0	0	0	113.1	A99 M100 Q101 Q161 V185	P97-A99 VanDerWaalsContact C-N 3.27Å; P97-A99 PolarHBondContact O-N 2.88Å; P97-M100 HydrophobicContact CB-CG 4.34Å; P97-M100 HydrophobicContact CG-CE 4.34Å; P97-M100 HydrophobicContact CG-CG 4.47Å; P97-M100 HydrophobicContact CG-SD 4.14Å; P97-M100 WeakPolarHBondContact O-CB 3.35Å; P97-M100 PolarHBondContact O-N 2.83Å; P97-Q101 PolarHBondContact O-N 2.92Å; P97-Q161 HydrophobicContact CB-CB 4.46Å; P97-V185 HydrophobicContact CG-CG2 4.26Å
98	L	82.9	Confident	71.1	Confident	57 Å²	57	70.1 Å²	70.1	30%	0.298	37%	0.368	S	S	.	.	H	α-helix	trans	-54.2	-44.3	179.9	-68.9	170.7	0	0	0	112	E45 M100 Q101 D102	E45-L98 HydrophobicContact CB-CD1 4.37Å; E45-L98 HydrophobicContact CB-CD2 4.3Å; E45-L98 WeakPolarHBondContact O-CD2 3.49Å; L98-M100 PolarHBondContact O-N 2.91Å; L98-Q101 WeakPolarHBondContact O-CB 3.36Å; L98-Q101 PolarHBondContact O-N 2.86Å; L98-D102 PolarHBondContact O-N 2.82Å
99	A	85.1	Confident	73.3	Confident	7 Å²	7	64.3 Å²	64.3	6%	0.058	34%	0.337	C	S	.	.	H	α-helix	trans	-55	-37	176.4	0	0	0	0	0	113.2	P97 D102 L103 L123 P163	P97-A99 VanDerWaalsContact C-N 3.27Å; P97-A99 PolarHBondContact O-N 2.88Å; A99-D102 PolarHBondContact O-N 2.86Å; A99-L103 WeakPolarHBondContact O-CG 3.07Å; A99-L103 PolarHBondContact O-N 2.82Å; A99-L123 HydrophobicContact CB-CD2 3.85Å; A99-P163 HydrophobicContact CB-CG 3.29Å
100	M	87.5	Confident	75.3	Confident	2 Å²	2	62.2 Å²	62.2	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-71.6	-34.2	177.6	-71.9	-174.2	-177.1	0	0	112.3	L96 P97 L98 V185 T187 P942	L96-M100 HydrophobicContact CB-CB 4.4Å; L96-M100 HydrophobicContact CD2-SD 4.06Å; P97-M100 HydrophobicContact CB-CG 4.34Å; P97-M100 HydrophobicContact CG-CE 4.34Å; P97-M100 HydrophobicContact CG-CG 4.47Å; P97-M100 HydrophobicContact CG-SD 4.14Å; P97-M100 WeakPolarHBondContact O-CB 3.35Å; P97-M100 PolarHBondContact O-N 2.83Å; L98-M100 PolarHBondContact O-N 2.91Å; M100-V185 HydrophobicContact CE-CB 3.81Å; M100-V185 HydrophobicContact CE-CG2 3.63Å; M100-V185 HydrophobicContact SD-CB 4.4Å; M100-V185 HydrophobicContact SD-CG2 4.03Å; M100-T187 WeakPolarHBondContact CE-OG1 3.34Å; M100-P942 HydrophobicContact CB-CG 3.79Å; M100-P942 HydrophobicContact CG-CG 4.23Å; M100-P942 WeakPolarHBondContact O-CG 3.45Å
101	Q	86.1	Confident	77.4	Confident	82 Å²	82	52.5 Å²	52.5	38%	0.383	27%	0.271	S	S	.	.	H	α-helix	trans	-67.9	-41.1	174.4	-57.8	179.5	34.7	0	0	110.5	L96 P97 L98 L103 L104 C105	L96-Q101 PolarHBondContact O-NE2 2.85Å; P97-Q101 PolarHBondContact O-N 2.92Å; L98-Q101 WeakPolarHBondContact O-CB 3.36Å; L98-Q101 PolarHBondContact O-N 2.86Å; Q101-L103 VanDerWaalsContact C-N 3.32Å; Q101-L103 PolarHBondContact O-N 3.17Å; Q101-L104 PolarHBondContact O-N 3.36Å; Q101-C105 PolarHBondContact O-N 2.77Å
102	D	86.8	Confident	78.8	Confident	12 Å²	12	50.1 Å²	50.1	6%	0.064	25%	0.254	C	S	.	.	H	α-helix	trans	-60.8	-36.3	177.2	-74.2	-15	0	0	0	112.8	L98 A99 L104 C105 R124	L98-D102 PolarHBondContact O-N 2.82Å; A99-D102 PolarHBondContact O-N 2.86Å; D102-L104 PolarHBondContact O-N 2.84Å; D102-L104 VanDerWaalsContact O-N 3.08Å; D102-C105 WeakPolarHBondContact O-CB 3.45Å; D102-C105 PolarHBondContact O-N 2.91Å; D102-R124 VanDerWaalsContact OD2-CG 3.3Å; D102-R124 WeakPolarHBondContact OD2-CG 3.45Å; D102-R124 PolarHBondContact OD2-N 3.31Å
103	L	87.9	Confident	80	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-54.8	-32.1	177.4	-66	180	0	0	0	112.8	A99 Q101 Y121 L123 T187 F189 P942 R944 A959	A99-L103 WeakPolarHBondContact O-CG 3.07Å; A99-L103 PolarHBondContact O-N 2.82Å; Q101-L103 VanDerWaalsContact C-N 3.32Å; Q101-L103 PolarHBondContact O-N 3.17Å; L103-Y121 WeakPolarHBondContact CD2-O 3.41Å; L103-L123 HydrophobicContact CD2-CD2 4.46Å; L103-T187 HydrophobicContact CD1-CG2 4.31Å; L103-F189 HydrophobicContact CD2-CE1 4.22Å; L103-P942 HydrophobicContact CB-CB 4.39Å; L103-P942 HydrophobicContact CD1-CB 4.4Å; L103-P942 HydrophobicContact CD1-CG 4.32Å; L103-R944 HydrophobicContact CB-CB 4.41Å; L103-R944 HydrophobicContact CD2-CB 4.44Å; L103-R944 PolarHBondContact O-NH1 3.29Å; L103-A959 HydrophobicContact CD1-CB 3.95Å; L103-A959 HydrophobicContact CD2-CB 3.87Å
104	L	85.7	Confident	81.6	Confident	62 Å²	62	44.3 Å²	44.3	33%	0.325	23%	0.225	S	C	.	.	H	α-helix	trans	-92.2	-14.1	-178.8	-61.3	176	0	0	0	113.5	Q101 D102 M106 R928 C930 P942	Q101-L104 PolarHBondContact O-N 3.36Å; D102-L104 PolarHBondContact O-N 2.84Å; D102-L104 VanDerWaalsContact O-N 3.08Å; L104-M106 PolarHBondContact O-N 3.27Å; L104-R928 VanDerWaalsContact C-NH1 3.27Å; L104-R928 PolarHBondContact O-NH1 3Å; L104-C930 WeakPolarHBondContact CD1-SG 3.49Å; L104-P942 HydrophobicContact CD1-CB 3.96Å; L104-P942 HydrophobicContact CD2-CB 3.79Å; L104-P942 HydrophobicContact CG-CB 3.71Å
105	C	84.8	Confident	83.1	Confident	20 Å²	20	40.9 Å²	40.9	14%	0.135	21%	0.205	C	C	.	.			trans	-66.7	120.1	-174.5	-175.4	0	0	0	0	112.1	Q101 D102 R928	Q101-C105 PolarHBondContact O-N 2.77Å; D102-C105 WeakPolarHBondContact O-CB 3.45Å; D102-C105 PolarHBondContact O-N 2.91Å; C105-R928 PolarHBondContact O-NH1 2.85Å; C105-R928 PolarHBondContact O-NH2 2.82Å
106	M	83.2	Confident	83.9	Confident	66 Å²	66	39.1 Å²	39.1	33%	0.325	20%	0.195	S	C	.	.			trans	-91.9	-6.6	-174.4	-62.2	-179.3	179.7	0	0	114.2	L104 N108 D109 N226 H286	L104-M106 PolarHBondContact O-N 3.27Å; M106-N108 PolarHBondContact O-N 2.84Å; M106-D109 VanDerWaalsContact C-OD1 3.3Å; M106-D109 WeakPolarHBondContact CA-OD1 3.38Å; M106-N226 HydrophobicContact CE-CB 3.85Å; M106-N226 WeakPolarHBondContact CE-ND2 3.34Å; M106-H286 PolarHBondContact SD-ND1 2.75Å; M106-H286 VanDerWaalsContact SD-ND1 3.43Å
107	H	79.4	Confident	84.5	Confident	104 Å²	104	37 Å²	37	48%	0.481	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-26	-168.6	-63.5	101.3	0	0	0	113.7	K51	K51-H107 HydrophobicContact CB-CB 4.28Å
108	N	79.8	Confident	84.8	Confident	17 Å²	17	37 Å²	37	9%	0.091	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.5	40.4	-171.9	-65.6	-38.2	0	0	0	111.9	E50 G52 Y54 M106 P111	E50-N108 PolarHBondContact O-ND2 2.97Å; E50-N108 VanDerWaalsContact O-ND2 3.13Å; E50-N108 PolarHBondContact O-OD1 3.22Å; G52-N108 PolarHBondContact N-OD1 2.74Å; Y54-N108 HydrophobicContact CD2-CB 3.35Å; Y54-N108 HydrophobicContact CE2-CB 3.62Å; Y54-N108 HydrophobicContact CG-CB 3.96Å; M106-N108 PolarHBondContact O-N 2.84Å; N108-P111 WeakPolarHBondContact O-CD 3.49Å
109	D	82.8	Confident	85.2	Confident	32 Å²	32	36.6 Å²	36.6	17%	0.171	18%	0.178	C	C	.	.			trans	-73.2	129.9	179.5	-69.7	20.6	0	0	0	109.8	M106 L926 R928	M106-D109 VanDerWaalsContact C-OD1 3.3Å; M106-D109 WeakPolarHBondContact CA-OD1 3.38Å; D109-L926 WeakPolarHBondContact OD2-CD2 3.39Å; D109-R928 IonicContact OD1-CZ 2.81Å; D109-R928 IonicContact OD1-NH1 3.22Å; D109-R928 IonicContact OD1-NH2 2.61Å; D109-R928 PolarHBondContact OD1-NH2 3.02Å; D109-R928 IonicContact OD2-CZ 2.81Å; D109-R928 IonicContact OD2-NH1 2.9Å; D109-R928 IonicContact OD2-NH2 2.66Å; D109-R928 PolarHBondContact OD2-NH2 3.11Å
110	F	88.3	Confident	85.5	Confident	8 Å²	8	36.7 Å²	36.7	4%	0.035	18%	0.177	C	C	.	.	S	Bend	trans	61.4	57.3	179.4	-43.3	-78.9	0	0	0	115.8	A228 R230 T283 E924 L926 F946	F110-A228 HydrophobicContact CE2-CB 3.98Å; F110-A228 HydrophobicContact CZ-CB 4.25Å; F110-R230 HydrophobicContact CD1-CB 4.04Å; F110-R230 HydrophobicContact CD2-CB 3.91Å; F110-R230 HydrophobicContact CE1-CB 4Å; F110-R230 HydrophobicContact CE2-CB 3.86Å; F110-R230 HydrophobicContact CG-CB 4.01Å; F110-R230 HydrophobicContact CG-CG 4.47Å; F110-R230 HydrophobicContact CZ-CB 3.91Å; F110-R230 PolarHBondContact O-NH1 3.18Å; F110-R230 VanDerWaalsContact O-NH1 3.13Å; F110-T283 HydrophobicContact CD2-CG2 4.27Å; F110-T283 HydrophobicContact CE2-CG2 4.29Å; F110-E924 HydrophobicContact CD1-CB 3.89Å; F110-E924 WeakPolarHBondContact CD1-OE2 3.5Å; F110-E924 HydrophobicContact CE1-CB 3.51Å; F110-L926 HydrophobicContact CZ-CB 4.22Å; F110-F946 AromaticContact CD1-CE2 3.86Å; F110-F946 HydrophobicContact CD1-CE2 3.86Å; F110-F946 HydrophobicContact CD1-CZ 4.45Å; F110-F946 HydrophobicContact CE1-CD2 4.47Å; F110-F946 AromaticContact CE1-CE2 3.64Å; F110-F946 HydrophobicContact CE1-CE2 3.64Å; F110-F946 HydrophobicContact CE1-CZ 4.47Å
111	P	85.7	Confident	85.7	Confident	6 Å²	6	36.6 Å²	36.6	4%	0.039	18%	0.177	C	C	.	.			trans	-64	130.1	177.4	27.8	-34.2	0	0	0	111.3	I55 N108 A114 R119	I55-P111 HydrophobicContact CG1-CB 4.46Å; N108-P111 WeakPolarHBondContact O-CD 3.49Å; P111-A114 HydrophobicContact CB-CB 3.89Å; P111-A114 HydrophobicContact CG-CB 3.74Å; P111-R119 HydrophobicContact CG-CB 4.43Å; P111-R119 PolarHBondContact O-NH1 3.11Å
112	P	76.1	Confident	85.8	Confident	19 Å²	19	33 Å²	33	12%	0.123	16%	0.161	C	C	.	.	S	Bend	trans	-66.4	-41	-177	19.4	-30.6	0	0	0	114	I55 E870	I55-P112 HydrophobicContact CD1-CG 4.07Å; I55-P112 HydrophobicContact CG1-CG 4.36Å; P112-E870 HydrophobicContact CB-CB 3.92Å; P112-E870 VanDerWaalsContact CB-OE2 3.23Å; P112-E870 WeakPolarHBondContact CB-OE2 3.31Å; P112-E870 WeakPolarHBondContact CD-OE2 3.25Å; P112-E870 HydrophobicContact CG-CB 3.91Å; P112-E870 WeakPolarHBondContact CG-OE2 3.18Å
113	R	76.7	Confident	85.9	Confident	175 Å²	175	32.4 Å²	32.4	66%	0.66	16%	0.158	S	C	*	.	S	Bend	trans	-122.5	86.3	-178.9	-82.9	-174.7	158.6	163.8	-4.7	109.2	P869	R113-P869 HydrophobicContact CG-CB 4.22Å; R113-P869 HydrophobicContact CG-CG 4.47Å
114	A	83.4	Confident	85.9	Confident	35 Å²	35	33.5 Å²	33.5	29%	0.289	16%	0.162	S	C	.	.	S	Bend	trans	-149.5	161.9	173.8	0	0	0	0	0	111.1	P111 V118	P111-A114 HydrophobicContact CB-CB 3.89Å; P111-A114 HydrophobicContact CG-CB 3.74Å; A114-V118 HydrophobicContact CB-CB 4.08Å; A114-V118 HydrophobicContact CB-CG1 4.03Å
115	H	88.6	Confident	86.2	Confident	56 Å²	56	33.5 Å²	33.5	26%	0.259	16%	0.161	S	C	.	.			trans	-57.7	146.8	171.2	-173.3	-94	0	0	0	110.5	L117 V118 R119 F126	H115-L117 VanDerWaalsContact C-N 3.29Å; H115-L117 PolarHBondContact ND1-N 2.94Å; H115-L117 PolarHBondContact O-N 3.2Å; H115-V118 HydrophobicContact CB-CG2 4.03Å; H115-V118 WeakPolarHBondContact O-CB 3.39Å; H115-V118 PolarHBondContact O-N 2.95Å; H115-R119 PolarHBondContact O-N 3.33Å; H115-F126 HydrophobicContact CB-CZ 4.1Å; H115-F126 AromaticContact CE1-CE2 3.92Å; H115-F126 AromaticContact CG-CZ 3.81Å; H115-F126 AromaticContact ND1-CE2 3.67Å; H115-F126 AromaticContact ND1-CZ 3.4Å; H115-F126 WeakPolarHBondContact ND1-CZ 3.46Å
116	C	88.3	Confident	86.6	Confident	15 Å²	15	32.5 Å²	32.5	10%	0.101	15%	0.154	C	C	.	.	H	α-helix	trans	-58.4	-37.9	-173.8	59.4	0	0	0	0	113.5	V118 R119 W120	C116-V118 VanDerWaalsContact C-N 3.34Å; C116-V118 PolarHBondContact O-N 2.88Å; C116-R119 WeakPolarHBondContact O-CB 3.42Å; C116-R119 PolarHBondContact O-N 3.43Å; C116-W120 HydrophobicContact CB-CD2 4.4Å; C116-W120 HydrophobicContact CB-CE3 4.45Å; C116-W120 HydrophobicContact CB-CH2 3.73Å; C116-W120 HydrophobicContact CB-CZ2 3.66Å; C116-W120 HydrophobicContact CB-CZ3 4.11Å; C116-W120 PolarHBondContact O-N 3.33Å
117	L	91.7	Very high	87.2	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-66	-33.7	175.8	-63.4	174.2	0	0	0	112.8	H115 W120 Y121 F126 V128 F165 Y176	H115-L117 VanDerWaalsContact C-N 3.29Å; H115-L117 PolarHBondContact ND1-N 2.94Å; H115-L117 PolarHBondContact O-N 3.2Å; L117-W120 HydrophobicContact CD2-CE3 4.03Å; L117-W120 HydrophobicContact CD2-CZ3 4.22Å; L117-W120 PolarHBondContact O-N 3.47Å; L117-Y121 HydrophobicContact CD2-CD2 4.04Å; L117-Y121 HydrophobicContact CD2-CE2 3.83Å; L117-Y121 WeakPolarHBondContact O-CB 3.48Å; L117-Y121 PolarHBondContact O-N 2.89Å; L117-F126 HydrophobicContact CB-CE2 4.27Å; L117-F126 HydrophobicContact CB-CZ 4.35Å; L117-F126 HydrophobicContact CD1-CD2 3.79Å; L117-F126 HydrophobicContact CD1-CE2 3.76Å; L117-V128 HydrophobicContact CD1-CG2 3.75Å; L117-F165 HydrophobicContact CD1-CB 4.13Å; L117-F165 HydrophobicContact CD1-CD1 4.16Å; L117-F165 HydrophobicContact CD1-CD2 3.72Å; L117-F165 HydrophobicContact CD1-CE2 4.13Å; L117-F165 HydrophobicContact CD1-CG 3.74Å; L117-F165 HydrophobicContact CD2-CD1 4.01Å; L117-F165 HydrophobicContact CD2-CE1 3.99Å; L117-F165 HydrophobicContact CD2-CG 4.43Å; L117-F165 HydrophobicContact CD2-CZ 4.4Å; L117-Y176 HydrophobicContact CD1-CD1 4.38Å; L117-Y176 HydrophobicContact CD1-CG 4.42Å; L117-Y176 HydrophobicContact CD2-CD2 3.85Å; L117-Y176 HydrophobicContact CD2-CE2 4.48Å; L117-Y176 HydrophobicContact CD2-CG 3.97Å; L117-Y176 HydrophobicContact CG-CD2 4.39Å
118	V	91.1	Very high	87.9	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.006	12%	0.118	C	C	.	.	H	α-helix	trans	-66.7	-43.9	173	-178.4	0	0	0	0	109.7	Y54 W59 A114 H115 C116 W120 G122 F126	Y54-V118 HydrophobicContact CD2-CG1 3.78Å; Y54-V118 HydrophobicContact CE2-CG1 4.16Å; Y54-V118 HydrophobicContact CG-CG1 4.16Å; W59-V118 HydrophobicContact CH2-CB 4.33Å; W59-V118 HydrophobicContact CH2-CG1 4.02Å; W59-V118 HydrophobicContact CH2-CG2 3.34Å; W59-V118 HydrophobicContact CZ2-CB 4.45Å; W59-V118 HydrophobicContact CZ2-CG1 3.87Å; W59-V118 HydrophobicContact CZ2-CG2 3.81Å; W59-V118 HydrophobicContact CZ3-CG2 3.92Å; A114-V118 HydrophobicContact CB-CB 4.08Å; A114-V118 HydrophobicContact CB-CG1 4.03Å; H115-V118 HydrophobicContact CB-CG2 4.03Å; H115-V118 WeakPolarHBondContact O-CB 3.39Å; H115-V118 PolarHBondContact O-N 2.95Å; C116-V118 VanDerWaalsContact C-N 3.34Å; C116-V118 PolarHBondContact O-N 2.88Å; V118-W120 VanDerWaalsContact C-N 3.35Å; V118-W120 PolarHBondContact O-N 3.46Å; V118-G122 WeakPolarHBondContact O-CA 3.48Å; V118-G122 PolarHBondContact O-N 3.16Å; V118-F126 HydrophobicContact CG2-CD1 4.48Å; V118-F126 HydrophobicContact CG2-CE1 3.53Å; V118-F126 HydrophobicContact CG2-CZ 4.15Å
119	R	89.3	Confident	88.5	Confident	48 Å²	48	24 Å²	24	18%	0.181	11%	0.114	C	C	.	.	H	α-helix	trans	-61.7	-41.4	176.7	-170.6	-178.2	-174.6	95.8	-6.1	112.2	P111 H115 C116 E924 F946	P111-R119 HydrophobicContact CG-CB 4.43Å; P111-R119 PolarHBondContact O-NH1 3.11Å; H115-R119 PolarHBondContact O-N 3.33Å; C116-R119 WeakPolarHBondContact O-CB 3.42Å; C116-R119 PolarHBondContact O-N 3.43Å; R119-E924 IonicContact CZ-OE1 2.72Å; R119-E924 IonicContact CZ-OE2 2.9Å; R119-E924 IonicContact NE-OE1 3.37Å; R119-E924 PolarHBondContact NE-OE1 3.11Å; R119-E924 IonicContact NE-OE2 3.01Å; R119-E924 IonicContact NH2-OE1 3.51Å; R119-E924 PolarHBondContact NH2-OE1 3.45Å; R119-E924 IonicContact NH2-OE2 3.79Å; R119-E924 PolarHBondContact NH2-OE2 3.21Å; R119-F946 HydrophobicContact CG-CZ 4.29Å
120	W	91.8	Very high	89	Confident	9 Å²	9	23.5 Å²	23.5	3%	0.034	11%	0.113	C	C	.	.	H	α-helix	trans	-79.8	-48.1	-175	-58.8	-17.9	0	0	0	112.5	C116 L117 V118 R174 Y176 I191 R944 F946 R955 A957	C116-W120 HydrophobicContact CB-CD2 4.4Å; C116-W120 HydrophobicContact CB-CE3 4.45Å; C116-W120 HydrophobicContact CB-CH2 3.73Å; C116-W120 HydrophobicContact CB-CZ2 3.66Å; C116-W120 HydrophobicContact CB-CZ3 4.11Å; C116-W120 PolarHBondContact O-N 3.33Å; L117-W120 HydrophobicContact CD2-CE3 4.03Å; L117-W120 HydrophobicContact CD2-CZ3 4.22Å; L117-W120 PolarHBondContact O-N 3.47Å; V118-W120 VanDerWaalsContact C-N 3.35Å; V118-W120 PolarHBondContact O-N 3.46Å; W120-R174 HydrophobicContact CH2-CB 4.04Å; W120-R174 VanDerWaalsContact CH2-O 3.29Å; W120-R174 WeakPolarHBondContact CH2-O 3.48Å; W120-Y176 AromaticContact CZ3-CD2 3.95Å; W120-Y176 HydrophobicContact CZ3-CD2 3.95Å; W120-Y176 HydrophobicContact CZ3-CE2 4.22Å; W120-I191 HydrophobicContact CE3-CD1 3.48Å; W120-I191 VanDerWaalsContact CE3-CD1 3.48Å; W120-I191 HydrophobicContact CH2-CD1 4.42Å; W120-I191 HydrophobicContact CZ3-CD1 3.35Å; W120-R944 PolarHBondContact O-NE 2.89Å; W120-R944 PolarHBondContact O-NH2 3.4Å; W120-F946 HydrophobicContact CB-CB 4.49Å; W120-F946 HydrophobicContact CB-CD1 4.08Å; W120-F946 HydrophobicContact CB-CG 4.43Å; W120-F946 AromaticContact CD1-CD1 3.28Å; W120-F946 AromaticContact CD1-CE1 3.16Å; W120-F946 AromaticContact CG-CD1 3.86Å; W120-F946 HydrophobicContact CG-CD1 3.86Å; W120-F946 HydrophobicContact CG-CE1 4.16Å; W120-F946 AromaticContact NE1-CE1 3.71Å; W120-F946 WeakPolarHBondContact O-CB 3.39Å; W120-R955 VanDerWaalsContact CZ2-NH1 3.33Å; W120-A957 HydrophobicContact CB-CB 3.84Å; W120-A957 HydrophobicContact CD2-CB 4.36Å; W120-A957 HydrophobicContact CE3-CB 4.48Å; W120-A957 HydrophobicContact CG-CB 4.12Å
121	Y	91.7	Very high	89.1	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-103.2	-20.1	-172.4	-60	-60	0	0	0	114	L103 L117 F165 F189 E190 I191 R944 A957 G958 A959	L103-Y121 WeakPolarHBondContact CD2-O 3.41Å; L117-Y121 HydrophobicContact CD2-CD2 4.04Å; L117-Y121 HydrophobicContact CD2-CE2 3.83Å; L117-Y121 WeakPolarHBondContact O-CB 3.48Å; L117-Y121 PolarHBondContact O-N 2.89Å; Y121-F165 HydrophobicContact CD2-CE1 4Å; Y121-F165 AromaticContact CD2-CZ 3.95Å; Y121-F165 HydrophobicContact CD2-CZ 3.95Å; Y121-F165 AromaticContact CE2-CE1 3.71Å; Y121-F165 HydrophobicContact CE2-CE1 3.71Å; Y121-F165 HydrophobicContact CE2-CZ 4.15Å; Y121-F189 AromaticContact CD1-CD1 3.66Å; Y121-F189 HydrophobicContact CD1-CD1 3.66Å; Y121-F189 AromaticContact CD1-CE1 3.99Å; Y121-F189 HydrophobicContact CD1-CE1 3.99Å; Y121-F189 HydrophobicContact CD2-CD1 4Å; Y121-F189 HydrophobicContact CD2-CE1 4.44Å; Y121-F189 AromaticContact CE1-CD1 3.63Å; Y121-F189 HydrophobicContact CE1-CD1 3.63Å; Y121-F189 HydrophobicContact CE1-CE1 4.41Å; Y121-F189 HydrophobicContact CE2-CB 4.37Å; Y121-F189 AromaticContact CE2-CD1 3.97Å; Y121-F189 HydrophobicContact CE2-CD1 3.97Å; Y121-F189 AromaticContact CG-CD1 3.84Å; Y121-F189 HydrophobicContact CG-CD1 3.84Å; Y121-F189 AromaticContact CG-CE1 4Å; Y121-F189 HydrophobicContact CG-CE1 4Å; Y121-F189 AromaticContact CZ-CD1 3.77Å; Y121-E190 PolarHBondContact OH-O 2.85Å; Y121-I191 HydrophobicContact CE2-CD1 4.45Å; Y121-I191 VanDerWaalsContact OH-CG1 3.29Å; Y121-I191 WeakPolarHBondContact OH-CG1 3.38Å; Y121-R944 PolarHBondContact O-NE 3.34Å; Y121-A957 HydrophobicContact CE1-CB 4.03Å; Y121-G958 WeakPolarHBondContact CE1-O 3.42Å; Y121-G958 PolarHBondContact OH-O 3.4Å; Y121-A959 HydrophobicContact CD1-CB 3.88Å; Y121-A959 HydrophobicContact CE1-CB 4Å
122	G	88.1	Confident	89	Confident	6 Å²	6	23 Å²	23	6%	0.062	11%	0.11	C	C	.	.			trans	80.4	20.2	179.7	0	0	0	0	0	114.6	Y54 V118	Y54-G122 WeakPolarHBondContact CE2-O 3.44Å; Y54-G122 PolarHBondContact OH-O 3.38Å; V118-G122 WeakPolarHBondContact O-CA 3.48Å; V118-G122 PolarHBondContact O-N 3.16Å
123	L	89.9	Confident	89	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.135	C	C	.	.			trans	-78	142	-172.9	-57	172.9	0	0	0	112.8	A99 L103 F126 P163 F165 F189	A99-L123 HydrophobicContact CB-CD2 3.85Å; L103-L123 HydrophobicContact CD2-CD2 4.46Å; L123-F126 HydrophobicContact CB-CD1 4.24Å; L123-F126 HydrophobicContact CD1-CB 4.3Å; L123-P163 HydrophobicContact CD1-CB 4.17Å; L123-P163 HydrophobicContact CD1-CG 4.15Å; L123-P163 HydrophobicContact CD2-CG 4.24Å; L123-F165 HydrophobicContact CD1-CE2 3.68Å; L123-F165 HydrophobicContact CD1-CZ 3.65Å; L123-F189 HydrophobicContact CD1-CE1 4.45Å
124	R	88.4	Confident	89	Confident	24 Å²	24	25.4 Å²	25.4	9%	0.091	15%	0.146	C	C	.	.	S	Bend	trans	-87.3	-27.5	174	-62.1	174.5	94.4	169.7	10.7	114	T47 Y54 W59 F79 L80 E82 D102	T47-R124 PolarHBondContact O-NH1 3.06Å; Y54-R124 HydrophobicContact CE1-CG 3.68Å; Y54-R124 WeakPolarHBondContact OH-CG 3.29Å; W59-R124 WeakPolarHBondContact CZ3-O 3.33Å; F79-R124 WeakPolarHBondContact CA-O 3.33Å; L80-R124 PolarHBondContact N-O 3.22Å; E82-R124 IonicContact OE1-CZ 2.74Å; E82-R124 IonicContact OE1-NE 3.94Å; E82-R124 PolarHBondContact OE1-NE 3.08Å; E82-R124 IonicContact OE1-NH2 3.97Å; E82-R124 PolarHBondContact OE1-NH2 3.22Å; E82-R124 IonicContact OE2-CZ 2.85Å; E82-R124 IonicContact OE2-NH2 3.18Å; E82-R124 PolarHBondContact OE2-NH2 2.7Å; D102-R124 VanDerWaalsContact OD2-CG 3.3Å; D102-R124 WeakPolarHBondContact OD2-CG 3.45Å; D102-R124 PolarHBondContact OD2-N 3.31Å
125	E	90.9	Very high	88.7	Confident	62 Å²	62	25.5 Å²	25.5	29%	0.29	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	133.1	-174.7	-177.5	176.4	-156.1	0	0	109.6	L39 H77 H78 F79 V162	L39-E125 WeakPolarHBondContact CD2-OE1 3.37Å; H77-E125 IonicContact CD2-OE1 3.17Å; H77-E125 IonicContact CE1-OE1 3.99Å; H77-E125 PolarHBondContact CE1-OE1 2.83Å; H77-E125 WeakPolarHBondContact NE2-CG 3.31Å; H77-E125 IonicContact NE2-OE1 3.33Å; H77-E125 PolarHBondContact NE2-OE1 2.89Å; H78-E125 WeakPolarHBondContact O-CA 3.42Å; F79-E125 HydrophobicContact CB-CB 4.28Å; F79-E125 HydrophobicContact CB-CG 3.95Å; E125-V162 HydrophobicContact CG-CG1 3.85Å; E125-V162 HydrophobicContact CG-CG2 4.28Å
126	F	93.8	Very high	88.3	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	159.3	177	59.1	-83.6	0	0	0	112	W59 H78 H115 L117 V118 L123 V128 P163 F165	W59-F126 HydrophobicContact CZ3-CE1 4.14Å; H78-F126 HydrophobicContact CB-CD1 4.36Å; H78-F126 HydrophobicContact CB-CD2 4.29Å; H78-F126 HydrophobicContact CB-CE1 3.84Å; H78-F126 HydrophobicContact CB-CE2 3.77Å; H78-F126 HydrophobicContact CB-CZ 3.51Å; H78-F126 AromaticContact CD2-CE2 3.51Å; H78-F126 AromaticContact CG-CE2 3.73Å; H78-F126 AromaticContact CG-CZ 3.77Å; H78-F126 PolarHBondContact N-O 3.06Å; H78-F126 PolarHBondContact O-N 3.46Å; H115-F126 HydrophobicContact CB-CZ 4.1Å; H115-F126 AromaticContact CE1-CE2 3.92Å; H115-F126 AromaticContact CG-CZ 3.81Å; H115-F126 AromaticContact ND1-CE2 3.67Å; H115-F126 AromaticContact ND1-CZ 3.4Å; H115-F126 WeakPolarHBondContact ND1-CZ 3.46Å; L117-F126 HydrophobicContact CB-CE2 4.27Å; L117-F126 HydrophobicContact CB-CZ 4.35Å; L117-F126 HydrophobicContact CD1-CD2 3.79Å; L117-F126 HydrophobicContact CD1-CE2 3.76Å; V118-F126 HydrophobicContact CG2-CD1 4.48Å; V118-F126 HydrophobicContact CG2-CE1 3.53Å; V118-F126 HydrophobicContact CG2-CZ 4.15Å; L123-F126 HydrophobicContact CB-CD1 4.24Å; L123-F126 HydrophobicContact CD1-CB 4.3Å; F126-V128 HydrophobicContact CD2-CG2 3.58Å; F126-V128 HydrophobicContact CE2-CG2 3.58Å; F126-P163 WeakPolarHBondContact CA-O 3.4Å; F126-P163 HydrophobicContact CB-CB 4.46Å; F126-F165 HydrophobicContact CB-CD2 4.1Å; F126-F165 HydrophobicContact CB-CE2 3.84Å; F126-F165 HydrophobicContact CD2-CD2 4.29Å; F126-F165 HydrophobicContact CG-CE2 4.38Å
127	V	94.9	Very high	88	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	137	175.4	178.8	0	0	0	0	109.9	W37 L39 I75 T76 H77 V162 P163 M164 F165	W37-V127 HydrophobicContact CZ3-CG1 4.33Å; L39-V127 HydrophobicContact CD1-CG2 3.91Å; I75-V127 HydrophobicContact CD1-CG1 3.81Å; I75-V127 HydrophobicContact CG1-CG1 3.5Å; T76-V127 CarbonylContact O-C 3.6Å; T76-V127 VanDerWaalsContact O-CA 3.31Å; T76-V127 WeakPolarHBondContact O-CA 3.47Å; H77-V127 HydrophobicContact CB-CG2 4.29Å; V127-V162 HydrophobicContact CG2-CG1 4.17Å; V127-P163 PolarHBondContact N-O 2.79Å; V127-M164 HydrophobicContact CB-CB 4.48Å; V127-M164 HydrophobicContact CB-CG 4.18Å; V127-M164 HydrophobicContact CG1-CE 4.39Å; V127-M164 HydrophobicContact CG1-CG 4.18Å; V127-M164 CarbonylContact O-C 3.52Å; V127-M164 WeakPolarHBondContact O-CA 3.34Å; V127-F165 PolarHBondContact O-N 3.07Å
128	V	94.8	Very high	87.7	Confident	5 Å²	5	30.7 Å²	30.7	3%	0.03	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	126.6	176.2	-175	0	0	0	0	110.3	I75 T76 L117 F126 F165 Y176	I75-V128 WeakPolarHBondContact CA-O 3.44Å; T76-V128 PolarHBondContact N-O 3.24Å; T76-V128 PolarHBondContact O-N 2.87Å; T76-V128 PolarHBondContact OG1-O 3.24Å; L117-V128 HydrophobicContact CD1-CG2 3.75Å; F126-V128 HydrophobicContact CD2-CG2 3.58Å; F126-V128 HydrophobicContact CE2-CG2 3.58Å; V128-F165 CarbonylContact C-O 3.6Å; V128-F165 WeakPolarHBondContact CA-O 3.37Å; V128-F165 HydrophobicContact CG2-CB 4.39Å; V128-Y176 HydrophobicContact CG1-CD1 4.07Å; V128-Y176 HydrophobicContact CG1-CE1 3.72Å
129	I	93.5	Very high	87.5	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	114.8	168.4	-60	177.1	0	0	0	107.9	I66 F73 Y74 I75 V151 M164 F165 Q167	I66-I129 HydrophobicContact CD1-CG2 4.27Å; F73-I129 HydrophobicContact CB-CG2 4.1Å; F73-I129 HydrophobicContact CD1-CG2 3.94Å; F73-I129 HydrophobicContact CG-CG2 4.16Å; Y74-I129 CarbonylContact O-C 3.57Å; Y74-I129 WeakPolarHBondContact O-CA 3.32Å; I75-I129 HydrophobicContact CB-CG1 4.37Å; I75-I129 HydrophobicContact CD1-CD1 4.4Å; I75-I129 HydrophobicContact CD1-CG1 4.17Å; I75-I129 HydrophobicContact CG1-CG1 4.01Å; I129-V151 HydrophobicContact CD1-CG2 3.98Å; I129-M164 HydrophobicContact CD1-CG 4.43Å; I129-M164 HydrophobicContact CD1-SD 3.71Å; I129-M164 HydrophobicContact CG1-SD 4.39Å; I129-F165 PolarHBondContact N-O 3.44Å; I129-Q167 PolarHBondContact O-N 3.02Å
130	S	91.9	Very high	87.4	Confident	22 Å²	22	34.9 Å²	34.9	15%	0.154	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	146.5	-179.1	63.6	0	0	0	0	112	F73 Y74 Q167	F73-S130 CarbonylContact C-O 3.56Å; F73-S130 WeakPolarHBondContact CA-O 3.45Å; Y74-S130 PolarHBondContact N-O 2.95Å; Y74-S130 PolarHBondContact O-N 3.45Å; S130-Q167 VanDerWaalsContact CB-OE1 3.3Å
131	P	90.1	Very high	87.2	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.013	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	146.9	177.6	26.5	-31.7	0	0	0	111.4	F71 F73 C135 K171	F71-P131 HydrophobicContact CE1-CB 3.82Å; F71-P131 HydrophobicContact CZ-CB 3.9Å; F73-P131 HydrophobicContact CE1-CB 4.4Å; P131-C135 HydrophobicContact CB-CB 4.43Å; P131-K171 VanDerWaalsContact O-CE 3.27Å; P131-K171 WeakPolarHBondContact O-CE 3.3Å; P131-K171 PolarHBondContact O-NZ 3.38Å
132	G	83.3	Confident	87	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.01	26%	0.26	C	S	.	.			trans	-52	158.8	179.1	0	0	0	0	0	114.6	K72 N134 C135 K171	K72-G132 PolarHBondContact O-N 3.24Å; G132-N134 PolarHBondContact O-N 3.45Å; G132-C135 PolarHBondContact O-N 3.24Å; G132-C135 VanDerWaalsContact O-N 3.14Å; G132-K171 PolarHBondContact O-NZ 2.88Å
133	A	77.8	Confident	86.9	Confident	79 Å²	79	50.8 Å²	50.8	65%	0.653	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-34.9	-178.1	0	0	0	0	0	112.9
134	N	75.3	Confident	86.8	Confident	166 Å²	166	51.4 Å²	51.4	89%	0.888	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	7.6	-177.9	-60.1	-15.9	0	0	0	113.4	G132	G132-N134 PolarHBondContact O-N 3.45Å
135	C	77.3	Confident	86.8	Confident	37 Å²	37	54.1 Å²	54.1	25%	0.25	30%	0.302	C	S	.	.	S	Bend	trans	-99	147.3	-173.8	-62.8	0	0	0	0	111.9	F71 P131 G132	F71-C135 HydrophobicContact CD2-CB 4.42Å; F71-C135 HydrophobicContact CE1-CB 3.89Å; F71-C135 HydrophobicContact CE2-CB 3.72Å; F71-C135 HydrophobicContact CZ-CB 3.44Å; F71-C135 VanDerWaalsContact CZ-CB 3.44Å; P131-C135 HydrophobicContact CB-CB 4.43Å; G132-C135 PolarHBondContact O-N 3.24Å; G132-C135 VanDerWaalsContact O-N 3.14Å
136	E	81.3	Confident	86.8	Confident	146 Å²	146	54.4 Å²	54.4	68%	0.682	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-64.3	148.7	178.3	-165.3	-177.2	177	0	0	111.7	F71	F71-E136 VanDerWaalsContact CZ-O 3.27Å; F71-E136 WeakPolarHBondContact CZ-O 3.46Å
137	A	82.3	Confident	86.6	Confident	27 Å²	27	54.9 Å²	54.9	22%	0.223	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-63.2	146.2	174.6	0	0	0	0	0	112.4	I139 Q169 Q170	A137-I139 HydrophobicContact CB-CD1 4.32Å; A137-I139 HydrophobicContact CB-CG1 4.12Å; A137-I139 PolarHBondContact O-N 3.37Å; A137-Q169 WeakPolarHBondContact CB-O 3.41Å; A137-Q170 HydrophobicContact CB-CG 4.43Å
138	I	84.5	Confident	86.4	Confident	8 Å²	8	56.9 Å²	56.9	4%	0.041	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-83.8	97.2	178.1	-51.9	164.4	0	0	0	108.7	F73 K143 L147 V166 I168 Q169	F73-I138 HydrophobicContact CE1-CD1 3.61Å; F73-I138 HydrophobicContact CE1-CG1 4.45Å; F73-I138 HydrophobicContact CZ-CD1 4.11Å; I138-K143 HydrophobicContact CG2-CB 3.92Å; I138-L147 HydrophobicContact CD1-CD1 3.4Å; I138-L147 HydrophobicContact CG1-CD1 4.36Å; I138-L147 HydrophobicContact CG2-CD1 4.26Å; I138-V166 HydrophobicContact CD1-CG1 4.43Å; I138-I168 WeakPolarHBondContact O-CG2 3.37Å; I138-Q169 WeakPolarHBondContact O-CA 3.21Å; I138-Q169 PolarHBondContact O-N 3.19Å
139	I	86.2	Confident	86.2	Confident	84 Å²	84	59.4 Å²	59.4	43%	0.431	34%	0.336	S	S	.	.			trans	-107	-28.2	-176	-55	168	0	0	0	111.9	A137 E141	A137-I139 HydrophobicContact CB-CD1 4.32Å; A137-I139 HydrophobicContact CB-CG1 4.12Å; A137-I139 PolarHBondContact O-N 3.37Å; I139-E141 PolarHBondContact O-N 3.48Å
140	S	87.6	Confident	86.2	Confident	53 Å²	53	59.5 Å²	59.5	37%	0.371	34%	0.337	S	S	.	.			trans	-72.5	124.2	-177.3	-172.5	0	0	0	0	111.7	S142 K143 C144	S140-S142 VanDerWaalsContact C-N 3.25Å; S140-S142 PolarHBondContact O-N 3.3Å; S140-S142 PolarHBondContact OG-OG 2.81Å; S140-K143 WeakPolarHBondContact O-CB 3.4Å; S140-K143 PolarHBondContact O-N 2.93Å; S140-C144 PolarHBondContact O-N 3.49Å; S140-C144 PolarHBondContact O-SG 2.65Å
141	E	87.3	Confident	86.2	Confident	149 Å²	149	58.5 Å²	58.5	70%	0.696	33%	0.33	S	S	*	.	H	α-helix	trans	-54.4	-40.3	178.1	-174	179.8	175.5	0	0	112.4	I139 K143 C144 N145	I139-E141 PolarHBondContact O-N 3.48Å; E141-K143 VanDerWaalsContact C-N 3.32Å; E141-K143 PolarHBondContact O-N 2.94Å; E141-C144 WeakPolarHBondContact O-CB 3.23Å; E141-C144 PolarHBondContact O-N 2.83Å; E141-N145 WeakPolarHBondContact O-CB 3.46Å; E141-N145 PolarHBondContact O-N 2.91Å; E141-N145 PolarHBondContact O-ND2 3.46Å
142	S	87.3	Confident	86.3	Confident	80 Å²	80	59.6 Å²	59.6	56%	0.559	34%	0.337	S	S	*	.	H	α-helix	trans	-60.1	-38.7	175.3	56.5	0	0	0	0	113.4	S140 L146	S140-S142 VanDerWaalsContact C-N 3.25Å; S140-S142 PolarHBondContact O-N 3.3Å; S140-S142 PolarHBondContact OG-OG 2.81Å; S142-L146 WeakPolarHBondContact O-CB 3.42Å; S142-L146 PolarHBondContact O-N 3.25Å
143	K	86.6	Confident	86.6	Confident	120 Å²	120	63.3 Å²	63.3	52%	0.522	36%	0.355	S	S	.	.	H	α-helix	trans	-72.5	-38.8	177.5	-66.3	-177	179.8	-177.3	0	110.9	I138 S140 E141 L146 L147	I138-K143 HydrophobicContact CG2-CB 3.92Å; S140-K143 WeakPolarHBondContact O-CB 3.4Å; S140-K143 PolarHBondContact O-N 2.93Å; E141-K143 VanDerWaalsContact C-N 3.32Å; E141-K143 PolarHBondContact O-N 2.94Å; K143-L146 PolarHBondContact O-N 2.83Å; K143-L147 WeakPolarHBondContact O-CG 3.45Å; K143-L147 PolarHBondContact O-N 3.27Å
144	C	87	Confident	87.3	Confident	12 Å²	12	59.6 Å²	59.6	8%	0.081	32%	0.324	C	S	.	.	H	α-helix	trans	-59.9	-50.2	174.2	-59.5	0	0	0	0	111.1	S140 E141 L146 L147 L148 I168	S140-C144 PolarHBondContact O-N 3.49Å; S140-C144 PolarHBondContact O-SG 2.65Å; E141-C144 WeakPolarHBondContact O-CB 3.23Å; E141-C144 PolarHBondContact O-N 2.83Å; C144-L146 VanDerWaalsContact C-N 3.35Å; C144-L146 PolarHBondContact O-N 3.31Å; C144-L147 PolarHBondContact O-N 3.16Å; C144-L148 WeakPolarHBondContact O-CB 3.3Å; C144-L148 WeakPolarHBondContact O-CG 3.35Å; C144-L148 PolarHBondContact O-N 3.38Å; C144-I168 HydrophobicContact CB-CD1 4.05Å; C144-I168 HydrophobicContact CB-CG2 4.44Å; C144-I168 WeakPolarHBondContact SG-CG2 3.27Å
145	N	89.6	Confident	88	Confident	82 Å²	82	51.7 Å²	51.7	44%	0.439	28%	0.282	S	S	.	.	H	α-helix	trans	-63.9	-40.2	179.6	-69.2	-17.6	0	0	0	111.4	E141 L147 L148 S149	E141-N145 WeakPolarHBondContact O-CB 3.46Å; E141-N145 PolarHBondContact O-N 2.91Å; E141-N145 PolarHBondContact O-ND2 3.46Å; N145-L147 PolarHBondContact O-N 2.79Å; N145-L148 PolarHBondContact O-N 2.84Å; N145-S149 WeakPolarHBondContact O-CB 3.31Å; N145-S149 PolarHBondContact O-N 2.81Å; N145-S149 PolarHBondContact O-OG 2.82Å
146	L	89.9	Confident	88.5	Confident	68 Å²	68	53.7 Å²	53.7	36%	0.356	30%	0.296	S	S	.	.	H	α-helix	trans	-59.3	-46	175	-175.5	71.9	0	0	0	112.2	W23 F68 S142 K143 C144 S149 S150	W23-L146 HydrophobicContact CG-CD1 4.26Å; F68-L146 HydrophobicContact CE1-CD2 4.4Å; F68-L146 HydrophobicContact CE2-CD2 4.27Å; F68-L146 HydrophobicContact CZ-CD2 3.76Å; S142-L146 WeakPolarHBondContact O-CB 3.42Å; S142-L146 PolarHBondContact O-N 3.25Å; K143-L146 PolarHBondContact O-N 2.83Å; C144-L146 VanDerWaalsContact C-N 3.35Å; C144-L146 PolarHBondContact O-N 3.31Å; L146-S149 PolarHBondContact O-N 3.36Å; L146-S150 PolarHBondContact O-N 2.96Å; L146-S150 PolarHBondContact O-OG 2.82Å
147	L	89.6	Confident	88.9	Confident	10 Å²	10	51.4 Å²	51.4	5%	0.052	29%	0.289	C	S	.	.	H	α-helix	trans	-67	-42.9	178.3	-71.4	169	0	0	0	111.7	F26 F73 I138 K143 C144 N145 S149 S150 V151 V166	F26-L147 HydrophobicContact CE1-CD2 3.96Å; F26-L147 HydrophobicContact CZ-CD2 4.06Å; F73-L147 HydrophobicContact CE1-CD1 4.22Å; F73-L147 HydrophobicContact CE2-CD2 4.12Å; F73-L147 HydrophobicContact CZ-CD1 3.89Å; F73-L147 HydrophobicContact CZ-CD2 3.98Å; I138-L147 HydrophobicContact CD1-CD1 3.4Å; I138-L147 HydrophobicContact CG1-CD1 4.36Å; I138-L147 HydrophobicContact CG2-CD1 4.26Å; K143-L147 WeakPolarHBondContact O-CG 3.45Å; K143-L147 PolarHBondContact O-N 3.27Å; C144-L147 PolarHBondContact O-N 3.16Å; N145-L147 PolarHBondContact O-N 2.79Å; L147-S149 VanDerWaalsContact C-N 3.34Å; L147-S149 PolarHBondContact O-N 3.02Å; L147-S150 VanDerWaalsContact O-CB 3.29Å; L147-S150 WeakPolarHBondContact O-CB 3.39Å; L147-S150 PolarHBondContact O-N 2.82Å; L147-S150 VanDerWaalsContact O-N 3.12Å; L147-V151 WeakPolarHBondContact O-CG2 3.4Å; L147-V151 PolarHBondContact O-N 3.12Å; L147-V166 HydrophobicContact CB-CG1 4.11Å; L147-V166 HydrophobicContact CB-CG2 4.39Å; L147-V166 HydrophobicContact CD1-CG1 3.98Å
148	L	90.8	Very high	89.1	Confident	42 Å²	42	51.2 Å²	51.2	22%	0.22	29%	0.286	C	S	.	.	H	α-helix	trans	-62.5	-40.3	175.3	-72.9	171	0	0	0	112	C144 N145 S150 V151 S152 V166 A177	C144-L148 WeakPolarHBondContact O-CB 3.3Å; C144-L148 WeakPolarHBondContact O-CG 3.35Å; C144-L148 PolarHBondContact O-N 3.38Å; N145-L148 PolarHBondContact O-N 2.84Å; L148-S150 VanDerWaalsContact C-N 3.32Å; L148-S150 PolarHBondContact O-N 2.73Å; L148-V151 PolarHBondContact O-N 3.14Å; L148-S152 WeakPolarHBondContact O-CB 3.14Å; L148-S152 PolarHBondContact O-N 2.82Å; L148-V166 HydrophobicContact CD2-CG2 4.34Å; L148-A177 HydrophobicContact CD1-CB 3.87Å; L148-A177 HydrophobicContact CD2-CB 3.81Å; L148-A177 HydrophobicContact CG-CB 4.37Å
149	S	91.8	Very high	89.1	Confident	59 Å²	59	52.9 Å²	52.9	41%	0.413	31%	0.305	S	S	.	.	H	α-helix	trans	-62.8	-39.2	172.2	-61.2	0	0	0	0	111.8	N145 L146 L147 S152 M153	N145-S149 WeakPolarHBondContact O-CB 3.31Å; N145-S149 PolarHBondContact O-N 2.81Å; N145-S149 PolarHBondContact O-OG 2.82Å; L146-S149 PolarHBondContact O-N 3.36Å; L147-S149 VanDerWaalsContact C-N 3.34Å; L147-S149 PolarHBondContact O-N 3.02Å; S149-S152 PolarHBondContact O-N 3Å; S149-M153 WeakPolarHBondContact O-CG 3.36Å; S149-M153 PolarHBondContact O-N 3.18Å
150	S	92.1	Very high	89.1	Confident	2 Å²	2	49 Å²	49	1%	0.014	29%	0.285	C	S	.	.	H	α-helix	trans	-61.4	-45	175.4	-48.8	0	0	0	0	111.3	W23 L146 L147 L148 M153 S154	W23-S150 VanDerWaalsContact CD1-OG 3.27Å; W23-S150 PolarHBondContact NE1-OG 2.76Å; L146-S150 PolarHBondContact O-N 2.96Å; L146-S150 PolarHBondContact O-OG 2.82Å; L147-S150 VanDerWaalsContact O-CB 3.29Å; L147-S150 WeakPolarHBondContact O-CB 3.39Å; L147-S150 PolarHBondContact O-N 2.82Å; L147-S150 VanDerWaalsContact O-N 3.12Å; L148-S150 VanDerWaalsContact C-N 3.32Å; L148-S150 PolarHBondContact O-N 2.73Å; S150-M153 PolarHBondContact O-N 2.9Å; S150-S154 WeakPolarHBondContact O-CB 3.42Å; S150-S154 PolarHBondContact O-N 3.33Å; S150-S154 PolarHBondContact O-OG 3.13Å
151	V	92.1	Very high	89.2	Confident	2 Å²	2	49 Å²	49	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-61.4	-50.6	175.3	168.8	0	0	0	0	110.8	I129 L147 L148 M153 S154 L155 M164 V166	I129-V151 HydrophobicContact CD1-CG2 3.98Å; L147-V151 WeakPolarHBondContact O-CG2 3.4Å; L147-V151 PolarHBondContact O-N 3.12Å; L148-V151 PolarHBondContact O-N 3.14Å; V151-M153 VanDerWaalsContact C-N 3.29Å; V151-M153 PolarHBondContact O-N 2.85Å; V151-S154 WeakPolarHBondContact CA-OG 3.39Å; V151-S154 PolarHBondContact O-N 3.3Å; V151-S154 VanDerWaalsContact O-N 3.15Å; V151-S154 PolarHBondContact O-OG 3.15Å; V151-L155 HydrophobicContact CG1-CD1 3.85Å; V151-L155 HydrophobicContact CG1-CG 4.3Å; V151-L155 WeakPolarHBondContact O-CG 3.48Å; V151-L155 PolarHBondContact O-N 3.02Å; V151-M164 HydrophobicContact CB-SD 4.06Å; V151-M164 HydrophobicContact CG1-CB 3.69Å; V151-M164 HydrophobicContact CG1-CG 3.78Å; V151-M164 HydrophobicContact CG1-SD 3.61Å; V151-M164 HydrophobicContact CG2-CG 4.17Å; V151-M164 HydrophobicContact CG2-SD 3.58Å; V151-M164 VanDerWaalsContact CG2-SD 3.58Å; V151-V166 HydrophobicContact CG2-CG2 3.63Å
152	S	91.7	Very high	89.3	Confident	24 Å²	24	42.5 Å²	42.5	17%	0.168	25%	0.25	C	S	.	.	H	α-helix	trans	-57.5	-41	-179.8	-160.6	0	0	0	0	112.3	L148 S149 S156 E179 Q181	L148-S152 WeakPolarHBondContact O-CB 3.14Å; L148-S152 PolarHBondContact O-N 2.82Å; S149-S152 PolarHBondContact O-N 3Å; S152-S156 WeakPolarHBondContact O-CB 3.5Å; S152-S156 PolarHBondContact O-N 3.06Å; S152-S156 VanDerWaalsContact O-N 3.09Å; S152-E179 WeakPolarHBondContact CB-OE2 3.37Å; S152-E179 VanDerWaalsContact OG-CD 3.3Å; S152-E179 PolarHBondContact OG-OE1 2.93Å; S152-E179 VanDerWaalsContact OG-OE1 3.1Å; S152-E179 PolarHBondContact OG-OE2 2.85Å; S152-Q181 PolarHBondContact O-NE2 3.2Å; S152-Q181 VanDerWaalsContact O-NE2 3.08Å; S152-Q181 PolarHBondContact OG-NE2 2.8Å
153	M	91.3	Very high	89.6	Confident	80 Å²	80	38.9 Å²	38.9	39%	0.394	22%	0.224	S	C	.	.	H	α-helix	trans	-68.9	-45.7	175.3	-72	-168.2	73.3	0	0	112.3	W23 V27 S149 S150 V151 L155 S156 N157	W23-M153 HydrophobicContact CH2-CE 4.36Å; W23-M153 HydrophobicContact CH2-SD 3.22Å; W23-M153 WeakPolarHBondContact CH2-SD 3.38Å; W23-M153 HydrophobicContact CZ2-SD 3.47Å; W23-M153 WeakPolarHBondContact CZ2-SD 3.43Å; W23-M153 HydrophobicContact CZ3-SD 4.22Å; V27-M153 HydrophobicContact CG1-CB 4.27Å; S149-M153 WeakPolarHBondContact O-CG 3.36Å; S149-M153 PolarHBondContact O-N 3.18Å; S150-M153 PolarHBondContact O-N 2.9Å; V151-M153 VanDerWaalsContact C-N 3.29Å; V151-M153 PolarHBondContact O-N 2.85Å; M153-L155 VanDerWaalsContact C-N 3.31Å; M153-L155 PolarHBondContact O-N 2.89Å; M153-S156 PolarHBondContact O-N 2.82Å; M153-N157 WeakPolarHBondContact O-CB 3.16Å; M153-N157 PolarHBondContact O-N 2.86Å
154	S	91.1	Very high	90	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.9	-38.6	179.1	67.2	0	0	0	0	112.5	S150 V151 S158	S150-S154 WeakPolarHBondContact O-CB 3.42Å; S150-S154 PolarHBondContact O-N 3.33Å; S150-S154 PolarHBondContact O-OG 3.13Å; V151-S154 WeakPolarHBondContact CA-OG 3.39Å; V151-S154 PolarHBondContact O-N 3.3Å; V151-S154 VanDerWaalsContact O-N 3.15Å; V151-S154 PolarHBondContact O-OG 3.15Å; S154-S158 VanDerWaalsContact O-CB 3.22Å; S154-S158 WeakPolarHBondContact O-CB 3.32Å; S154-S158 PolarHBondContact O-N 2.91Å; S154-S158 PolarHBondContact O-OG 2.82Å
155	L	90	Very high	90.4	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-65.5	-45.9	174.6	-70.8	173.6	0	0	0	111.1	V151 M153 N157 S158 G159 C160 M164 E179 Q181	V151-L155 HydrophobicContact CG1-CD1 3.85Å; V151-L155 HydrophobicContact CG1-CG 4.3Å; V151-L155 WeakPolarHBondContact O-CG 3.48Å; V151-L155 PolarHBondContact O-N 3.02Å; M153-L155 VanDerWaalsContact C-N 3.31Å; M153-L155 PolarHBondContact O-N 2.89Å; L155-N157 PolarHBondContact O-N 3.31Å; L155-S158 PolarHBondContact O-OG 2.8Å; L155-G159 WeakPolarHBondContact O-CA 3.47Å; L155-G159 PolarHBondContact O-N 2.82Å; L155-C160 HydrophobicContact CD2-CB 4.11Å; L155-M164 HydrophobicContact CD1-CB 4.32Å; L155-M164 HydrophobicContact CD2-CB 4.38Å; L155-M164 HydrophobicContact CD2-CE 4.26Å; L155-E179 HydrophobicContact CD1-CB 4.26Å; L155-E179 WeakPolarHBondContact CD1-O 3.33Å; L155-Q181 HydrophobicContact CB-CB 4.5Å; L155-Q181 HydrophobicContact CB-CG 4.35Å
156	S	88.5	Confident	90.6	Very high	78 Å²	78	28.7 Å²	28.7	55%	0.545	18%	0.175	S	C	.	.	H	α-helix	trans	-65.7	-37.3	179.9	-176	0	0	0	0	112.8	S152 M153 Q181	S152-S156 WeakPolarHBondContact O-CB 3.5Å; S152-S156 PolarHBondContact O-N 3.06Å; S152-S156 VanDerWaalsContact O-N 3.09Å; M153-S156 PolarHBondContact O-N 2.82Å; S156-Q181 VanDerWaalsContact CB-OE1 3.29Å; S156-Q181 VanDerWaalsContact N-OE1 3.13Å
157	N	89.4	Confident	90.7	Very high	99 Å²	99	26.4 Å²	26.4	53%	0.529	16%	0.162	S	C	.	.	H	α-helix	trans	-77.1	-41.1	-178.4	-71.8	-10	0	0	0	112	E31 M153 L155	E31-N157 WeakPolarHBondContact OE1-CB 3.47Å; E31-N157 PolarHBondContact OE1-ND2 3.09Å; M153-N157 WeakPolarHBondContact O-CB 3.16Å; M153-N157 PolarHBondContact O-N 2.86Å; L155-N157 PolarHBondContact O-N 3.31Å
158	S	86.5	Confident	90.7	Very high	23 Å²	23	26.6 Å²	26.6	16%	0.161	16%	0.164	C	C	.	.	H	α-helix	trans	-80.1	-21.5	-179.2	64.4	0	0	0	0	113.4	T40 S154 L155 C160	T40-S158 VanDerWaalsContact CG2-O 3.22Å; T40-S158 WeakPolarHBondContact CG2-O 3.36Å; S154-S158 VanDerWaalsContact O-CB 3.22Å; S154-S158 WeakPolarHBondContact O-CB 3.32Å; S154-S158 PolarHBondContact O-N 2.91Å; S154-S158 PolarHBondContact O-OG 2.82Å; L155-S158 PolarHBondContact O-OG 2.8Å; S158-C160 PolarHBondContact O-N 3.01Å; S158-C160 WeakPolarHBondContact OG-CB 3.27Å; S158-C160 PolarHBondContact OG-N 2.91Å
159	G	84.2	Confident	90.6	Very high	43 Å²	43	27.2 Å²	27.2	44%	0.443	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.2	16	-172.2	0	0	0	0	0	113.5	L155 Q161	L155-G159 WeakPolarHBondContact O-CA 3.47Å; L155-G159 PolarHBondContact O-N 2.82Å; G159-Q161 PolarHBondContact O-N 2.84Å
160	C	87.4	Confident	90.3	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.014	16%	0.163	C	C	.	.			trans	-68	128.4	179.7	-175.2	0	0	0	0	111.1	L34 L39 T40 L155 S158	L34-C160 HydrophobicContact CD1-CB 4.17Å; L39-C160 PolarHBondContact O-SG 2.92Å; T40-C160 HydrophobicContact CG2-CB 4.47Å; L155-C160 HydrophobicContact CD2-CB 4.11Å; S158-C160 PolarHBondContact O-N 3.01Å; S158-C160 WeakPolarHBondContact OG-CB 3.27Å; S158-C160 PolarHBondContact OG-N 2.91Å
161	Q	87.9	Confident	90	Very high	53 Å²	53	32 Å²	32	25%	0.248	18%	0.18	C	C	.	.			trans	-96.1	1.8	179.8	-58.8	-174.2	7.2	0	0	113.5	N42 P97 G159 C180 Q181	N42-Q161 PolarHBondContact OD1-NE2 2.91Å; P97-Q161 HydrophobicContact CB-CB 4.46Å; G159-Q161 PolarHBondContact O-N 2.84Å; Q161-C180 PolarHBondContact O-SG 3.14Å; Q161-Q181 WeakPolarHBondContact CA-O 3.38Å
162	V	90.8	Very high	89.6	Confident	13 Å²	13	39.7 Å²	39.7	8%	0.079	21%	0.209	C	C	.	.	S	Bend	trans	-79.5	131	179.6	179.1	0	0	0	0	109.4	L39 E125 V127 M164	L39-V162 HydrophobicContact CB-CG2 4.39Å; L39-V162 HydrophobicContact CD2-CG2 4.44Å; E125-V162 HydrophobicContact CG-CG1 3.85Å; E125-V162 HydrophobicContact CG-CG2 4.28Å; V127-V162 HydrophobicContact CG2-CG1 4.17Å; V162-M164 PolarHBondContact O-N 2.92Å
163	P	93.4	Very high	89.4	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.019	22%	0.215	C	C	.	.			trans	-59.7	131.5	176.2	-24.2	33.8	0	0	0	112.2	A99 L123 F126 V127 F165 C180 F189	A99-P163 HydrophobicContact CB-CG 3.29Å; L123-P163 HydrophobicContact CD1-CB 4.17Å; L123-P163 HydrophobicContact CD1-CG 4.15Å; L123-P163 HydrophobicContact CD2-CG 4.24Å; F126-P163 WeakPolarHBondContact CA-O 3.4Å; F126-P163 HydrophobicContact CB-CB 4.46Å; V127-P163 PolarHBondContact N-O 2.79Å; P163-F165 HydrophobicContact CB-CE2 3.77Å; P163-F165 HydrophobicContact CB-CZ 4.29Å; P163-C180 HydrophobicContact CB-CB 4.17Å; P163-C180 HydrophobicContact CG-CB 4.08Å; P163-F189 HydrophobicContact CB-CE2 3.96Å; P163-F189 HydrophobicContact CB-CZ 4.22Å; P163-F189 HydrophobicContact CG-CE2 4.45Å; P163-F189 HydrophobicContact CG-CZ 4.35Å
164	M	94.8	Very high	89.3	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	132	176	-171.3	179.2	-57.1	0	0	110.8	V30 L34 V127 I129 V151 L155 V162 G178 E179	V30-M164 HydrophobicContact CG1-CE 3.95Å; V30-M164 HydrophobicContact CG1-SD 4.19Å; L34-M164 HydrophobicContact CD1-CE 3.86Å; L34-M164 HydrophobicContact CD2-CE 3.75Å; L34-M164 HydrophobicContact CG-CE 4.18Å; V127-M164 HydrophobicContact CB-CB 4.48Å; V127-M164 HydrophobicContact CB-CG 4.18Å; V127-M164 HydrophobicContact CG1-CE 4.39Å; V127-M164 HydrophobicContact CG1-CG 4.18Å; V127-M164 CarbonylContact O-C 3.52Å; V127-M164 WeakPolarHBondContact O-CA 3.34Å; I129-M164 HydrophobicContact CD1-CG 4.43Å; I129-M164 HydrophobicContact CD1-SD 3.71Å; I129-M164 HydrophobicContact CG1-SD 4.39Å; V151-M164 HydrophobicContact CB-SD 4.06Å; V151-M164 HydrophobicContact CG1-CB 3.69Å; V151-M164 HydrophobicContact CG1-CG 3.78Å; V151-M164 HydrophobicContact CG1-SD 3.61Å; V151-M164 HydrophobicContact CG2-CG 4.17Å; V151-M164 HydrophobicContact CG2-SD 3.58Å; V151-M164 VanDerWaalsContact CG2-SD 3.58Å; L155-M164 HydrophobicContact CD1-CB 4.32Å; L155-M164 HydrophobicContact CD2-CB 4.38Å; L155-M164 HydrophobicContact CD2-CE 4.26Å; V162-M164 PolarHBondContact O-N 2.92Å; M164-G178 CarbonylContact O-C 3.6Å; M164-G178 WeakPolarHBondContact O-CA 3.28Å; M164-E179 PolarHBondContact N-O 3.34Å; M164-E179 PolarHBondContact O-N 3.02Å
165	F	95.3	Very high	89.3	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	143.5	-177.6	-64.8	-89.6	0	0	0	111	L117 Y121 L123 F126 V127 V128 I129 P163 Y176 A177 F189	L117-F165 HydrophobicContact CD1-CB 4.13Å; L117-F165 HydrophobicContact CD1-CD1 4.16Å; L117-F165 HydrophobicContact CD1-CD2 3.72Å; L117-F165 HydrophobicContact CD1-CE2 4.13Å; L117-F165 HydrophobicContact CD1-CG 3.74Å; L117-F165 HydrophobicContact CD2-CD1 4.01Å; L117-F165 HydrophobicContact CD2-CE1 3.99Å; L117-F165 HydrophobicContact CD2-CG 4.43Å; L117-F165 HydrophobicContact CD2-CZ 4.4Å; Y121-F165 HydrophobicContact CD2-CE1 4Å; Y121-F165 AromaticContact CD2-CZ 3.95Å; Y121-F165 HydrophobicContact CD2-CZ 3.95Å; Y121-F165 AromaticContact CE2-CE1 3.71Å; Y121-F165 HydrophobicContact CE2-CE1 3.71Å; Y121-F165 HydrophobicContact CE2-CZ 4.15Å; L123-F165 HydrophobicContact CD1-CE2 3.68Å; L123-F165 HydrophobicContact CD1-CZ 3.65Å; F126-F165 HydrophobicContact CB-CD2 4.1Å; F126-F165 HydrophobicContact CB-CE2 3.84Å; F126-F165 HydrophobicContact CD2-CD2 4.29Å; F126-F165 HydrophobicContact CG-CE2 4.38Å; V127-F165 PolarHBondContact O-N 3.07Å; V128-F165 CarbonylContact C-O 3.6Å; V128-F165 WeakPolarHBondContact CA-O 3.37Å; V128-F165 HydrophobicContact CG2-CB 4.39Å; I129-F165 PolarHBondContact N-O 3.44Å; P163-F165 HydrophobicContact CB-CE2 3.77Å; P163-F165 HydrophobicContact CB-CZ 4.29Å; F165-Y176 HydrophobicContact CB-CD1 4.4Å; F165-A177 CarbonylContact C-O 3.53Å; F165-A177 WeakPolarHBondContact CA-O 3.39Å; F165-F189 HydrophobicContact CD1-CB 4.33Å; F165-F189 HydrophobicContact CE1-CB 3.56Å; F165-F189 AromaticContact CE1-CD1 3.99Å; F165-F189 HydrophobicContact CE1-CD1 3.99Å; F165-F189 HydrophobicContact CE1-CD2 4.03Å; F165-F189 AromaticContact CE1-CG 3.6Å; F165-F189 HydrophobicContact CE1-CG 3.6Å; F165-F189 HydrophobicContact CZ-CB 4.3Å; F165-F189 AromaticContact CZ-CD1 3.95Å; F165-F189 HydrophobicContact CZ-CD1 3.95Å; F165-F189 HydrophobicContact CZ-CD2 4.02Å; F165-F189 HydrophobicContact CZ-CE1 4.23Å; F165-F189 HydrophobicContact CZ-CE2 4.3Å; F165-F189 AromaticContact CZ-CG 3.83Å; F165-F189 HydrophobicContact CZ-CG 3.83Å; F165-F189 HydrophobicContact CZ-CZ 4.4Å
166	V	93.4	Very high	89.5	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	127.4	170.2	-176.5	0	0	0	0	108.3	I138 L147 L148 V151 I168 Y176 A177	I138-V166 HydrophobicContact CD1-CG1 4.43Å; L147-V166 HydrophobicContact CB-CG1 4.11Å; L147-V166 HydrophobicContact CB-CG2 4.39Å; L147-V166 HydrophobicContact CD1-CG1 3.98Å; L148-V166 HydrophobicContact CD2-CG2 4.34Å; V151-V166 HydrophobicContact CG2-CG2 3.63Å; V166-I168 HydrophobicContact CB-CG1 4.48Å; V166-I168 HydrophobicContact CG1-CG1 4.15Å; V166-I168 PolarHBondContact O-N 2.94Å; V166-Y176 VanDerWaalsContact O-CA 3.32Å; V166-Y176 WeakPolarHBondContact O-CA 3.31Å; V166-A177 PolarHBondContact N-O 3.05Å; V166-A177 PolarHBondContact O-N 3.4Å; V166-A177 VanDerWaalsContact O-N 3.1Å
167	Q	92.4	Very high	89.7	Confident	19 Å²	19	44.4 Å²	44.4	9%	0.089	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	118.1	173.5	-168.8	178.7	26.3	0	0	110.1	I129 S130 Y176	I129-Q167 PolarHBondContact O-N 3.02Å; S130-Q167 VanDerWaalsContact CB-OE1 3.3Å; Q167-Y176 HydrophobicContact CB-CD1 3.95Å; Q167-Y176 HydrophobicContact CB-CE1 3.76Å; Q167-Y176 HydrophobicContact CG-CD1 4.22Å; Q167-Y176 HydrophobicContact CG-CE1 3.79Å
168	I	90.6	Very high	89.9	Confident	15 Å²	15	40 Å²	40	8%	0.077	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	159.2	-175.9	-59.9	169.3	0	0	0	108.9	I138 C144 V166 I175 A177	I138-I168 WeakPolarHBondContact O-CG2 3.37Å; C144-I168 HydrophobicContact CB-CD1 4.05Å; C144-I168 HydrophobicContact CB-CG2 4.44Å; C144-I168 WeakPolarHBondContact SG-CG2 3.27Å; V166-I168 HydrophobicContact CB-CG1 4.48Å; V166-I168 HydrophobicContact CG1-CG1 4.15Å; V166-I168 PolarHBondContact O-N 2.94Å; I168-I175 PolarHBondContact N-O 3.3Å; I168-I175 VanDerWaalsContact O-O 3.1Å; I168-A177 HydrophobicContact CD1-CB 3.53Å
169	Q	87.8	Confident	90.3	Very high	54 Å²	54	39.2 Å²	39.2	25%	0.252	18%	0.183	S	C	.	.	B	Isolated β-bridge	trans	61.9	-168.4	-174.6	-62	-69.5	-24.6	0	0	112.6	A137 I138 I175	A137-Q169 WeakPolarHBondContact CB-O 3.41Å; I138-Q169 WeakPolarHBondContact O-CA 3.21Å; I138-Q169 PolarHBondContact O-N 3.19Å; Q169-I175 HydrophobicContact CB-CB 4.49Å; Q169-I175 HydrophobicContact CB-CD1 4.02Å; Q169-I175 HydrophobicContact CG-CD1 3.87Å
170	Q	86.1	Confident	90.7	Very high	78 Å²	78	37.1 Å²	37.1	36%	0.364	16%	0.162	S	C	.	.			trans	-65.1	136.4	178.1	-64	173.5	-23.7	0	0	111	A137 W172 R173	A137-Q170 HydrophobicContact CB-CG 4.43Å; Q170-W172 HydrophobicContact CB-CG 4.48Å; Q170-W172 PolarHBondContact O-N 3.14Å; Q170-W172 VanDerWaalsContact O-N 3.1Å; Q170-R173 WeakPolarHBondContact O-CB 3.34Å; Q170-R173 PolarHBondContact O-N 3.23Å
171	K	84.6	Confident	90.7	Very high	85 Å²	85	38.7 Å²	38.7	37%	0.37	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-51.8	-38.6	-175.4	-68.2	-176.5	175.5	179.5	0	113.8	P131 G132 R173 R174	P131-K171 VanDerWaalsContact O-CE 3.27Å; P131-K171 WeakPolarHBondContact O-CE 3.3Å; P131-K171 PolarHBondContact O-NZ 3.38Å; G132-K171 PolarHBondContact O-NZ 2.88Å; K171-R173 VanDerWaalsContact C-N 3.26Å; K171-R173 PolarHBondContact O-N 3.04Å; K171-R174 PolarHBondContact O-N 3.39Å
172	W	84.7	Confident	90.6	Very high	163 Å²	163	37 Å²	37	62%	0.617	17%	0.166	S	C	*	.	G	3₁₀ helix	trans	-65.5	-24.5	179.7	68	-97.2	0	0	0	113.9	Q170 R174	Q170-W172 HydrophobicContact CB-CG 4.48Å; Q170-W172 PolarHBondContact O-N 3.14Å; Q170-W172 VanDerWaalsContact O-N 3.1Å; W172-R174 VanDerWaalsContact C-N 3.29Å; W172-R174 PolarHBondContact O-N 2.83Å
173	R	86.9	Confident	90.2	Very high	83 Å²	83	39.9 Å²	39.9	31%	0.313	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-75.1	-18.9	177.6	-68.2	-171.7	175.1	-162.7	-0.6	113.3	Q170 K171 I175 R955	Q170-R173 WeakPolarHBondContact O-CB 3.34Å; Q170-R173 PolarHBondContact O-N 3.23Å; K171-R173 VanDerWaalsContact C-N 3.26Å; K171-R173 PolarHBondContact O-N 3.04Å; R173-I175 VanDerWaalsContact C-N 3.32Å; R173-I175 HydrophobicContact CB-CD1 3.93Å; R173-I175 HydrophobicContact CB-CG1 4.02Å; R173-I175 PolarHBondContact O-N 3.17Å; R173-R955 PolarHBondContact O-NH2 3.16Å
174	R	89.1	Confident	89.8	Confident	142 Å²	142	40.8 Å²	40.8	54%	0.536	20%	0.195	S	C	.	.			trans	50.9	49.6	-179.8	-59.1	179.2	-179.3	177.1	-1.2	112.1	W120 K171 W172 Y176	W120-R174 HydrophobicContact CH2-CB 4.04Å; W120-R174 VanDerWaalsContact CH2-O 3.29Å; W120-R174 WeakPolarHBondContact CH2-O 3.48Å; K171-R174 PolarHBondContact O-N 3.39Å; W172-R174 VanDerWaalsContact C-N 3.29Å; W172-R174 PolarHBondContact O-N 2.83Å; R174-Y176 HydrophobicContact CB-CE2 4Å; R174-Y176 WeakPolarHBondContact O-CD2 3.45Å; R174-Y176 WeakPolarHBondContact O-CE2 3.42Å
175	I	91.8	Very high	89.6	Confident	22 Å²	22	41 Å²	41	11%	0.113	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	129.2	176.4	-63.8	168.6	0	0	0	108	I168 Q169 R173 I191 H193	I168-I175 PolarHBondContact N-O 3.3Å; I168-I175 VanDerWaalsContact O-O 3.1Å; Q169-I175 HydrophobicContact CB-CB 4.49Å; Q169-I175 HydrophobicContact CB-CD1 4.02Å; Q169-I175 HydrophobicContact CG-CD1 3.87Å; R173-I175 VanDerWaalsContact C-N 3.32Å; R173-I175 HydrophobicContact CB-CD1 3.93Å; R173-I175 HydrophobicContact CB-CG1 4.02Å; R173-I175 PolarHBondContact O-N 3.17Å; I175-I191 HydrophobicContact CG2-CB 4.46Å; I175-H193 HydrophobicContact CD1-CB 4.01Å; I175-H193 HydrophobicContact CG1-CB 4.11Å
176	Y	93.4	Very high	89.4	Confident	16 Å²	16	45.1 Å²	45.1	6%	0.063	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	142.8	178.5	-56.9	-93.5	0	0	0	108.5	L117 W120 V128 F165 V166 Q167 R174 I191	L117-Y176 HydrophobicContact CD1-CD1 4.38Å; L117-Y176 HydrophobicContact CD1-CG 4.42Å; L117-Y176 HydrophobicContact CD2-CD2 3.85Å; L117-Y176 HydrophobicContact CD2-CE2 4.48Å; L117-Y176 HydrophobicContact CD2-CG 3.97Å; L117-Y176 HydrophobicContact CG-CD2 4.39Å; W120-Y176 AromaticContact CZ3-CD2 3.95Å; W120-Y176 HydrophobicContact CZ3-CD2 3.95Å; W120-Y176 HydrophobicContact CZ3-CE2 4.22Å; V128-Y176 HydrophobicContact CG1-CD1 4.07Å; V128-Y176 HydrophobicContact CG1-CE1 3.72Å; F165-Y176 HydrophobicContact CB-CD1 4.4Å; V166-Y176 VanDerWaalsContact O-CA 3.32Å; V166-Y176 WeakPolarHBondContact O-CA 3.31Å; Q167-Y176 HydrophobicContact CB-CD1 3.95Å; Q167-Y176 HydrophobicContact CB-CE1 3.76Å; Q167-Y176 HydrophobicContact CG-CD1 4.22Å; Q167-Y176 HydrophobicContact CG-CE1 3.79Å; R174-Y176 HydrophobicContact CB-CE2 4Å; R174-Y176 WeakPolarHBondContact O-CD2 3.45Å; R174-Y176 WeakPolarHBondContact O-CE2 3.42Å; Y176-I191 HydrophobicContact CD2-CD1 4.21Å; Y176-I191 WeakPolarHBondContact O-CG1 3.43Å
177	A	93.5	Very high	89.4	Confident	18 Å²	18	45.1 Å²	45.1	15%	0.149	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	138.6	164.3	0	0	0	0	0	107.5	L148 F165 V166 I168 F189	L148-A177 HydrophobicContact CD1-CB 3.87Å; L148-A177 HydrophobicContact CD2-CB 3.81Å; L148-A177 HydrophobicContact CG-CB 4.37Å; F165-A177 CarbonylContact C-O 3.53Å; F165-A177 WeakPolarHBondContact CA-O 3.39Å; V166-A177 PolarHBondContact N-O 3.05Å; V166-A177 PolarHBondContact O-N 3.4Å; V166-A177 VanDerWaalsContact O-N 3.1Å; I168-A177 HydrophobicContact CD1-CB 3.53Å; A177-F189 WeakPolarHBondContact CA-O 3.38Å
178	G	94.1	Very high	89.5	Confident	6 Å²	6	46.1 Å²	46.1	6%	0.062	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	167.8	-174.5	0	0	0	0	0	112.9	M164 F189	M164-G178 CarbonylContact O-C 3.6Å; M164-G178 WeakPolarHBondContact O-CA 3.28Å; G178-F189 PolarHBondContact N-O 3.31Å; G178-F189 PolarHBondContact O-N 2.99Å
179	E	93.9	Very high	89.7	Confident	7 Å²	7	45.5 Å²	45.5	3%	0.033	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	146.7	177.8	-168.6	177	158.8	0	0	109.4	S152 L155 M164 Q181 R186 T187	S152-E179 WeakPolarHBondContact CB-OE2 3.37Å; S152-E179 VanDerWaalsContact OG-CD 3.3Å; S152-E179 PolarHBondContact OG-OE1 2.93Å; S152-E179 VanDerWaalsContact OG-OE1 3.1Å; S152-E179 PolarHBondContact OG-OE2 2.85Å; L155-E179 HydrophobicContact CD1-CB 4.26Å; L155-E179 WeakPolarHBondContact CD1-O 3.33Å; M164-E179 PolarHBondContact N-O 3.34Å; M164-E179 PolarHBondContact O-N 3.02Å; E179-Q181 HydrophobicContact CG-CG 4.34Å; E179-Q181 WeakPolarHBondContact OE1-CG 3.42Å; E179-Q181 PolarHBondContact OE1-NE2 3.19Å; E179-R186 HydrophobicContact CG-CG 4.14Å; E179-R186 WeakPolarHBondContact OE1-CD 3.32Å; E179-R186 IonicContact OE1-CZ 3.46Å; E179-R186 IonicContact OE1-NE 2.82Å; E179-R186 PolarHBondContact OE1-NE 3.37Å; E179-R186 VanDerWaalsContact OE1-NE 3.16Å; E179-R186 IonicContact OE1-NH1 2.81Å; E179-R186 PolarHBondContact OE1-NH1 2.83Å; E179-R186 IonicContact OE1-NH2 2.65Å; E179-R186 PolarHBondContact OE1-NH2 3.42Å; E179-R186 IonicContact OE2-CZ 3.92Å; E179-R186 VanDerWaalsContact OE2-CZ 3.22Å; E179-R186 IonicContact OE2-NE 3.65Å; E179-R186 IonicContact OE2-NH1 3.53Å; E179-R186 IonicContact OE2-NH2 3Å; E179-R186 PolarHBondContact OE2-NH2 2.91Å; E179-T187 WeakPolarHBondContact CA-O 3.48Å
180	C	92.3	Very high	90	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	130.7	167.4	177.5	0	0	0	0	108.3	Q161 P163 R186 T187 F189	Q161-C180 PolarHBondContact O-SG 3.14Å; P163-C180 HydrophobicContact CB-CB 4.17Å; P163-C180 HydrophobicContact CG-CB 4.08Å; C180-R186 CarbonylContact O-C 3.56Å; C180-R186 WeakPolarHBondContact O-CA 3.48Å; C180-T187 PolarHBondContact N-O 3.1Å; C180-T187 PolarHBondContact O-N 2.91Å; C180-F189 HydrophobicContact CB-CE2 3.73Å; C180-F189 HydrophobicContact CB-CZ 4.38Å
181	Q	88.8	Confident	90.4	Very high	35 Å²	35	44 Å²	44	16%	0.164	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	143.6	177.4	-67	-178.8	7.7	0	0	110	S152 L155 S156 Q161 E179	S152-Q181 PolarHBondContact O-NE2 3.2Å; S152-Q181 VanDerWaalsContact O-NE2 3.08Å; S152-Q181 PolarHBondContact OG-NE2 2.8Å; L155-Q181 HydrophobicContact CB-CB 4.5Å; L155-Q181 HydrophobicContact CB-CG 4.35Å; S156-Q181 VanDerWaalsContact CB-OE1 3.29Å; S156-Q181 VanDerWaalsContact N-OE1 3.13Å; Q161-Q181 WeakPolarHBondContact CA-O 3.38Å; E179-Q181 HydrophobicContact CG-CG 4.34Å; E179-Q181 WeakPolarHBondContact OE1-CG 3.42Å; E179-Q181 PolarHBondContact OE1-NE2 3.19Å
182	G	85.1	Confident	90.7	Very high	17 Å²	17	43 Å²	43	18%	0.175	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	178	172.3	0	0	0	0	0	110.3	G184 V185	G182-G184 PolarHBondContact O-N 3.06Å; G182-V185 PolarHBondContact N-O 2.82Å; G182-V185 PolarHBondContact O-N 3.46Å; G182-V185 VanDerWaalsContact O-O 3.13Å
183	P	83.3	Confident	91.1	Very high	74 Å²	74	36.8 Å²	36.8	48%	0.481	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	105.3	178.6	24.5	-32.5	0	0	0	110.3	V185	P183-V185 VanDerWaalsContact C-N 3.28Å; P183-V185 PolarHBondContact O-N 2.95Å
184	G	84.8	Confident	91.3	Very high	22 Å²	22	36.5 Å²	36.5	23%	0.227	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	11.8	178	0	0	0	0	0	115.9	G182 D963 T964 S965	G182-G184 PolarHBondContact O-N 3.06Å; G184-D963 VanDerWaalsContact O-OD1 3.11Å; G184-T964 PolarHBondContact O-N 2.9Å; G184-T964 PolarHBondContact O-OG1 3.04Å; G184-S965 WeakPolarHBondContact CA-OG 3.24Å; G184-S965 PolarHBondContact O-N 3.45Å; G184-S965 PolarHBondContact O-OG 3.02Å; G184-S965 VanDerWaalsContact O-OG 3.06Å
185	V	89.6	Confident	91.2	Very high	6 Å²	6	38.4 Å²	38.4	4%	0.036	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	147	-175.1	-65.6	0	0	0	0	111.5	L96 P97 M100 G182 P183 L941 A962 T964	L96-V185 HydrophobicContact CD2-CG1 4.44Å; P97-V185 HydrophobicContact CG-CG2 4.26Å; M100-V185 HydrophobicContact CE-CB 3.81Å; M100-V185 HydrophobicContact CE-CG2 3.63Å; M100-V185 HydrophobicContact SD-CB 4.4Å; M100-V185 HydrophobicContact SD-CG2 4.03Å; G182-V185 PolarHBondContact N-O 2.82Å; G182-V185 PolarHBondContact O-N 3.46Å; G182-V185 VanDerWaalsContact O-O 3.13Å; P183-V185 VanDerWaalsContact C-N 3.28Å; P183-V185 PolarHBondContact O-N 2.95Å; V185-L941 HydrophobicContact CB-CD2 4.46Å; V185-L941 HydrophobicContact CG1-CD1 4.12Å; V185-L941 HydrophobicContact CG1-CD2 3.72Å; V185-A962 WeakPolarHBondContact CA-O 3.15Å; V185-T964 PolarHBondContact N-OG1 3.44Å
186	R	91.6	Very high	91	Very high	85 Å²	85	45 Å²	45	32%	0.321	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	137.9	177.4	174.9	-179.3	164.7	138.1	12.7	110.3	E179 C180 D188 S961 A962 T964	E179-R186 HydrophobicContact CG-CG 4.14Å; E179-R186 WeakPolarHBondContact OE1-CD 3.32Å; E179-R186 IonicContact OE1-CZ 3.46Å; E179-R186 IonicContact OE1-NE 2.82Å; E179-R186 PolarHBondContact OE1-NE 3.37Å; E179-R186 VanDerWaalsContact OE1-NE 3.16Å; E179-R186 IonicContact OE1-NH1 2.81Å; E179-R186 PolarHBondContact OE1-NH1 2.83Å; E179-R186 IonicContact OE1-NH2 2.65Å; E179-R186 PolarHBondContact OE1-NH2 3.42Å; E179-R186 IonicContact OE2-CZ 3.92Å; E179-R186 VanDerWaalsContact OE2-CZ 3.22Å; E179-R186 IonicContact OE2-NE 3.65Å; E179-R186 IonicContact OE2-NH1 3.53Å; E179-R186 IonicContact OE2-NH2 3Å; E179-R186 PolarHBondContact OE2-NH2 2.91Å; C180-R186 CarbonylContact O-C 3.56Å; C180-R186 WeakPolarHBondContact O-CA 3.48Å; R186-D188 IonicContact CZ-OD1 3.63Å; R186-D188 VanDerWaalsContact CZ-OD1 3.25Å; R186-D188 IonicContact NE-OD1 2.76Å; R186-D188 PolarHBondContact NE-OD1 3.05Å; R186-D188 IonicContact NE-OD2 3.89Å; R186-D188 IonicContact NH2-OD1 3.16Å; R186-D188 PolarHBondContact NH2-OD1 3.1Å; R186-S961 CarbonylContact O-C 3.57Å; R186-S961 VanDerWaalsContact O-CA 3.25Å; R186-S961 WeakPolarHBondContact O-CA 3.41Å; R186-A962 PolarHBondContact N-O 3.2Å; R186-A962 PolarHBondContact O-N 3.47Å; R186-T964 HydrophobicContact CB-CG2 3.79Å
187	T	93.5	Very high	90.6	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.006	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	125.4	169.6	-55.6	0	0	0	0	110.2	M100 L103 E179 C180 F189 A959 S961	M100-T187 WeakPolarHBondContact CE-OG1 3.34Å; L103-T187 HydrophobicContact CD1-CG2 4.31Å; E179-T187 WeakPolarHBondContact CA-O 3.48Å; C180-T187 PolarHBondContact N-O 3.1Å; C180-T187 PolarHBondContact O-N 2.91Å; T187-F189 HydrophobicContact CG2-CD2 4.46Å; T187-F189 HydrophobicContact CG2-CE1 4.19Å; T187-F189 HydrophobicContact CG2-CE2 3.99Å; T187-F189 HydrophobicContact CG2-CZ 3.85Å; T187-A959 HydrophobicContact CG2-CB 4.05Å; T187-S961 PolarHBondContact OG1-OG 2.85Å
188	D	94.3	Very high	90.4	Very high	39 Å²	39	47.1 Å²	47.1	21%	0.209	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	129.4	173	-61.2	-49.5	0	0	0	109.7	R186 A959 F960	R186-D188 IonicContact CZ-OD1 3.63Å; R186-D188 VanDerWaalsContact CZ-OD1 3.25Å; R186-D188 IonicContact NE-OD1 2.76Å; R186-D188 PolarHBondContact NE-OD1 3.05Å; R186-D188 IonicContact NE-OD2 3.89Å; R186-D188 IonicContact NH2-OD1 3.16Å; R186-D188 PolarHBondContact NH2-OD1 3.1Å; D188-A959 WeakPolarHBondContact O-CA 3.46Å; D188-F960 PolarHBondContact N-O 3.2Å; D188-F960 PolarHBondContact O-N 3.35Å
189	F	95.1	Very high	90	Very high	3 Å²	3	51.6 Å²	51.6	1%	0.013	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	118.1	176.2	-61.3	-87.5	0	0	0	110.2	L103 Y121 L123 P163 F165 A177 G178 C180 T187 G958 A959	L103-F189 HydrophobicContact CD2-CE1 4.22Å; Y121-F189 AromaticContact CD1-CD1 3.66Å; Y121-F189 HydrophobicContact CD1-CD1 3.66Å; Y121-F189 AromaticContact CD1-CE1 3.99Å; Y121-F189 HydrophobicContact CD1-CE1 3.99Å; Y121-F189 HydrophobicContact CD2-CD1 4Å; Y121-F189 HydrophobicContact CD2-CE1 4.44Å; Y121-F189 AromaticContact CE1-CD1 3.63Å; Y121-F189 HydrophobicContact CE1-CD1 3.63Å; Y121-F189 HydrophobicContact CE1-CE1 4.41Å; Y121-F189 HydrophobicContact CE2-CB 4.37Å; Y121-F189 AromaticContact CE2-CD1 3.97Å; Y121-F189 HydrophobicContact CE2-CD1 3.97Å; Y121-F189 AromaticContact CG-CD1 3.84Å; Y121-F189 HydrophobicContact CG-CD1 3.84Å; Y121-F189 AromaticContact CG-CE1 4Å; Y121-F189 HydrophobicContact CG-CE1 4Å; Y121-F189 AromaticContact CZ-CD1 3.77Å; L123-F189 HydrophobicContact CD1-CE1 4.45Å; P163-F189 HydrophobicContact CB-CE2 3.96Å; P163-F189 HydrophobicContact CB-CZ 4.22Å; P163-F189 HydrophobicContact CG-CE2 4.45Å; P163-F189 HydrophobicContact CG-CZ 4.35Å; F165-F189 HydrophobicContact CD1-CB 4.33Å; F165-F189 HydrophobicContact CE1-CB 3.56Å; F165-F189 AromaticContact CE1-CD1 3.99Å; F165-F189 HydrophobicContact CE1-CD1 3.99Å; F165-F189 HydrophobicContact CE1-CD2 4.03Å; F165-F189 AromaticContact CE1-CG 3.6Å; F165-F189 HydrophobicContact CE1-CG 3.6Å; F165-F189 HydrophobicContact CZ-CB 4.3Å; F165-F189 AromaticContact CZ-CD1 3.95Å; F165-F189 HydrophobicContact CZ-CD1 3.95Å; F165-F189 HydrophobicContact CZ-CD2 4.02Å; F165-F189 HydrophobicContact CZ-CE1 4.23Å; F165-F189 HydrophobicContact CZ-CE2 4.3Å; F165-F189 AromaticContact CZ-CG 3.83Å; F165-F189 HydrophobicContact CZ-CG 3.83Å; F165-F189 HydrophobicContact CZ-CZ 4.4Å; A177-F189 WeakPolarHBondContact CA-O 3.38Å; G178-F189 PolarHBondContact N-O 3.31Å; G178-F189 PolarHBondContact O-N 2.99Å; C180-F189 HydrophobicContact CB-CE2 3.73Å; C180-F189 HydrophobicContact CB-CZ 4.38Å; T187-F189 HydrophobicContact CG2-CD2 4.46Å; T187-F189 HydrophobicContact CG2-CE1 4.19Å; T187-F189 HydrophobicContact CG2-CE2 3.99Å; T187-F189 HydrophobicContact CG2-CZ 3.85Å; F189-G958 WeakPolarHBondContact CA-O 3.43Å; F189-A959 HydrophobicContact CD1-CB 3.64Å; F189-A959 HydrophobicContact CE1-CB 3.64Å
190	E	93.3	Very high	89.7	Confident	81 Å²	81	57.4 Å²	57.4	38%	0.379	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	140.3	-176.2	-63.8	-179.4	-173.4	0	0	111.3	Y121 K214 A957 G958	Y121-E190 PolarHBondContact OH-O 2.85Å; E190-K214 VanDerWaalsContact OE2-CE 3.29Å; E190-K214 WeakPolarHBondContact OE2-CE 3.39Å; E190-K214 IonicContact OE2-NZ 2.56Å; E190-K214 PolarHBondContact OE2-NZ 3.17Å; E190-A957 CarbonylContact O-C 3.57Å; E190-A957 WeakPolarHBondContact O-CA 3.29Å; E190-G958 PolarHBondContact N-O 3.42Å; E190-G958 PolarHBondContact O-N 2.85Å
191	I	94.1	Very high	89.4	Confident	20 Å²	20	60.5 Å²	60.5	10%	0.103	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	128	177.2	-59	-177.7	0	0	0	110.5	W120 Y121 I175 Y176 R955 L956 A957	W120-I191 HydrophobicContact CE3-CD1 3.48Å; W120-I191 VanDerWaalsContact CE3-CD1 3.48Å; W120-I191 HydrophobicContact CH2-CD1 4.42Å; W120-I191 HydrophobicContact CZ3-CD1 3.35Å; Y121-I191 HydrophobicContact CE2-CD1 4.45Å; Y121-I191 VanDerWaalsContact OH-CG1 3.29Å; Y121-I191 WeakPolarHBondContact OH-CG1 3.38Å; I175-I191 HydrophobicContact CG2-CB 4.46Å; Y176-I191 HydrophobicContact CD2-CD1 4.21Å; Y176-I191 WeakPolarHBondContact O-CG1 3.43Å; I191-R955 HydrophobicContact CG2-CG 3.9Å; I191-L956 CarbonylContact C-O 3.6Å; I191-L956 VanDerWaalsContact CA-O 3.29Å; I191-L956 WeakPolarHBondContact CA-O 3.4Å; I191-A957 HydrophobicContact CG1-CB 4.09Å
192	V	92.1	Very high	89.4	Confident	62 Å²	62	62.1 Å²	62.1	38%	0.376	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.3	169	-178.5	0	0	0	0	108.3	L194 R955 L956	V192-L194 HydrophobicContact CG1-CG 4.34Å; V192-R955 CarbonylContact O-C 3.58Å; V192-R955 VanDerWaalsContact O-CA 3.29Å; V192-R955 WeakPolarHBondContact O-CA 3.29Å; V192-L956 HydrophobicContact CB-CB 4.31Å; V192-L956 PolarHBondContact N-O 2.98Å; V192-L956 PolarHBondContact O-N 2.78Å
193	H	92.6	Very high	89.6	Confident	33 Å²	33	62.4 Å²	62.4	15%	0.153	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	120.1	177	170.4	-86	0	0	0	110.5	I175 E953 F954	I175-H193 HydrophobicContact CD1-CB 4.01Å; I175-H193 HydrophobicContact CG1-CB 4.11Å; H193-E953 IonicContact CD2-OE1 3.4Å; H193-E953 IonicContact NE2-OE1 2.83Å; H193-F954 CarbonylContact C-O 3.07Å; H193-F954 WeakPolarHBondContact CA-O 3.41Å
194	L	90.6	Very high	90	Very high	77 Å²	77	59.2 Å²	59.2	40%	0.403	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	152.4	175.7	-55.9	177.2	0	0	0	109.8	V192 P198 F954	V192-L194 HydrophobicContact CG1-CG 4.34Å; L194-P198 HydrophobicContact CD1-CG 4.18Å; L194-F954 HydrophobicContact CB-CB 4.25Å; L194-F954 HydrophobicContact CB-CD1 4.12Å; L194-F954 HydrophobicContact CD1-CD1 3.92Å; L194-F954 HydrophobicContact CD1-CE1 4.33Å; L194-F954 HydrophobicContact CG-CD1 4.19Å; L194-F954 PolarHBondContact N-O 2.86Å; L194-F954 PolarHBondContact O-N 3.42Å
195	R	87.4	Confident	90.3	Very high	183 Å²	183	59.7 Å²	59.7	69%	0.691	29%	0.294	S	S	*	.	S	Bend	trans	-76.6	-25.5	177.8	-173.3	175.6	178.7	175.5	2.9	113.3	D952	R195-D952 CarbonylContact O-C 3.57Å; R195-D952 WeakPolarHBondContact O-CA 3.15Å
196	K	87.5	Confident	90.3	Very high	160 Å²	160	59.6 Å²	59.6	70%	0.696	29%	0.294	S	S	*	.	S	Bend	trans	-127.6	138.8	-179.3	-68.2	-172.2	177.1	-174.4	0	109.5	P198	K196-P198 WeakPolarHBondContact O-CD 3.4Å
197	V	86.2	Confident	90.4	Very high	35 Å²	35	55.6 Å²	55.6	21%	0.212	28%	0.279	C	S	.	.			trans	-71.3	121.9	173.7	-177.5	0	0	0	0	109	N202 L949 F954	V197-N202 HydrophobicContact CG1-CB 4.16Å; V197-L949 HydrophobicContact CB-CD2 4.35Å; V197-L949 HydrophobicContact CG1-CD2 3.43Å; V197-L949 VanDerWaalsContact CG1-CD2 3.43Å; V197-L949 HydrophobicContact CG2-CD2 3.93Å; V197-F954 HydrophobicContact CB-CD2 4.42Å; V197-F954 HydrophobicContact CG1-CD2 4.11Å; V197-F954 HydrophobicContact CG1-CE2 4.42Å; V197-F954 HydrophobicContact CG2-CB 3.93Å; V197-F954 HydrophobicContact CG2-CD2 4.06Å; V197-F954 HydrophobicContact CG2-CG 4.34Å
198	P	88.9	Confident	90.3	Very high	43 Å²	43	56.3 Å²	56.3	28%	0.279	28%	0.283	S	S	.	.			trans	-63.5	138.7	170	-21.2	34.8	0	0	0	110.7	L194 K196 Q200 Y201 N202	L194-P198 HydrophobicContact CD1-CG 4.18Å; K196-P198 WeakPolarHBondContact O-CD 3.4Å; P198-Q200 PolarHBondContact O-N 3.05Å; P198-Q200 VanDerWaalsContact O-N 3.13Å; P198-Y201 HydrophobicContact CB-CD2 3.89Å; P198-Y201 HydrophobicContact CB-CE2 4.47Å; P198-Y201 HydrophobicContact CG-CD2 3.97Å; P198-Y201 PolarHBondContact O-N 3.16Å; P198-N202 PolarHBondContact O-N 2.81Å
199	S	85.4	Confident	90	Very high	100 Å²	100	59.6 Å²	59.6	70%	0.699	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-57.2	-33.4	-176.3	53.2	0	0	0	0	113.6	Y201 N202	S199-Y201 VanDerWaalsContact C-N 3.26Å; S199-Y201 PolarHBondContact O-N 2.96Å; S199-N202 WeakPolarHBondContact O-CB 3.5Å; S199-N202 PolarHBondContact O-N 3.02Å
200	Q	86.2	Confident	89.9	Confident	129 Å²	129	61.5 Å²	61.5	60%	0.603	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-64.6	-27	178.2	-63.5	173.9	-2.1	0	0	113.3	P198 H203 G206	P198-Q200 PolarHBondContact O-N 3.05Å; P198-Q200 VanDerWaalsContact O-N 3.13Å; Q200-H203 PolarHBondContact O-CE1 2.96Å; Q200-H203 VanDerWaalsContact O-CE1 3.23Å; Q200-G206 WeakPolarHBondContact O-CA 3.48Å
201	Y	87.6	Confident	89.8	Confident	65 Å²	65	57.6 Å²	57.6	26%	0.255	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-111.1	18.6	-175.9	-53.5	-47.7	0	0	0	112.4	P198 S199 H203 G206 I210 L949 F954	P198-Y201 HydrophobicContact CB-CD2 3.89Å; P198-Y201 HydrophobicContact CB-CE2 4.47Å; P198-Y201 HydrophobicContact CG-CD2 3.97Å; P198-Y201 PolarHBondContact O-N 3.16Å; S199-Y201 VanDerWaalsContact C-N 3.26Å; S199-Y201 PolarHBondContact O-N 2.96Å; Y201-H203 PolarHBondContact O-N 3.47Å; Y201-G206 WeakPolarHBondContact CD1-O 3.25Å; Y201-I210 HydrophobicContact CD1-CG2 4.41Å; Y201-I210 HydrophobicContact CE1-CB 4.04Å; Y201-I210 HydrophobicContact CE1-CD1 4.36Å; Y201-I210 HydrophobicContact CE1-CG2 4.42Å; Y201-I210 HydrophobicContact CE2-CD1 4.39Å; Y201-L949 WeakPolarHBondContact O-CD2 3.35Å; Y201-F954 HydrophobicContact CD2-CZ 4.36Å
202	N	87.6	Confident	89.6	Confident	69 Å²	69	59.2 Å²	59.2	37%	0.369	30%	0.298	S	S	.	.	S	Bend	trans	-83	0.8	-176.8	-161.7	35.1	0	0	0	113.5	V197 P198 S199 R923	V197-N202 HydrophobicContact CG1-CB 4.16Å; P198-N202 PolarHBondContact O-N 2.81Å; S199-N202 WeakPolarHBondContact O-CB 3.5Å; S199-N202 PolarHBondContact O-N 3.02Å; N202-R923 PolarHBondContact O-NH1 2.77Å; N202-R923 PolarHBondContact OD1-NH2 2.93Å
203	H	89.9	Confident	89.5	Confident	24 Å²	24	60.9 Å²	60.9	11%	0.111	31%	0.313	C	S	.	.	S	Bend	trans	-146.5	162.6	-172.9	59.5	-91	0	0	0	109.7	Q200 Y201 S205 G206 L207	Q200-H203 PolarHBondContact O-CE1 2.96Å; Q200-H203 VanDerWaalsContact O-CE1 3.23Å; Y201-H203 PolarHBondContact O-N 3.47Å; H203-S205 PolarHBondContact CD2-OG 2.88Å; H203-S205 PolarHBondContact NE2-OG 2.77Å; H203-S205 PolarHBondContact O-N 3.22Å; H203-G206 PolarHBondContact CD2-N 3.47Å; H203-G206 PolarHBondContact NE2-N 3.3Å; H203-G206 PolarHBondContact O-N 3.2Å; H203-L207 PolarHBondContact O-N 2.95Å
204	L	90.8	Very high	89.3	Confident	6 Å²	6	63.5 Å²	63.5	3%	0.031	32%	0.324	C	S	.	.	H	α-helix	trans	-60.8	-43.2	-173.3	-176.1	62.2	0	0	0	113.4	G206 L207 L208 I227 I229 D294 I925 L927	L204-G206 PolarHBondContact O-N 2.82Å; L204-L207 PolarHBondContact O-N 2.78Å; L204-L207 VanDerWaalsContact O-N 3.11Å; L204-L208 HydrophobicContact CD1-CG 4.4Å; L204-L208 HydrophobicContact CG-CD1 4.05Å; L204-L208 HydrophobicContact CG-CG 4.35Å; L204-L208 WeakPolarHBondContact O-CG 3.49Å; L204-L208 PolarHBondContact O-N 3.29Å; L204-I227 HydrophobicContact CD1-CD1 4.24Å; L204-I227 HydrophobicContact CD1-CG2 3.84Å; L204-I227 HydrophobicContact CD2-CD1 4Å; L204-I227 HydrophobicContact CD2-CG2 4.36Å; L204-I227 HydrophobicContact CG-CD1 4.44Å; L204-I229 HydrophobicContact CD1-CD1 4.44Å; L204-I229 HydrophobicContact CD2-CD1 4.07Å; L204-D294 HydrophobicContact CB-CB 3.77Å; L204-D294 WeakPolarHBondContact CB-OD2 3.4Å; L204-D294 HydrophobicContact CD2-CB 4.47Å; L204-D294 PolarHBondContact N-O 3.11Å; L204-D294 PolarHBondContact N-OD2 3.07Å; L204-I925 HydrophobicContact CD1-CG2 3.79Å; L204-L927 HydrophobicContact CD1-CD2 4.03Å
205	S	91.1	Very high	89.1	Confident	33 Å²	33	60 Å²	60	23%	0.231	31%	0.305	C	S	.	.	H	α-helix	trans	-60.1	-43.8	-178.3	63.3	0	0	0	0	112.7	H203 L207 L208 D209 D294	H203-S205 PolarHBondContact CD2-OG 2.88Å; H203-S205 PolarHBondContact NE2-OG 2.77Å; H203-S205 PolarHBondContact O-N 3.22Å; S205-L207 VanDerWaalsContact C-N 3.31Å; S205-L207 PolarHBondContact O-N 2.79Å; S205-L208 WeakPolarHBondContact O-CB 3.21Å; S205-L208 PolarHBondContact O-N 2.9Å; S205-D209 PolarHBondContact O-N 2.94Å; S205-D294 PolarHBondContact N-O 2.85Å
206	G	91.1	Very high	88.5	Confident	4 Å²	4	53.9 Å²	53.9	4%	0.041	30%	0.299	C	S	.	.	H	α-helix	trans	-64.7	-32.8	174.9	0	0	0	0	0	113.6	Q200 Y201 H203 L204 D209 I210	Q200-G206 WeakPolarHBondContact O-CA 3.48Å; Y201-G206 WeakPolarHBondContact CD1-O 3.25Å; H203-G206 PolarHBondContact CD2-N 3.47Å; H203-G206 PolarHBondContact NE2-N 3.3Å; H203-G206 PolarHBondContact O-N 3.2Å; L204-G206 PolarHBondContact O-N 2.82Å; G206-D209 PolarHBondContact O-N 2.71Å; G206-I210 PolarHBondContact O-N 3.34Å
207	L	92.4	Very high	87.8	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-71.5	-34.8	173.6	-68.9	177.2	0	0	0	112.7	H203 L204 S205 I210 F211 I925 L927 C947 L949 F954 L956	H203-L207 PolarHBondContact O-N 2.95Å; L204-L207 PolarHBondContact O-N 2.78Å; L204-L207 VanDerWaalsContact O-N 3.11Å; S205-L207 VanDerWaalsContact C-N 3.31Å; S205-L207 PolarHBondContact O-N 2.79Å; L207-I210 HydrophobicContact CD2-CG2 4.48Å; L207-I210 WeakPolarHBondContact O-CG2 3.45Å; L207-F211 WeakPolarHBondContact O-CB 3.41Å; L207-F211 PolarHBondContact O-N 2.71Å; L207-F211 VanDerWaalsContact O-N 3.09Å; L207-I925 HydrophobicContact CD1-CB 4.3Å; L207-I925 HydrophobicContact CD1-CD1 3.58Å; L207-I925 HydrophobicContact CD1-CG2 4.4Å; L207-L927 HydrophobicContact CB-CD1 4.34Å; L207-C947 HydrophobicContact CD1-CB 3.98Å; L207-C947 HydrophobicContact CD2-CB 4.43Å; L207-L949 HydrophobicContact CD1-CD1 4.18Å; L207-F954 HydrophobicContact CD2-CE2 4.49Å; L207-L956 HydrophobicContact CD2-CD2 4.05Å
208	L	91.2	Very high	86.9	Confident	17 Å²	17	52.5 Å²	52.5	9%	0.089	30%	0.299	C	S	.	.	H	α-helix	trans	-65.7	-40	172.2	-73.8	169.4	0	0	0	111.1	L204 S205 F211 K212 V225 I227 E289 L927	L204-L208 HydrophobicContact CD1-CG 4.4Å; L204-L208 HydrophobicContact CG-CD1 4.05Å; L204-L208 HydrophobicContact CG-CG 4.35Å; L204-L208 WeakPolarHBondContact O-CG 3.49Å; L204-L208 PolarHBondContact O-N 3.29Å; S205-L208 WeakPolarHBondContact O-CB 3.21Å; S205-L208 PolarHBondContact O-N 2.9Å; L208-F211 PolarHBondContact O-N 3.35Å; L208-K212 WeakPolarHBondContact O-CB 3.47Å; L208-K212 VanDerWaalsContact O-CG 3.31Å; L208-K212 WeakPolarHBondContact O-CG 3.43Å; L208-K212 PolarHBondContact O-N 2.94Å; L208-V225 HydrophobicContact CD2-CB 3.97Å; L208-V225 HydrophobicContact CD2-CG1 3.92Å; L208-V225 HydrophobicContact CD2-CG2 4.19Å; L208-I227 HydrophobicContact CD1-CD1 4.16Å; L208-I227 HydrophobicContact CD2-CD1 4.06Å; L208-E289 HydrophobicContact CD1-CG 4.4Å; L208-L927 HydrophobicContact CD2-CD1 4.14Å; L208-L927 HydrophobicContact CD2-CD2 3.89Å
209	D	90	Very high	86	Confident	107 Å²	107	52.8 Å²	52.8	57%	0.572	30%	0.298	S	S	*	.	H	α-helix	trans	-62.4	-47.5	178.6	-71	-21.2	0	0	0	112.1	S205 G206 F211 K212 S213	S205-D209 PolarHBondContact O-N 2.94Å; G206-D209 PolarHBondContact O-N 2.71Å; D209-F211 PolarHBondContact O-N 2.76Å; D209-K212 PolarHBondContact O-N 3.43Å; D209-S213 VanDerWaalsContact O-CB 3.23Å; D209-S213 WeakPolarHBondContact O-CB 3.44Å; D209-S213 PolarHBondContact O-N 2.91Å
210	I	91.7	Very high	85.3	Confident	43 Å²	43	56 Å²	56	22%	0.221	31%	0.307	C	S	.	.	H	α-helix	trans	-65.5	-38.7	176.5	-172.2	172.2	0	0	0	111.7	Y201 G206 L207 S213 K214 L956	Y201-I210 HydrophobicContact CD1-CG2 4.41Å; Y201-I210 HydrophobicContact CE1-CB 4.04Å; Y201-I210 HydrophobicContact CE1-CD1 4.36Å; Y201-I210 HydrophobicContact CE1-CG2 4.42Å; Y201-I210 HydrophobicContact CE2-CD1 4.39Å; G206-I210 PolarHBondContact O-N 3.34Å; L207-I210 HydrophobicContact CD2-CG2 4.48Å; L207-I210 WeakPolarHBondContact O-CG2 3.45Å; I210-S213 PolarHBondContact O-N 3.29Å; I210-K214 VanDerWaalsContact O-CB 3.31Å; I210-K214 WeakPolarHBondContact O-CB 3.43Å; I210-K214 PolarHBondContact O-N 3.22Å; I210-L956 HydrophobicContact CD1-CD1 3.92Å
211	F	92.1	Very high	84.6	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.1	-48.9	177.9	-178.1	-126.7	0	0	0	111.3	L207 L208 D209 K214 I215 V225 L927 T929 Q943 L945 F960	L207-F211 WeakPolarHBondContact O-CB 3.41Å; L207-F211 PolarHBondContact O-N 2.71Å; L207-F211 VanDerWaalsContact O-N 3.09Å; L208-F211 PolarHBondContact O-N 3.35Å; D209-F211 PolarHBondContact O-N 2.76Å; F211-K214 PolarHBondContact O-N 3.48Å; F211-I215 HydrophobicContact CD1-CD1 4.2Å; F211-I215 HydrophobicContact CE1-CD1 3.93Å; F211-I215 HydrophobicContact CE2-CD1 4.29Å; F211-I215 HydrophobicContact CE2-CG1 4.5Å; F211-I215 HydrophobicContact CZ-CD1 3.99Å; F211-I215 WeakPolarHBondContact O-CG1 3.48Å; F211-I215 PolarHBondContact O-N 3.29Å; F211-I215 VanDerWaalsContact O-N 3.08Å; F211-V225 HydrophobicContact CD1-CG1 4.13Å; F211-V225 HydrophobicContact CD1-CG2 4.14Å; F211-V225 HydrophobicContact CE1-CG1 3.86Å; F211-V225 HydrophobicContact CE1-CG2 4.07Å; F211-L927 HydrophobicContact CB-CD1 3.82Å; F211-L927 HydrophobicContact CD1-CB 3.92Å; F211-L927 HydrophobicContact CD1-CD1 4.14Å; F211-L927 HydrophobicContact CE1-CB 3.98Å; F211-L927 HydrophobicContact CG-CB 4.26Å; F211-L927 HydrophobicContact CG-CD1 4.06Å; F211-L927 HydrophobicContact CZ-CB 4.38Å; F211-T929 HydrophobicContact CE1-CG2 3.73Å; F211-T929 HydrophobicContact CZ-CG2 3.92Å; F211-Q943 HydrophobicContact CE2-CB 4.17Å; F211-Q943 HydrophobicContact CZ-CB 3.88Å; F211-L945 HydrophobicContact CB-CD2 3.89Å; F211-L945 HydrophobicContact CD2-CB 3.48Å; F211-L945 VanDerWaalsContact CD2-CB 3.48Å; F211-L945 HydrophobicContact CD2-CD2 4Å; F211-L945 HydrophobicContact CD2-CG 4.33Å; F211-L945 HydrophobicContact CE2-CB 3.73Å; F211-L945 HydrophobicContact CG-CB 4.26Å; F211-L945 HydrophobicContact CG-CD2 4.29Å; F211-F960 AromaticContact CD2-CE1 3.98Å; F211-F960 HydrophobicContact CD2-CE1 3.98Å; F211-F960 HydrophobicContact CD2-CZ 4.34Å; F211-F960 AromaticContact CE2-CE1 3.9Å; F211-F960 HydrophobicContact CE2-CE1 3.9Å
212	K	89.3	Confident	84.2	Confident	53 Å²	53	54.5 Å²	54.5	23%	0.23	31%	0.313	C	S	.	.	H	α-helix	trans	-64.6	-42.1	177.3	-71	179.2	176.7	-171.3	0	112.4	L208 D209 K214 I215 L222 E289	L208-K212 WeakPolarHBondContact O-CB 3.47Å; L208-K212 VanDerWaalsContact O-CG 3.31Å; L208-K212 WeakPolarHBondContact O-CG 3.43Å; L208-K212 PolarHBondContact O-N 2.94Å; D209-K212 PolarHBondContact O-N 3.43Å; K212-K214 PolarHBondContact O-N 3.1Å; K212-I215 PolarHBondContact O-N 2.85Å; K212-L222 HydrophobicContact CB-CD1 4.07Å; K212-L222 HydrophobicContact CD-CD1 4.17Å; K212-L222 HydrophobicContact CG-CD1 3.99Å; K212-E289 WeakPolarHBondContact CE-OE2 3.4Å; K212-E289 IonicContact NZ-OE1 2.73Å; K212-E289 PolarHBondContact NZ-OE1 3.21Å; K212-E289 IonicContact NZ-OE2 3Å; K212-E289 PolarHBondContact NZ-OE2 3.35Å
213	S	89.3	Confident	84	Confident	97 Å²	97	53.3 Å²	53.3	68%	0.678	31%	0.309	S	S	*	.	H	α-helix	trans	-60.3	-35.2	175.2	-177.4	0	0	0	0	112.2	D209 I210	D209-S213 VanDerWaalsContact O-CB 3.23Å; D209-S213 WeakPolarHBondContact O-CB 3.44Å; D209-S213 PolarHBondContact O-N 2.91Å; I210-S213 PolarHBondContact O-N 3.29Å
214	K	88.3	Confident	83.8	Confident	88 Å²	88	56.2 Å²	56.2	38%	0.383	33%	0.33	S	S	.	.	H	α-helix	trans	-81.8	-27.3	-177.6	-165.7	150.4	-176.5	172.9	0	113.8	E190 I210 F211 K212 G216 F960	E190-K214 VanDerWaalsContact OE2-CE 3.29Å; E190-K214 WeakPolarHBondContact OE2-CE 3.39Å; E190-K214 IonicContact OE2-NZ 2.56Å; E190-K214 PolarHBondContact OE2-NZ 3.17Å; I210-K214 VanDerWaalsContact O-CB 3.31Å; I210-K214 WeakPolarHBondContact O-CB 3.43Å; I210-K214 PolarHBondContact O-N 3.22Å; F211-K214 PolarHBondContact O-N 3.48Å; K212-K214 PolarHBondContact O-N 3.1Å; K214-G216 PolarHBondContact O-N 3.13Å; K214-F960 HydrophobicContact CB-CE1 4.16Å; K214-F960 HydrophobicContact CB-CZ 3.94Å; K214-F960 HydrophobicContact CD-CE2 3.7Å; K214-F960 HydrophobicContact CD-CZ 3.79Å; K214-F960 HydrophobicContact CG-CD2 4.41Å; K214-F960 HydrophobicContact CG-CE1 4.06Å; K214-F960 HydrophobicContact CG-CE2 3.81Å; K214-F960 HydrophobicContact CG-CZ 3.62Å
215	I	86.8	Confident	83.8	Confident	3 Å²	3	56 Å²	56	2%	0.015	33%	0.329	C	S	.	.	H	α-helix	trans	-58.6	-40.7	169.7	-68.2	167.3	0	0	0	110	F211 K212 C217 T929 V931 R933 Q943 F960	F211-I215 HydrophobicContact CD1-CD1 4.2Å; F211-I215 HydrophobicContact CE1-CD1 3.93Å; F211-I215 HydrophobicContact CE2-CD1 4.29Å; F211-I215 HydrophobicContact CE2-CG1 4.5Å; F211-I215 HydrophobicContact CZ-CD1 3.99Å; F211-I215 WeakPolarHBondContact O-CG1 3.48Å; F211-I215 PolarHBondContact O-N 3.29Å; F211-I215 VanDerWaalsContact O-N 3.08Å; K212-I215 PolarHBondContact O-N 2.85Å; I215-C217 HydrophobicContact CG2-CB 4.11Å; I215-C217 PolarHBondContact O-N 3.18Å; I215-T929 HydrophobicContact CD1-CG2 3.77Å; I215-V931 HydrophobicContact CG2-CB 4.26Å; I215-V931 HydrophobicContact CG2-CG1 4.03Å; I215-V931 HydrophobicContact CG2-CG2 4.5Å; I215-R933 WeakPolarHBondContact O-CD 3.3Å; I215-R933 PolarHBondContact O-NE 3.02Å; I215-Q943 HydrophobicContact CD1-CB 4.37Å; I215-Q943 HydrophobicContact CD1-CG 4.4Å; I215-Q943 HydrophobicContact CG1-CB 4.35Å; I215-Q943 HydrophobicContact CG1-CG 4.22Å; I215-F960 HydrophobicContact CG1-CE1 4.36Å
216	G	76.1	Confident	83.9	Confident	55 Å²	55	56.8 Å²	56.8	57%	0.567	33%	0.331	S	S	*	.			trans	69.2	15.5	168.5	0	0	0	0	0	115.3	K214	K214-G216 PolarHBondContact O-N 3.13Å
217	C	71.1	Confident	84	Confident	15 Å²	15	56.9 Å²	56.9	10%	0.101	33%	0.33	C	S	.	.			trans	-88.1	133.3	179.3	-64.5	0	0	0	0	111.5	I215 L219 V931 P932 R933	I215-C217 HydrophobicContact CG2-CB 4.11Å; I215-C217 PolarHBondContact O-N 3.18Å; C217-L219 PolarHBondContact O-N 2.71Å; C217-V931 HydrophobicContact CB-CG1 4.08Å; C217-P932 PolarHBondContact SG-O 2.57Å; C217-R933 VanDerWaalsContact SG-CB 3.57Å
218	N	68.8	Low	84.1	Confident	152 Å²	152	57 Å²	57	81%	0.813	33%	0.331	S	S	*	.			trans	-75.9	28.1	178.9	-68.4	-22.8	0	0	0	114.1
219	L	68.9	Low	84.2	Confident	49 Å²	49	56.1 Å²	56.1	26%	0.257	33%	0.327	S	S	.	.			trans	-87.1	122	-177.9	-122	147.8	0	0	0	110	C217 L222 P932 P936	C217-L219 PolarHBondContact O-N 2.71Å; L219-L222 HydrophobicContact CB-CD2 4.41Å; L219-P932 HydrophobicContact CD1-CG 3.23Å; L219-P936 HydrophobicContact CD1-CB 3.98Å; L219-P936 HydrophobicContact CD1-CG 4.5Å; L219-P936 HydrophobicContact CG-CB 4.29Å
220	L	71.8	Confident	84.4	Confident	167 Å²	167	52 Å²	52	87%	0.874	30%	0.303	S	S	*	.	S	Bend	trans	-126.7	114.5	178.5	-75.6	161.8	0	0	0	109.1
221	P	70.3	Confident	84.5	Confident	115 Å²	115	50.5 Å²	50.5	75%	0.747	30%	0.295	S	S	*	.	S	Bend	cis	-80.8	151.5	-2.7	32.7	-32.9	0	0	0	113.4
222	L	78.8	Confident	84.6	Confident	48 Å²	48	51.6 Å²	51.6	25%	0.251	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-67.5	147.7	168.7	-78	162.7	0	0	0	110.5	K212 L219 V931	K212-L222 HydrophobicContact CB-CD1 4.07Å; K212-L222 HydrophobicContact CD-CD1 4.17Å; K212-L222 HydrophobicContact CG-CD1 3.99Å; L219-L222 HydrophobicContact CB-CD2 4.41Å; L222-V931 HydrophobicContact CD2-CG1 3.98Å; L222-V931 HydrophobicContact CD2-CG2 4.42Å
223	P	83.6	Confident	84.8	Confident	43 Å²	43	49.5 Å²	49.5	28%	0.279	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-55.1	146.9	169.2	-24.1	34.1	0	0	0	111.8	V931	P223-V931 HydrophobicContact CG-CG2 4.06Å
224	P	86.6	Confident	84.9	Confident	86 Å²	86	47.3 Å²	47.3	56%	0.558	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-61.1	143.5	178.8	26.2	-33.7	0	0	0	110.8	T929	P224-T929 PolarHBondContact O-OG1 2.91Å
225	V	90.6	Very high	84.8	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.006	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-87.8	131	176.4	-177.7	0	0	0	0	109.3	L208 F211 I227 E289 L927	L208-V225 HydrophobicContact CD2-CB 3.97Å; L208-V225 HydrophobicContact CD2-CG1 3.92Å; L208-V225 HydrophobicContact CD2-CG2 4.19Å; F211-V225 HydrophobicContact CD1-CG1 4.13Å; F211-V225 HydrophobicContact CD1-CG2 4.14Å; F211-V225 HydrophobicContact CE1-CG1 3.86Å; F211-V225 HydrophobicContact CE1-CG2 4.07Å; V225-I227 HydrophobicContact CG1-CG1 4.17Å; V225-E289 PolarHBondContact O-N 2.87Å; V225-L927 HydrophobicContact CG1-CB 3.89Å; V225-L927 HydrophobicContact CG1-CD2 4.19Å
226	N	92.5	Very high	84.4	Confident	49 Å²	49	49.6 Å²	49.6	26%	0.262	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	133.4	167.9	-69.4	-33.1	0	0	0	109.1	M106 L927 R928	M106-N226 HydrophobicContact CE-CB 3.85Å; M106-N226 WeakPolarHBondContact CE-ND2 3.34Å; N226-L927 CarbonylContact O-C 3.49Å; N226-L927 WeakPolarHBondContact O-CA 3.41Å; N226-R928 PolarHBondContact N-O 2.93Å; N226-R928 PolarHBondContact O-N 3.5Å
227	I	93.7	Very high	83.8	Confident	6 Å²	6	51.4 Å²	51.4	3%	0.031	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	128.2	-168.6	-50.6	175.9	0	0	0	108.1	L204 L208 V225 I229 L287 I925 L926 L927	L204-I227 HydrophobicContact CD1-CD1 4.24Å; L204-I227 HydrophobicContact CD1-CG2 3.84Å; L204-I227 HydrophobicContact CD2-CD1 4Å; L204-I227 HydrophobicContact CD2-CG2 4.36Å; L204-I227 HydrophobicContact CG-CD1 4.44Å; L208-I227 HydrophobicContact CD1-CD1 4.16Å; L208-I227 HydrophobicContact CD2-CD1 4.06Å; V225-I227 HydrophobicContact CG1-CG1 4.17Å; I227-I229 HydrophobicContact CG2-CD1 3.9Å; I227-I229 HydrophobicContact CG2-CG1 3.68Å; I227-L287 HydrophobicContact CB-CB 4.15Å; I227-L287 PolarHBondContact N-O 3.21Å; I227-L287 PolarHBondContact O-N 3.44Å; I227-I925 HydrophobicContact CG2-CG2 4.42Å; I227-L926 CarbonylContact C-O 3.58Å; I227-L926 VanDerWaalsContact CA-O 3.29Å; I227-L926 WeakPolarHBondContact CA-O 3.32Å; I227-L927 HydrophobicContact CB-CD2 4.26Å; I227-L927 HydrophobicContact CD1-CD2 4.36Å; I227-L927 HydrophobicContact CG1-CD2 3.81Å; I227-L927 HydrophobicContact CG2-CD2 3.88Å
228	A	94	Very high	83.6	Confident	2 Å²	2	51.7 Å²	51.7	2%	0.017	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	132.5	166.2	0	0	0	0	0	109	F110 W284 P285 I925 L926	F110-A228 HydrophobicContact CE2-CB 3.98Å; F110-A228 HydrophobicContact CZ-CB 4.25Å; A228-W284 CarbonylContact C-O 3.58Å; A228-W284 VanDerWaalsContact CA-O 3.27Å; A228-W284 WeakPolarHBondContact CA-O 3.48Å; A228-P285 WeakPolarHBondContact CB-O 3.5Å; A228-I925 CarbonylContact O-C 3.58Å; A228-L926 HydrophobicContact CB-CB 4.24Å; A228-L926 HydrophobicContact CB-CD2 4.41Å; A228-L926 PolarHBondContact N-O 3.43Å; A228-L926 PolarHBondContact O-N 3.01Å
229	I	94.3	Very high	83	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	134.2	-174.9	-54.4	-179.8	0	0	0	108.7	L204 I227 Y231 T283 W284 L287 L301 E924 I925	L204-I229 HydrophobicContact CD1-CD1 4.44Å; L204-I229 HydrophobicContact CD2-CD1 4.07Å; I227-I229 HydrophobicContact CG2-CD1 3.9Å; I227-I229 HydrophobicContact CG2-CG1 3.68Å; I229-Y231 HydrophobicContact CG2-CD1 3.69Å; I229-Y231 HydrophobicContact CG2-CE1 3.38Å; I229-T283 CarbonylContact O-C 3.51Å; I229-T283 VanDerWaalsContact O-CA 3.32Å; I229-T283 WeakPolarHBondContact O-CA 3.16Å; I229-W284 HydrophobicContact CB-CB 4.47Å; I229-W284 HydrophobicContact CB-CE3 4.09Å; I229-W284 HydrophobicContact CG2-CE3 4.05Å; I229-W284 HydrophobicContact CG2-CZ3 4.35Å; I229-W284 PolarHBondContact N-O 2.83Å; I229-W284 PolarHBondContact O-N 3.05Å; I229-L287 HydrophobicContact CD1-CD1 4.03Å; I229-L287 HydrophobicContact CG1-CD1 4.43Å; I229-L301 HydrophobicContact CD1-CD1 3.76Å; I229-L301 HydrophobicContact CD1-CD2 4.05Å; I229-L301 HydrophobicContact CG2-CD1 4.38Å; I229-E924 WeakPolarHBondContact CA-O 3.14Å; I229-I925 HydrophobicContact CG1-CG1 4.35Å; I229-I925 HydrophobicContact CG1-CG2 4.46Å; I229-I925 HydrophobicContact CG2-CG1 4.15Å
230	R	93.9	Very high	82.2	Confident	21 Å²	21	52.7 Å²	52.7	8%	0.079	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	118.1	173.4	175.8	178.5	162.8	144.6	8.9	109.5	F110 A281 T282 T283 E870 E924	F110-R230 HydrophobicContact CD1-CB 4.04Å; F110-R230 HydrophobicContact CD2-CB 3.91Å; F110-R230 HydrophobicContact CE1-CB 4Å; F110-R230 HydrophobicContact CE2-CB 3.86Å; F110-R230 HydrophobicContact CG-CB 4.01Å; F110-R230 HydrophobicContact CG-CG 4.47Å; F110-R230 HydrophobicContact CZ-CB 3.91Å; F110-R230 PolarHBondContact O-NH1 3.18Å; F110-R230 VanDerWaalsContact O-NH1 3.13Å; R230-A281 HydrophobicContact CG-CB 4.27Å; R230-T282 WeakPolarHBondContact CA-O 3.38Å; R230-T283 HydrophobicContact CB-CG2 4.43Å; R230-E870 IonicContact CZ-OE1 2.82Å; R230-E870 IonicContact CZ-OE2 3.56Å; R230-E870 IonicContact NH1-OE1 2.85Å; R230-E870 PolarHBondContact NH1-OE1 2.7Å; R230-E870 IonicContact NH1-OE2 3.14Å; R230-E870 PolarHBondContact NH1-OE2 2.9Å; R230-E870 VanDerWaalsContact NH1-OE2 3.17Å; R230-E870 IonicContact NH2-OE1 3.25Å; R230-E870 PolarHBondContact NH2-OE1 2.91Å; R230-E870 IonicContact NH2-OE2 2.68Å; R230-E924 HydrophobicContact CB-CB 4.43Å; R230-E924 PolarHBondContact N-O 3.16Å; R230-E924 IonicContact NE-OE2 3.75Å; R230-E924 PolarHBondContact O-N 2.84Å
231	Y	94.4	Very high	81.2	Confident	11 Å²	11	46.1 Å²	46.1	4%	0.043	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	135	172.7	-70.2	-3.2	0	0	0	109.2	I229 A281 T282 W284 L301 P920 R923	I229-Y231 HydrophobicContact CG2-CD1 3.69Å; I229-Y231 HydrophobicContact CG2-CE1 3.38Å; Y231-A281 CarbonylContact O-C 3.58Å; Y231-A281 VanDerWaalsContact O-CA 3.31Å; Y231-A281 WeakPolarHBondContact O-CA 3.23Å; Y231-T282 PolarHBondContact N-O 3.32Å; Y231-T282 PolarHBondContact O-N 3.2Å; Y231-W284 HydrophobicContact CD2-CH2 4.1Å; Y231-W284 AromaticContact CD2-CZ3 3.96Å; Y231-W284 HydrophobicContact CD2-CZ3 3.96Å; Y231-W284 HydrophobicContact CG-CZ3 4.01Å; Y231-L301 HydrophobicContact CE2-CB 3.83Å; Y231-L301 HydrophobicContact CE2-CD1 4.06Å; Y231-L301 WeakPolarHBondContact OH-CD1 3.4Å; Y231-P920 HydrophobicContact CG-CB 4.47Å; Y231-R923 HydrophobicContact CD1-CB 3.7Å; Y231-R923 HydrophobicContact CD1-CG 3.47Å; Y231-R923 VanDerWaalsContact CD1-CG 3.47Å; Y231-R923 HydrophobicContact CE1-CB 3.63Å; Y231-R923 HydrophobicContact CE1-CG 3.48Å; Y231-R923 VanDerWaalsContact CE1-CG 3.48Å; Y231-R923 HydrophobicContact CG-CG 4.1Å
232	T	93.8	Very high	80.5	Confident	22 Å²	22	45.8 Å²	45.8	14%	0.135	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	122.9	179.2	-55.6	0	0	0	0	109.8	H279 L280 P920 A921 G922	T232-H279 HydrophobicContact CG2-CB 4.31Å; T232-L280 CarbonylContact C-O 3.56Å; T232-L280 WeakPolarHBondContact CA-O 3.36Å; T232-P920 CarbonylContact O-C 3.51Å; T232-A921 PolarHBondContact O-N 3.26Å; T232-G922 PolarHBondContact N-O 3.47Å; T232-G922 PolarHBondContact O-N 2.84Å
233	Y	93.1	Very high	79.8	Confident	10 Å²	10	45.3 Å²	45.3	4%	0.039	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	134.9	176.1	-57.2	-88.3	0	0	0	108.8	H279 L280 T282 P303 F917 P918 P920	Y233-H279 WeakPolarHBondContact O-CA 3.4Å; Y233-L280 PolarHBondContact N-O 2.82Å; Y233-L280 PolarHBondContact O-N 2.85Å; Y233-T282 HydrophobicContact CD2-CG2 4.28Å; Y233-T282 HydrophobicContact CE2-CG2 4.02Å; Y233-P303 HydrophobicContact CE2-CB 3.79Å; Y233-P303 HydrophobicContact CE2-CG 4.27Å; Y233-P303 WeakPolarHBondContact OH-CG 3.49Å; Y233-F917 HydrophobicContact CD1-CB 4.06Å; Y233-F917 HydrophobicContact CE1-CB 4.04Å; Y233-F917 HydrophobicContact CG-CD1 4.49Å; Y233-P918 HydrophobicContact CD1-CG 4.49Å; Y233-P918 VanDerWaalsContact CD1-O 3.26Å; Y233-P918 WeakPolarHBondContact CD1-O 3.39Å; Y233-P918 VanDerWaalsContact CE1-O 3.27Å; Y233-P918 WeakPolarHBondContact CE1-O 3.36Å; Y233-P920 HydrophobicContact CD1-CB 4.28Å; Y233-P920 HydrophobicContact CE1-CB 3.85Å; Y233-P920 HydrophobicContact CE1-CG 4.44Å
234	I	91.1	Very high	78.5	Confident	50 Å²	50	46.3 Å²	46.3	26%	0.256	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	127.9	-177.5	-57.7	176.9	0	0	0	108.5	Q236 E277 L278 A921	I234-Q236 HydrophobicContact CG2-CG 3.74Å; I234-E277 HydrophobicContact CG2-CB 4.06Å; I234-E277 HydrophobicContact CG2-CG 4.25Å; I234-L278 WeakPolarHBondContact CA-O 3.44Å; I234-A921 HydrophobicContact CB-CB 4.4Å; I234-A921 HydrophobicContact CD1-CB 3.5Å; I234-A921 VanDerWaalsContact CD1-CB 3.5Å; I234-A921 HydrophobicContact CG1-CB 3.7Å
235	L	86.4	Confident	77	Confident	8 Å²	8	43.9 Å²	43.9	4%	0.042	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	112.3	169.3	-167.9	71.6	0	0	0	108.1	W238 E277 L278 L888 F889 A892	L235-W238 HydrophobicContact CD2-CD2 4.21Å; L235-W238 HydrophobicContact CD2-CE3 4.37Å; L235-E277 CarbonylContact O-C 3.53Å; L235-E277 VanDerWaalsContact O-CA 3.32Å; L235-E277 WeakPolarHBondContact O-CA 3.34Å; L235-L278 HydrophobicContact CB-CB 3.9Å; L235-L278 HydrophobicContact CD2-CB 4.39Å; L235-L278 HydrophobicContact CD2-CD2 4.32Å; L235-L278 PolarHBondContact N-O 3.32Å; L235-L278 PolarHBondContact O-N 3.34Å; L235-L888 HydrophobicContact CD2-CB 4.11Å; L235-F889 HydrophobicContact CB-CE1 3.88Å; L235-F889 HydrophobicContact CB-CZ 3.91Å; L235-F889 HydrophobicContact CD1-CD1 3.98Å; L235-F889 HydrophobicContact CD1-CE1 4.15Å; L235-F889 HydrophobicContact CD1-CG 4.42Å; L235-A892 HydrophobicContact CD1-CB 3.33Å
236	Q	78	Confident	75	Confident	131 Å²	131	48.6 Å²	48.6	61%	0.612	25%	0.251	S	S	*	.			trans	-98.9	-35.1	179	-60.4	-174.3	-41.3	0	0	111.7	I234 E277	I234-Q236 HydrophobicContact CG2-CG 3.74Å; Q236-E277 HydrophobicContact CG-CG 4.2Å; Q236-E277 PolarHBondContact NE2-OE1 3.2Å
237	D	64.9	Low	72.8	Confident	93 Å²	93	51.5 Å²	51.5	50%	0.497	27%	0.273	S	S	.	.			trans	-102.2	104.7	-176.5	-92.8	-47.2	0	0	0	111.7	Q239	D237-Q239 VanDerWaalsContact C-N 3.26Å; D237-Q239 HydrophobicContact CB-CG 3.93Å; D237-Q239 PolarHBondContact O-N 2.85Å; D237-Q239 PolarHBondContact OD1-NE2 2.61Å; D237-Q239 PolarHBondContact OD2-NE2 3.43Å
238	W	65.5	Low	70.6	Confident	22 Å²	22	53.9 Å²	53.9	8%	0.083	29%	0.289	C	S	.	.			trans	-91.3	38.8	172.8	-62.2	78	0	0	0	112	L235 Q240 S241 I275 L278 K842 F843 L888	L235-W238 HydrophobicContact CD2-CD2 4.21Å; L235-W238 HydrophobicContact CD2-CE3 4.37Å; W238-Q240 PolarHBondContact O-N 2.58Å; W238-S241 PolarHBondContact O-N 2.89Å; W238-I275 HydrophobicContact CZ2-CG2 3.93Å; W238-L278 HydrophobicContact CH2-CB 4.16Å; W238-L278 HydrophobicContact CH2-CD1 3.92Å; W238-L278 HydrophobicContact CH2-CD2 3.81Å; W238-L278 HydrophobicContact CH2-CG 4.18Å; W238-L278 HydrophobicContact CZ2-CB 3.55Å; W238-L278 HydrophobicContact CZ2-CD1 3.88Å; W238-L278 HydrophobicContact CZ2-CD2 4.09Å; W238-L278 HydrophobicContact CZ2-CG 4.04Å; W238-K842 HydrophobicContact CB-CD 4.44Å; W238-K842 HydrophobicContact CD2-CD 3.62Å; W238-K842 HydrophobicContact CD2-CG 4.3Å; W238-K842 HydrophobicContact CE3-CB 3.76Å; W238-K842 HydrophobicContact CE3-CD 3.37Å; W238-K842 HydrophobicContact CE3-CG 3.61Å; W238-K842 HydrophobicContact CG-CD 4.16Å; W238-K842 HydrophobicContact CH2-CB 4.39Å; W238-K842 HydrophobicContact CH2-CD 4.1Å; W238-K842 HydrophobicContact CZ2-CD 4.32Å; W238-K842 HydrophobicContact CZ3-CB 3.54Å; W238-K842 HydrophobicContact CZ3-CD 3.66Å; W238-K842 HydrophobicContact CZ3-CG 3.9Å; W238-F843 HydrophobicContact CH2-CE2 4.36Å; W238-L888 HydrophobicContact CE3-CD1 4.35Å; W238-L888 HydrophobicContact CZ3-CD1 3.73Å
239	Q	56.3	Low	68.2	Low	120 Å²	120	58.1 Å²	58.1	56%	0.561	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	2.8	-167.2	-69.3	177	1	0	0	116.5	D237	D237-Q239 VanDerWaalsContact C-N 3.26Å; D237-Q239 HydrophobicContact CB-CG 3.93Å; D237-Q239 PolarHBondContact O-N 2.85Å; D237-Q239 PolarHBondContact OD1-NE2 2.61Å; D237-Q239 PolarHBondContact OD2-NE2 3.43Å
240	Q	52.4	Low	66.1	Low	102 Å²	102	66.9 Å²	66.9	48%	0.477	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-26.4	179.6	-56.2	-159.2	-70.7	0	0	113.9	W238 N891	W238-Q240 PolarHBondContact O-N 2.58Å; Q240-N891 HydrophobicContact CG-CB 4.23Å; Q240-N891 PolarHBondContact NE2-ND2 3.48Å; Q240-N891 PolarHBondContact OE1-ND2 3.29Å
241	S	51.8	Low	63.8	Low	28 Å²	28	73.3 Å²	73.3	20%	0.196	39%	0.386	C	S	.	.	S	Bend	trans	-108.8	102.7	178.2	-51.3	0	0	0	0	106.3	W238 W243	W238-S241 PolarHBondContact O-N 2.89Å; S241-W243 PolarHBondContact O-N 2.97Å
242	S	55	Low	61.5	Low	108 Å²	108	76.1 Å²	76.1	76%	0.755	40%	0.404	S	S	*	.			trans	-57.3	124	165.6	51.4	0	0	0	0	107	P244	S242-P244 VanDerWaalsContact O-N 3.1Å
243	W	63.4	Low	59.2	Low	39 Å²	39	82.1 Å²	82.1	15%	0.148	43%	0.434	C	S	.	.			trans	-45.5	123.2	170.6	179.5	-119.9	0	0	0	107.7	S241 Q245 A270 P274 T834 S838	S241-W243 PolarHBondContact O-N 2.97Å; W243-Q245 PolarHBondContact O-N 3.41Å; W243-A270 HydrophobicContact CZ2-CB 4.14Å; W243-A270 PolarHBondContact NE1-O 2.9Å; W243-P274 HydrophobicContact CE3-CG 4.38Å; W243-P274 HydrophobicContact CH2-CG 3.51Å; W243-P274 HydrophobicContact CZ2-CG 4.07Å; W243-P274 VanDerWaalsContact CZ3-CD 3.47Å; W243-P274 HydrophobicContact CZ3-CG 3.74Å; W243-T834 WeakPolarHBondContact CH2-O 3.45Å; W243-S838 WeakPolarHBondContact CZ3-OG 3.41Å
244	P	55.8	Low	57.1	Low	64 Å²	64	85.4 Å²	85.4	42%	0.416	45%	0.452	S	S	.	.	S	Bend	trans	-67.4	-3.9	-163.1	25.3	-34.4	0	0	0	113.5	S242 Q246	S242-P244 VanDerWaalsContact O-N 3.1Å; P244-Q246 PolarHBondContact O-N 3.42Å; P244-Q246 VanDerWaalsContact O-N 3.09Å
245	Q	55.8	Low	54.4	Low	35 Å²	35	83.8 Å²	83.8	16%	0.164	45%	0.448	C	S	.	.			trans	-73.6	98	167.5	-66.9	-157.7	-19.1	0	0	109.9	W243 V258 F268 G269 A270	W243-Q245 PolarHBondContact O-N 3.41Å; Q245-V258 HydrophobicContact CB-CB 4.11Å; Q245-V258 HydrophobicContact CB-CG1 3.92Å; Q245-V258 HydrophobicContact CB-CG2 3.99Å; Q245-V258 VanDerWaalsContact CD-CG1 3.42Å; Q245-V258 HydrophobicContact CG-CB 4.32Å; Q245-V258 HydrophobicContact CG-CG1 3.83Å; Q245-V258 HydrophobicContact CG-CG2 3.94Å; Q245-F268 PolarHBondContact NE2-O 3.28Å; Q245-G269 VanDerWaalsContact NE2-CA 3.31Å; Q245-A270 PolarHBondContact NE2-O 3.47Å; Q245-A270 PolarHBondContact OE1-O 3.45Å
246	Q	48	Very low	52.5	Low	100 Å²	100	85.6 Å²	85.6	47%	0.467	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-60.5	138.1	167.3	-72.8	162.6	-65	0	0	109.4	P244 E257 V258	P244-Q246 PolarHBondContact O-N 3.42Å; P244-Q246 VanDerWaalsContact O-N 3.09Å; Q246-E257 PolarHBondContact NE2-OE2 3.14Å; Q246-E257 VanDerWaalsContact NE2-OE2 3.07Å; Q246-E257 PolarHBondContact OE1-OE1 2.89Å; Q246-E257 PolarHBondContact OE1-OE2 3.21Å; Q246-V258 WeakPolarHBondContact O-CB 3.29Å
247	P	46.7	Very low	50.6	Low	110 Å²	110	84.2 Å²	84.2	71%	0.714	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-59.6	147.7	176.3	25.1	-32.9	0	0	0	110.4	D249	P247-D249 PolarHBondContact O-N 2.91Å
248	P	47.9	Very low	49.4	Very low	56 Å²	56	82.1 Å²	82.1	36%	0.364	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-58.6	129.5	-177.7	20.6	-31	0	0	0	110.9	F250 V258	P248-F250 HydrophobicContact CG-CE2 4.5Å; P248-F250 HydrophobicContact CG-CZ 4.3Å; P248-F250 WeakPolarHBondContact O-CD2 3.33Å; P248-F250 PolarHBondContact O-N 2.86Å; P248-F250 VanDerWaalsContact O-N 3.15Å; P248-V258 WeakPolarHBondContact CA-O 3.35Å; P248-V258 WeakPolarHBondContact CB-O 3.23Å
249	D	43.7	Very low	48.4	Very low	90 Å²	90	83.1 Å²	83.1	48%	0.481	47%	0.469	S	S	.	.			trans	-77	100.1	177.2	-164.7	3.1	0	0	0	109.9	P247 D251 T252	P247-D249 PolarHBondContact O-N 2.91Å; D249-D251 PolarHBondContact O-N 3.42Å; D249-D251 VanDerWaalsContact O-N 3.13Å; D249-T252 PolarHBondContact O-N 3.21Å
250	F	49.2	Very low	47.7	Very low	185 Å²	185	78.8 Å²	78.8	81%	0.811	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-15.7	-175.8	-68	-81.7	0	0	0	113.8	P248 T252	P248-F250 HydrophobicContact CG-CE2 4.5Å; P248-F250 HydrophobicContact CG-CZ 4.3Å; P248-F250 WeakPolarHBondContact O-CD2 3.33Å; P248-F250 PolarHBondContact O-N 2.86Å; P248-F250 VanDerWaalsContact O-N 3.15Å; F250-T252 VanDerWaalsContact C-N 3.35Å
251	D	46.3	Very low	47.6	Very low	156 Å²	156	74.7 Å²	74.7	83%	0.834	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-13.2	-178.3	-82.7	-16.1	0	0	0	113.4	D249	D249-D251 PolarHBondContact O-N 3.42Å; D249-D251 VanDerWaalsContact O-N 3.13Å
252	T	47.1	Very low	47.9	Very low	69 Å²	69	77.8 Å²	77.8	42%	0.423	45%	0.45	S	S	.	.			trans	-111.5	99.7	179.4	-26.1	0	0	0	0	110.3	D249 F250 L254 G255	D249-T252 PolarHBondContact O-N 3.21Å; F250-T252 VanDerWaalsContact C-N 3.35Å; T252-L254 PolarHBondContact O-N 3.27Å; T252-G255 PolarHBondContact O-N 3.2Å
253	L	45.4	Very low	48.3	Very low	149 Å²	149	74 Å²	74	78%	0.78	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.3	-20.4	177.3	-86.5	161.2	0	0	0	114.3
254	L	48	Very low	48.3	Very low	79 Å²	79	73 Å²	73	41%	0.414	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-149.3	32.9	178.2	-69.8	170.4	0	0	0	112.8	T252 V261 F263	T252-L254 PolarHBondContact O-N 3.27Å; L254-V261 WeakPolarHBondContact CD2-O 3.22Å; L254-F263 HydrophobicContact CD1-CE2 4.26Å; L254-F263 HydrophobicContact CD2-CD2 3.84Å; L254-F263 HydrophobicContact CD2-CE2 3.51Å; L254-F263 HydrophobicContact CD2-CZ 4.24Å
255	G	35.1	Very low	49.2	Very low	16 Å²	16	74 Å²	74	17%	0.165	43%	0.425	C	S	.	.			trans	-98.4	124.7	-177.5	0	0	0	0	0	113	T252 E257	T252-G255 PolarHBondContact O-N 3.2Å; G255-E257 PolarHBondContact O-N 3.35Å
256	G	45.8	Very low	50.3	Low	46 Å²	46	72.8 Å²	72.8	47%	0.474	42%	0.419	S	S	.	.			trans	-64.9	115.7	178.5	0	0	0	0	0	113.4
257	E	38.9	Very low	51.7	Low	102 Å²	102	69.1 Å²	69.1	48%	0.477	40%	0.404	S	S	.	.	S	Bend	trans	-171.3	150.2	143.6	-99.4	166.3	-158	0	0	104.3	Q246 G255 G259 G260	Q246-E257 PolarHBondContact NE2-OE2 3.14Å; Q246-E257 VanDerWaalsContact NE2-OE2 3.07Å; Q246-E257 PolarHBondContact OE1-OE1 2.89Å; Q246-E257 PolarHBondContact OE1-OE2 3.21Å; G255-E257 PolarHBondContact O-N 3.35Å; E257-G259 PolarHBondContact O-N 2.95Å; E257-G260 PolarHBondContact O-N 2.68Å
258	V	39.9	Very low	53.3	Low	48 Å²	48	64.8 Å²	64.8	29%	0.291	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-34	122.3	-156	-176.9	0	0	0	0	115.7	Q245 Q246 P248 L322	Q245-V258 HydrophobicContact CB-CB 4.11Å; Q245-V258 HydrophobicContact CB-CG1 3.92Å; Q245-V258 HydrophobicContact CB-CG2 3.99Å; Q245-V258 VanDerWaalsContact CD-CG1 3.42Å; Q245-V258 HydrophobicContact CG-CB 4.32Å; Q245-V258 HydrophobicContact CG-CG1 3.83Å; Q245-V258 HydrophobicContact CG-CG2 3.94Å; Q246-V258 WeakPolarHBondContact O-CB 3.29Å; P248-V258 WeakPolarHBondContact CA-O 3.35Å; P248-V258 WeakPolarHBondContact CB-O 3.23Å; V258-L322 HydrophobicContact CG1-CD1 4.03Å
259	G	43.6	Very low	54.7	Low	43 Å²	43	62.2 Å²	62.2	44%	0.443	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.9	-13.1	-172.1	0	0	0	0	0	113.8	E257 V261	E257-G259 PolarHBondContact O-N 2.95Å; G259-V261 PolarHBondContact O-N 3.28Å
260	G	41.9	Very low	56.4	Low	29 Å²	29	57.9 Å²	57.9	30%	0.299	33%	0.334	S	S	.	.			trans	-66.3	108.1	166.1	0	0	0	0	0	111.3	E257 E262	E257-G260 PolarHBondContact O-N 2.68Å; G260-E262 PolarHBondContact O-N 2.93Å
261	V	50.8	Low	57.5	Low	17 Å²	17	52 Å²	52	10%	0.103	32%	0.315	C	S	.	.			trans	-77	83.2	-174.9	179.1	0	0	0	0	110.4	L254 G259 F263 M470	L254-V261 WeakPolarHBondContact CD2-O 3.22Å; G259-V261 PolarHBondContact O-N 3.28Å; V261-F263 PolarHBondContact O-N 2.83Å; V261-M470 HydrophobicContact CB-CE 3.82Å; V261-M470 HydrophobicContact CG1-CB 3.89Å; V261-M470 HydrophobicContact CG1-CE 3.28Å; V261-M470 HydrophobicContact CG1-CG 3.79Å; V261-M470 HydrophobicContact CG1-SD 4.33Å; V261-M470 HydrophobicContact CG2-CE 3.42Å; V261-M470 VanDerWaalsContact CG2-CE 3.42Å
262	E	57.7	Low	58.9	Low	93 Å²	93	50.2 Å²	50.2	44%	0.435	30%	0.302	S	S	.	.			trans	-71.4	121.2	163.7	-72.3	-172	173.5	0	0	109.5	G260 G264 N265	G260-E262 PolarHBondContact O-N 2.93Å; E262-G264 PolarHBondContact O-N 3.12Å; E262-G264 VanDerWaalsContact O-N 3.07Å; E262-N265 PolarHBondContact O-N 2.82Å; E262-N265 PolarHBondContact OE2-ND2 2.86Å
263	F	62.9	Low	60.4	Low	27 Å²	27	49.4 Å²	49.4	12%	0.118	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	117.5	174.3	-65.4	-64.7	0	0	0	110.2	L254 V261 M406 I410 Y413	L254-F263 HydrophobicContact CD1-CE2 4.26Å; L254-F263 HydrophobicContact CD2-CD2 3.84Å; L254-F263 HydrophobicContact CD2-CE2 3.51Å; L254-F263 HydrophobicContact CD2-CZ 4.24Å; V261-F263 PolarHBondContact O-N 2.83Å; F263-M406 HydrophobicContact CZ-SD 3.92Å; F263-I410 HydrophobicContact CE1-CD1 4.42Å; F263-I410 HydrophobicContact CE1-CG1 3.54Å; F263-I410 HydrophobicContact CE2-CG1 4.41Å; F263-I410 HydrophobicContact CZ-CD1 4.43Å; F263-I410 HydrophobicContact CZ-CG1 3.45Å; F263-I410 VanDerWaalsContact CZ-CG1 3.45Å; F263-Y413 VanDerWaalsContact C-CZ 3.46Å; F263-Y413 HydrophobicContact CB-CD1 3.68Å; F263-Y413 HydrophobicContact CB-CD2 3.46Å; F263-Y413 VanDerWaalsContact CB-CD2 3.46Å; F263-Y413 HydrophobicContact CB-CE1 3.76Å; F263-Y413 HydrophobicContact CB-CE2 3.53Å; F263-Y413 HydrophobicContact CB-CG 3.53Å; F263-Y413 HydrophobicContact CD2-CG 4.37Å; F263-Y413 HydrophobicContact CG-CD1 4.26Å; F263-Y413 HydrophobicContact CG-CD2 4.33Å; F263-Y413 HydrophobicContact CG-CG 4.05Å; F263-Y413 WeakPolarHBondContact O-CE2 3.44Å; F263-Y413 PolarHBondContact O-OH 3.48Å; F263-Y413 VanDerWaalsContact O-OH 3.07Å
264	G	63.3	Low	62.2	Low	20 Å²	20	42.3 Å²	42.3	21%	0.206	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	112.3	-7.9	177.9	0	0	0	0	0	115.8	E262 Y413 L466	E262-G264 PolarHBondContact O-N 3.12Å; E262-G264 VanDerWaalsContact O-N 3.07Å; G264-Y413 WeakPolarHBondContact CA-OH 3.3Å; G264-Y413 PolarHBondContact N-OH 3.43Å; G264-L466 WeakPolarHBondContact O-CD1 3.34Å
265	N	74.8	Confident	64	Low	85 Å²	85	38.7 Å²	38.7	46%	0.455	24%	0.237	S	C	.	.			trans	-115.9	133.3	173.7	-73.2	-29	0	0	0	110.1	E262	E262-N265 PolarHBondContact O-N 2.82Å; E262-N265 PolarHBondContact OE2-ND2 2.86Å
266	L	78.9	Confident	66.3	Low	9 Å²	9	39.9 Å²	39.9	5%	0.047	24%	0.243	C	C	.	.			trans	-76.8	137	170.6	-71	171.8	0	0	0	109.4	L323 L466 L774 A777 A778 K781	L266-L323 HydrophobicContact CB-CD1 3.82Å; L266-L323 HydrophobicContact CD1-CD1 3.71Å; L266-L323 HydrophobicContact CG-CD1 4.26Å; L266-L466 HydrophobicContact CD1-CD2 4.03Å; L266-L466 HydrophobicContact CD2-CD2 3.55Å; L266-L466 HydrophobicContact CG-CD2 3.59Å; L266-L774 HydrophobicContact CD1-CD1 4.27Å; L266-L774 HydrophobicContact CD2-CD1 3.84Å; L266-A777 HydrophobicContact CD1-CB 3.69Å; L266-A778 HydrophobicContact CD1-CB 4.34Å; L266-K781 HydrophobicContact CB-CG 4.42Å; L266-K781 WeakPolarHBondContact O-CE 3.08Å
267	P	76.9	Confident	68.3	Low	22 Å²	22	38.9 Å²	38.9	14%	0.143	23%	0.226	C	C	.	.			trans	-66	148.9	174.1	31	-34.6	0	0	0	109.4	L322 L323 F326 M470	P267-L322 HydrophobicContact CB-CB 4.06Å; P267-L322 HydrophobicContact CB-CD1 4.35Å; P267-L322 HydrophobicContact CG-CB 4.4Å; P267-L323 WeakPolarHBondContact O-CA 3.18Å; P267-L323 WeakPolarHBondContact O-CB 3.27Å; P267-L323 PolarHBondContact O-N 2.96Å; P267-F326 HydrophobicContact CB-CE2 4.38Å; P267-F326 HydrophobicContact CG-CD1 3.92Å; P267-F326 HydrophobicContact CG-CD2 3.62Å; P267-F326 HydrophobicContact CG-CE1 3.84Å; P267-F326 HydrophobicContact CG-CE2 3.48Å; P267-F326 VanDerWaalsContact CG-CE2 3.48Å; P267-F326 HydrophobicContact CG-CG 3.8Å; P267-F326 HydrophobicContact CG-CZ 3.6Å; P267-M470 HydrophobicContact CG-CE 4.3Å; P267-M470 HydrophobicContact CG-SD 4.41Å
268	F	81.9	Confident	70.7	Confident	19 Å²	19	34 Å²	34	8%	0.083	20%	0.203	C	C	.	.			trans	-144.3	139.3	-175	-179.9	-94.1	0	0	0	110.9	Q245 L323 K781 L782 E785 E830 I833 T834	Q245-F268 PolarHBondContact NE2-O 3.28Å; F268-L323 HydrophobicContact CD2-CB 4.42Å; F268-L323 HydrophobicContact CD2-CD2 4.28Å; F268-K781 HydrophobicContact CB-CG 4.46Å; F268-K781 HydrophobicContact CD2-CG 4.49Å; F268-L782 HydrophobicContact CE2-CD2 3.9Å; F268-E785 HydrophobicContact CD1-CB 4.35Å; F268-E785 HydrophobicContact CD1-CG 3.67Å; F268-E785 HydrophobicContact CD2-CG 4.05Å; F268-E785 HydrophobicContact CE1-CB 3.9Å; F268-E785 HydrophobicContact CE1-CG 3.75Å; F268-E785 HydrophobicContact CE2-CB 4.27Å; F268-E785 HydrophobicContact CE2-CG 4.11Å; F268-E785 HydrophobicContact CG-CG 3.83Å; F268-E785 HydrophobicContact CZ-CB 3.86Å; F268-E785 HydrophobicContact CZ-CG 3.98Å; F268-E830 HydrophobicContact CD2-CG 4.12Å; F268-E830 HydrophobicContact CE2-CB 4.14Å; F268-E830 HydrophobicContact CE2-CG 3.64Å; F268-E830 HydrophobicContact CZ-CG 4.12Å; F268-I833 HydrophobicContact CE1-CG2 4.01Å; F268-I833 HydrophobicContact CZ-CB 3.96Å; F268-I833 HydrophobicContact CZ-CD1 4.23Å; F268-I833 HydrophobicContact CZ-CG2 3.6Å; F268-T834 HydrophobicContact CE1-CG2 4.36Å; F268-T834 HydrophobicContact CZ-CG2 4.46Å
269	G	76.6	Confident	73.2	Confident	2 Å²	2	33.5 Å²	33.5	2%	0.021	20%	0.198	C	C	.	.	S	Bend	trans	111.6	168.3	169.8	0	0	0	0	0	114	Q245 L322 E830 T834	Q245-G269 VanDerWaalsContact NE2-CA 3.31Å; G269-L322 WeakPolarHBondContact O-CB 3.44Å; G269-L322 VanDerWaalsContact O-CG 3.31Å; G269-L322 WeakPolarHBondContact O-CG 3.48Å; G269-L322 PolarHBondContact O-N 3.18Å; G269-E830 PolarHBondContact N-OE1 2.69Å; G269-T834 VanDerWaalsContact CA-CG2 3.49Å
270	A	79.4	Confident	75.6	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.176	C	C	.	.	B	Isolated β-bridge	trans	-83.2	132.5	-178.5	0	0	0	0	0	111.5	W243 Q245 E272 L319 Q320 T834	W243-A270 HydrophobicContact CZ2-CB 4.14Å; W243-A270 PolarHBondContact NE1-O 2.9Å; Q245-A270 PolarHBondContact NE2-O 3.47Å; Q245-A270 PolarHBondContact OE1-O 3.45Å; A270-E272 WeakPolarHBondContact CB-O 3.45Å; A270-E272 PolarHBondContact O-N 3.39Å; A270-L319 HydrophobicContact CB-CD2 3.67Å; A270-Q320 WeakPolarHBondContact CA-O 3.37Å; A270-T834 HydrophobicContact CB-CG2 4.35Å
271	C	71.8	Confident	78.1	Confident	61 Å²	61	30.1 Å²	30.1	41%	0.412	16%	0.163	S	C	.	.	S	Bend	trans	-67.2	-25.9	178	-62.2	0	0	0	0	112.7	Q320 L322	C271-Q320 PolarHBondContact N-O 3.38Å; C271-L322 WeakPolarHBondContact SG-CD2 2.92Å
272	E	75.8	Confident	80.2	Confident	118 Å²	118	29.3 Å²	29.3	55%	0.551	16%	0.158	S	C	*	.	S	Bend	trans	-115.5	164.3	-179.6	-61.4	-175.9	173.6	0	0	110	A270 P274	A270-E272 WeakPolarHBondContact CB-O 3.45Å; A270-E272 PolarHBondContact O-N 3.39Å; E272-P274 VanDerWaalsContact O-CD 3.3Å; E272-P274 WeakPolarHBondContact O-CD 3.27Å
273	E	79.2	Confident	81.9	Confident	53 Å²	53	25.8 Å²	25.8	25%	0.248	14%	0.143	C	C	.	.			trans	-62.9	118.7	175.8	171.3	59.3	-118.1	0	0	110.5	I275 S838 K842	E273-I275 VanDerWaalsContact C-N 3.25Å; E273-I275 WeakPolarHBondContact CG-O 3.47Å; E273-I275 PolarHBondContact O-N 2.86Å; E273-I275 PolarHBondContact OE1-N 2.96Å; E273-I275 VanDerWaalsContact OE1-N 3.1Å; E273-S838 PolarHBondContact OE1-OG 3.17Å; E273-K842 IonicContact OE1-NZ 2.7Å; E273-K842 PolarHBondContact OE1-NZ 3.35Å; E273-K842 WeakPolarHBondContact OE2-CE 3.39Å; E273-K842 IonicContact OE2-NZ 3.06Å; E273-K842 PolarHBondContact OE2-NZ 3.06Å
274	P	82.7	Confident	83.3	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.14	C	C	.	.	S	Bend	trans	-69	-20.3	-177.4	27.7	-36.5	0	0	0	114.4	W243 E272 T315 A316 L319 E835	W243-P274 HydrophobicContact CE3-CG 4.38Å; W243-P274 HydrophobicContact CH2-CG 3.51Å; W243-P274 HydrophobicContact CZ2-CG 4.07Å; W243-P274 VanDerWaalsContact CZ3-CD 3.47Å; W243-P274 HydrophobicContact CZ3-CG 3.74Å; E272-P274 VanDerWaalsContact O-CD 3.3Å; E272-P274 WeakPolarHBondContact O-CD 3.27Å; P274-T315 CarbonylContact O-C 3.14Å; P274-T315 WeakPolarHBondContact O-CA 3.22Å; P274-A316 PolarHBondContact O-N 2.71Å; P274-L319 VanDerWaalsContact CA-CD2 3.47Å; P274-L319 HydrophobicContact CB-CD1 3.78Å; P274-L319 HydrophobicContact CB-CD2 3.78Å; P274-L319 HydrophobicContact CB-CG 4.4Å; P274-E835 HydrophobicContact CB-CG 3.86Å
275	I	85.4	Confident	84.4	Confident	3 Å²	3	26.4 Å²	26.4	2%	0.015	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	112.8	-179.1	-56.5	166	0	0	0	110.2	W238 E273 V313 S838 L839 K842	W238-I275 HydrophobicContact CZ2-CG2 3.93Å; E273-I275 VanDerWaalsContact C-N 3.25Å; E273-I275 WeakPolarHBondContact CG-O 3.47Å; E273-I275 PolarHBondContact O-N 2.86Å; E273-I275 PolarHBondContact OE1-N 2.96Å; E273-I275 VanDerWaalsContact OE1-N 3.1Å; I275-V313 HydrophobicContact CB-CG1 4.49Å; I275-V313 HydrophobicContact CG1-CG1 4.23Å; I275-V313 HydrophobicContact CG2-CG1 3.64Å; I275-S838 WeakPolarHBondContact CD1-OG 3.5Å; I275-L839 HydrophobicContact CD1-CB 4.42Å; I275-L839 HydrophobicContact CD1-CD2 3.39Å; I275-L839 HydrophobicContact CD1-CG 3.58Å; I275-L839 HydrophobicContact CG1-CD2 4.46Å; I275-K842 HydrophobicContact CD1-CD 4.01Å
276	S	83.9	Confident	84.8	Confident	41 Å²	41	27.9 Å²	27.9	29%	0.287	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	-47.4	178.7	60.6	0	0	0	0	112.7	R314 T315	S276-R314 PolarHBondContact N-O 3.31Å; S276-R314 PolarHBondContact OG-O 3.22Å; S276-T315 PolarHBondContact OG-O 3.1Å
277	E	87.9	Confident	85.3	Confident	24 Å²	24	28.4 Å²	28.4	11%	0.112	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	143.2	-173.5	-52	-178.6	145.6	0	0	112.7	I234 L235 Q236 H279 R314	I234-E277 HydrophobicContact CG2-CB 4.06Å; I234-E277 HydrophobicContact CG2-CG 4.25Å; L235-E277 CarbonylContact O-C 3.53Å; L235-E277 VanDerWaalsContact O-CA 3.32Å; L235-E277 WeakPolarHBondContact O-CA 3.34Å; Q236-E277 HydrophobicContact CG-CG 4.2Å; Q236-E277 PolarHBondContact NE2-OE1 3.2Å; E277-H279 IonicContact OE2-CD2 2.81Å; E277-H279 IonicContact OE2-CE1 3.33Å; E277-H279 IonicContact OE2-NE2 3.98Å; E277-H279 PolarHBondContact OE2-NE2 2.78Å; E277-R314 HydrophobicContact CB-CB 4.04Å; E277-R314 PolarHBondContact N-O 2.78Å; E277-R314 PolarHBondContact O-N 2.76Å; E277-R314 WeakPolarHBondContact OE2-CD 3.27Å; E277-R314 IonicContact OE2-NH1 3.57Å
278	L	90.1	Very high	85.8	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	122.8	164.7	-162.8	67.7	0	0	0	109.7	I234 L235 W238 I311 V313	I234-L278 WeakPolarHBondContact CA-O 3.44Å; L235-L278 HydrophobicContact CB-CB 3.9Å; L235-L278 HydrophobicContact CD2-CB 4.39Å; L235-L278 HydrophobicContact CD2-CD2 4.32Å; L235-L278 PolarHBondContact N-O 3.32Å; L235-L278 PolarHBondContact O-N 3.34Å; W238-L278 HydrophobicContact CH2-CB 4.16Å; W238-L278 HydrophobicContact CH2-CD1 3.92Å; W238-L278 HydrophobicContact CH2-CD2 3.81Å; W238-L278 HydrophobicContact CH2-CG 4.18Å; W238-L278 HydrophobicContact CZ2-CB 3.55Å; W238-L278 HydrophobicContact CZ2-CD1 3.88Å; W238-L278 HydrophobicContact CZ2-CD2 4.09Å; W238-L278 HydrophobicContact CZ2-CG 4.04Å; L278-I311 HydrophobicContact CD1-CG2 3.42Å; L278-I311 VanDerWaalsContact CD1-CG2 3.42Å; L278-I311 HydrophobicContact CG-CG2 4.09Å; L278-V313 HydrophobicContact CD1-CG2 3.81Å
279	H	92.3	Very high	85.9	Confident	37 Å²	37	32 Å²	32	17%	0.171	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	109.8	177.1	-67.8	-161.1	0	0	0	108.7	T232 Y233 E277 I311 R312	T232-H279 HydrophobicContact CG2-CB 4.31Å; Y233-H279 WeakPolarHBondContact O-CA 3.4Å; E277-H279 IonicContact OE2-CD2 2.81Å; E277-H279 IonicContact OE2-CE1 3.33Å; E277-H279 IonicContact OE2-NE2 3.98Å; E277-H279 PolarHBondContact OE2-NE2 2.78Å; H279-I311 WeakPolarHBondContact O-CA 3.4Å; H279-R312 HydrophobicContact CB-CB 4.16Å; H279-R312 PolarHBondContact N-O 2.78Å; H279-R312 PolarHBondContact O-N 3Å
280	L	93.9	Very high	86.1	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	118.5	172.2	174.1	65.8	0	0	0	109.2	T232 Y233 T282 W309 I311 I885 F889 F917	T232-L280 CarbonylContact C-O 3.56Å; T232-L280 WeakPolarHBondContact CA-O 3.36Å; Y233-L280 PolarHBondContact N-O 2.82Å; Y233-L280 PolarHBondContact O-N 2.85Å; L280-T282 HydrophobicContact CD2-CG2 4.31Å; L280-T282 HydrophobicContact CG-CG2 4.21Å; L280-W309 HydrophobicContact CD1-CB 4.12Å; L280-W309 HydrophobicContact CD1-CD2 3.93Å; L280-W309 HydrophobicContact CD1-CE3 3.76Å; L280-W309 HydrophobicContact CD1-CG 4.13Å; L280-W309 HydrophobicContact CD1-CZ3 4.4Å; L280-W309 HydrophobicContact CD2-CE3 4.34Å; L280-W309 HydrophobicContact CD2-CH2 4.38Å; L280-W309 HydrophobicContact CD2-CZ3 4.25Å; L280-I311 HydrophobicContact CD1-CG1 4.23Å; L280-I885 HydrophobicContact CD1-CG2 4.37Å; L280-I885 HydrophobicContact CD2-CG2 4.08Å; L280-F889 HydrophobicContact CB-CE2 3.76Å; L280-F889 HydrophobicContact CB-CZ 3.84Å; L280-F889 HydrophobicContact CD2-CD2 4.24Å; L280-F889 HydrophobicContact CD2-CE2 3.79Å; L280-F889 HydrophobicContact CD2-CZ 4.4Å; L280-F889 HydrophobicContact CG-CE2 4.41Å; L280-F917 HydrophobicContact CD2-CD1 4.41Å; L280-F917 HydrophobicContact CD2-CE1 3.66Å; L280-F917 HydrophobicContact CD2-CZ 4.39Å
281	A	93.9	Very high	86.4	Confident	2 Å²	2	40.5 Å²	40.5	2%	0.017	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	117.2	173.4	0	0	0	0	0	110.7	R230 Y231 W309 S310	R230-A281 HydrophobicContact CG-CB 4.27Å; Y231-A281 CarbonylContact O-C 3.58Å; Y231-A281 VanDerWaalsContact O-CA 3.31Å; Y231-A281 WeakPolarHBondContact O-CA 3.23Å; A281-W309 CarbonylContact O-C 3.55Å; A281-W309 WeakPolarHBondContact O-CA 3.37Å; A281-S310 WeakPolarHBondContact CB-OG 3.35Å; A281-S310 PolarHBondContact N-O 3.33Å; A281-S310 PolarHBondContact O-N 2.77Å
282	T	94.7	Very high	87.2	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	120.6	174.1	64.3	0	0	0	0	109.2	R230 Y231 Y233 L280 W284 P303 A306 W309	R230-T282 WeakPolarHBondContact CA-O 3.38Å; Y231-T282 PolarHBondContact N-O 3.32Å; Y231-T282 PolarHBondContact O-N 3.2Å; Y233-T282 HydrophobicContact CD2-CG2 4.28Å; Y233-T282 HydrophobicContact CE2-CG2 4.02Å; L280-T282 HydrophobicContact CD2-CG2 4.31Å; L280-T282 HydrophobicContact CG-CG2 4.21Å; T282-W284 WeakPolarHBondContact O-CZ3 3.45Å; T282-P303 HydrophobicContact CG2-CB 3.82Å; T282-A306 HydrophobicContact CG2-CB 4.43Å; T282-W309 HydrophobicContact CG2-CG 4.33Å
283	T	92.9	Very high	87.7	Confident	18 Å²	18	36.3 Å²	36.3	11%	0.11	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	132.9	-169.7	-54.1	0	0	0	0	111.9	F110 I229 R230 P307 H308	F110-T283 HydrophobicContact CD2-CG2 4.27Å; F110-T283 HydrophobicContact CE2-CG2 4.29Å; I229-T283 CarbonylContact O-C 3.51Å; I229-T283 VanDerWaalsContact O-CA 3.32Å; I229-T283 WeakPolarHBondContact O-CA 3.16Å; R230-T283 HydrophobicContact CB-CG2 4.43Å; T283-P307 VanDerWaalsContact O-CD 3.3Å; T283-P307 WeakPolarHBondContact O-CD 3Å; T283-P307 WeakPolarHBondContact O-CG 3.37Å; T283-H308 PolarHBondContact N-O 2.93Å; T283-H308 PolarHBondContact O-N 2.87Å
284	W	93.3	Very high	88.2	Confident	19 Å²	19	34.3 Å²	34.3	7%	0.072	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	98.2	168.5	-61.3	-98.6	0	0	0	108.4	A228 I229 Y231 T282 L287 L301 D302 A306 P307	A228-W284 CarbonylContact C-O 3.58Å; A228-W284 VanDerWaalsContact CA-O 3.27Å; A228-W284 WeakPolarHBondContact CA-O 3.48Å; I229-W284 HydrophobicContact CB-CB 4.47Å; I229-W284 HydrophobicContact CB-CE3 4.09Å; I229-W284 HydrophobicContact CG2-CE3 4.05Å; I229-W284 HydrophobicContact CG2-CZ3 4.35Å; I229-W284 PolarHBondContact N-O 2.83Å; I229-W284 PolarHBondContact O-N 3.05Å; Y231-W284 HydrophobicContact CD2-CH2 4.1Å; Y231-W284 AromaticContact CD2-CZ3 3.96Å; Y231-W284 HydrophobicContact CD2-CZ3 3.96Å; Y231-W284 HydrophobicContact CG-CZ3 4.01Å; T282-W284 WeakPolarHBondContact O-CZ3 3.45Å; W284-L287 HydrophobicContact CB-CD1 3.6Å; W284-L287 HydrophobicContact CB-CD2 4.5Å; W284-L287 HydrophobicContact CB-CG 3.98Å; W284-L287 HydrophobicContact CG-CD1 4.16Å; W284-L301 HydrophobicContact CD2-CD2 3.93Å; W284-L301 HydrophobicContact CE3-CD2 4.2Å; W284-L301 HydrophobicContact CG-CD2 4.36Å; W284-L301 HydrophobicContact CH2-CB 4.28Å; W284-L301 HydrophobicContact CH2-CD2 4.42Å; W284-L301 HydrophobicContact CZ2-CB 4.33Å; W284-L301 HydrophobicContact CZ2-CD2 4.15Å; W284-L301 HydrophobicContact CZ3-CD2 4.44Å; W284-D302 WeakPolarHBondContact CZ2-O 2.97Å; W284-A306 HydrophobicContact CD2-CB 4.29Å; W284-A306 HydrophobicContact CH2-CB 4.1Å; W284-A306 HydrophobicContact CZ2-CB 3.62Å; W284-P307 VanDerWaalsContact CD1-CD 3.5Å
285	P	86.5	Confident	88.5	Confident	42 Å²	42	37.6 Å²	37.6	27%	0.273	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	-28	-167.4	32.1	-38.2	0	0	0	114.3	A228	A228-P285 WeakPolarHBondContact CB-O 3.5Å
286	H	83	Confident	88.3	Confident	116 Å²	116	43.9 Å²	43.9	54%	0.537	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	84.2	-172.3	-170.1	76.2	0	0	0	110.9	M106	M106-H286 PolarHBondContact SD-ND1 2.75Å; M106-H286 VanDerWaalsContact SD-ND1 3.43Å
287	L	89.1	Confident	88.4	Confident	20 Å²	20	48.2 Å²	48.2	11%	0.105	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	133.4	171.7	-61.7	174.7	0	0	0	108.8	I227 I229 W284 I291 V292	I227-L287 HydrophobicContact CB-CB 4.15Å; I227-L287 PolarHBondContact N-O 3.21Å; I227-L287 PolarHBondContact O-N 3.44Å; I229-L287 HydrophobicContact CD1-CD1 4.03Å; I229-L287 HydrophobicContact CG1-CD1 4.43Å; W284-L287 HydrophobicContact CB-CD1 3.6Å; W284-L287 HydrophobicContact CB-CD2 4.5Å; W284-L287 HydrophobicContact CB-CG 3.98Å; W284-L287 HydrophobicContact CG-CD1 4.16Å; L287-I291 HydrophobicContact CD2-CG2 4.5Å; L287-V292 HydrophobicContact CD1-CB 4.46Å; L287-V292 HydrophobicContact CD1-CG2 3.81Å; L287-V292 HydrophobicContact CD2-CG2 3.77Å; L287-V292 HydrophobicContact CG-CG2 4.32Å
288	T	87.7	Confident	88.3	Confident	46 Å²	46	53.6 Å²	53.6	28%	0.282	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	152.4	167.3	62.2	0	0	0	0	109.6	G290 I291	T288-G290 PolarHBondContact O-N 3.06Å; T288-I291 PolarHBondContact O-N 2.9Å; T288-I291 WeakPolarHBondContact OG1-CD1 3.04Å; T288-I291 WeakPolarHBondContact OG1-CG1 3.44Å
289	E	83.4	Confident	88.2	Confident	70 Å²	70	56 Å²	56	33%	0.327	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	131	174	-172.7	-178.9	176	0	0	111.5	L208 K212 V225	L208-E289 HydrophobicContact CD1-CG 4.4Å; K212-E289 WeakPolarHBondContact CE-OE2 3.4Å; K212-E289 IonicContact NZ-OE1 2.73Å; K212-E289 PolarHBondContact NZ-OE1 3.21Å; K212-E289 IonicContact NZ-OE2 3Å; K212-E289 PolarHBondContact NZ-OE2 3.35Å; V225-E289 PolarHBondContact O-N 2.87Å
290	G	80.7	Confident	88	Confident	71 Å²	71	57 Å²	57	73%	0.732	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.2	-7.6	178.1	0	0	0	0	0	115.9	T288	T288-G290 PolarHBondContact O-N 3.06Å
291	I	87.3	Confident	87.7	Confident	109 Å²	109	57.6 Å²	57.6	56%	0.559	32%	0.323	S	S	*	.	S	Bend	trans	-75.9	-37.7	172.9	-65.3	-177.4	0	0	0	111.6	L287 T288	L287-I291 HydrophobicContact CD2-CG2 4.5Å; T288-I291 PolarHBondContact O-N 2.9Å; T288-I291 WeakPolarHBondContact OG1-CD1 3.04Å; T288-I291 WeakPolarHBondContact OG1-CG1 3.44Å
292	V	87.1	Confident	87.4	Confident	28 Å²	28	60.1 Å²	60.1	17%	0.17	34%	0.336	C	S	.	.	S	Bend	trans	-122	135.1	-174	176.3	0	0	0	0	108.8	L287 D300 L301	L287-V292 HydrophobicContact CD1-CB 4.46Å; L287-V292 HydrophobicContact CD1-CG2 3.81Å; L287-V292 HydrophobicContact CD2-CG2 3.77Å; L287-V292 HydrophobicContact CG-CG2 4.32Å; V292-D300 HydrophobicContact CG1-CB 3.92Å; V292-L301 HydrophobicContact CG1-CD2 3.76Å; V292-L301 HydrophobicContact CG1-CG 3.89Å
293	V	87.1	Confident	87.2	Confident	64 Å²	64	60.8 Å²	60.8	39%	0.388	34%	0.34	S	S	.	.			trans	-101.1	123	172.2	-176	0	0	0	0	108.9	Y298 S299 D300	V293-Y298 HydrophobicContact CB-CD1 4.38Å; V293-Y298 HydrophobicContact CG1-CD1 4.21Å; V293-S299 CarbonylContact O-C 3.58Å; V293-S299 WeakPolarHBondContact O-CA 3.35Å; V293-D300 WeakPolarHBondContact CB-OD2 3.2Å; V293-D300 PolarHBondContact N-OD2 3.5Å; V293-D300 PolarHBondContact O-N 2.99Å
294	D	89.4	Confident	87	Confident	11 Å²	11	62.2 Å²	62.2	6%	0.059	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-142.3	101.9	173.8	176	59.4	0	0	0	110.2	L204 S205 S299 L301	L204-D294 HydrophobicContact CB-CB 3.77Å; L204-D294 WeakPolarHBondContact CB-OD2 3.4Å; L204-D294 HydrophobicContact CD2-CB 4.47Å; L204-D294 PolarHBondContact N-O 3.11Å; L204-D294 PolarHBondContact N-OD2 3.07Å; S205-D294 PolarHBondContact N-O 2.85Å; D294-S299 WeakPolarHBondContact OD1-CB 3.49Å; D294-S299 PolarHBondContact OD1-OG 3.12Å; D294-L301 HydrophobicContact CB-CD1 3.98Å
295	N	87.9	Confident	86.7	Confident	68 Å²	68	68 Å²	68	36%	0.364	38%	0.375	S	S	.	.			trans	-129.3	178.4	-173	-57.5	14.8	0	0	0	109.5	V297 Y298	N295-V297 PolarHBondContact O-N 3.23Å; N295-Y298 PolarHBondContact N-O 3.28Å
296	D	83.3	Confident	86.9	Confident	135 Å²	135	66.2 Å²	66.2	72%	0.722	36%	0.364	S	S	*	.	S	Bend	trans	-63.2	-24.9	176.4	62.7	-27.4	0	0	0	114.6
297	V	85.4	Confident	87.3	Confident	133 Å²	133	63.9 Å²	63.9	81%	0.806	36%	0.359	S	S	*	.	S	Bend	trans	-99.1	-33	-178.6	-178.9	0	0	0	0	113.3	N295	N295-V297 PolarHBondContact O-N 3.23Å
298	Y	86.3	Confident	87.3	Confident	136 Å²	136	67 Å²	67	53%	0.533	37%	0.373	S	S	.	.			trans	-149.4	141.9	-169	178.8	-96.1	0	0	0	111.6	V293 N295 D300	V293-Y298 HydrophobicContact CB-CD1 4.38Å; V293-Y298 HydrophobicContact CG1-CD1 4.21Å; N295-Y298 PolarHBondContact N-O 3.28Å; Y298-D300 WeakPolarHBondContact CE1-OD1 3.44Å; Y298-D300 VanDerWaalsContact CZ-OD1 3.22Å; Y298-D300 PolarHBondContact OH-OD1 3.48Å
299	S	87.3	Confident	87.6	Confident	50 Å²	50	64.9 Å²	64.9	35%	0.35	36%	0.36	S	S	.	.	B	Isolated β-bridge	trans	-139.6	127.1	179.2	-166.7	0	0	0	0	110.6	V293 D294 L301	V293-S299 CarbonylContact O-C 3.58Å; V293-S299 WeakPolarHBondContact O-CA 3.35Å; D294-S299 WeakPolarHBondContact OD1-CB 3.49Å; D294-S299 PolarHBondContact OD1-OG 3.12Å; S299-L301 PolarHBondContact OG-N 3.05Å
300	D	87.6	Confident	88.1	Confident	58 Å²	58	62.1 Å²	62.1	31%	0.31	35%	0.348	S	S	.	.			trans	-78.5	-5.1	171.9	-74.1	-41.3	0	0	0	112.7	V292 V293 Y298 D302	V292-D300 HydrophobicContact CG1-CB 3.92Å; V293-D300 WeakPolarHBondContact CB-OD2 3.2Å; V293-D300 PolarHBondContact N-OD2 3.5Å; V293-D300 PolarHBondContact O-N 2.99Å; Y298-D300 WeakPolarHBondContact CE1-OD1 3.44Å; Y298-D300 VanDerWaalsContact CZ-OD1 3.22Å; Y298-D300 PolarHBondContact OH-OD1 3.48Å; D300-D302 VanDerWaalsContact C-N 3.32Å; D300-D302 PolarHBondContact O-N 3.25Å
301	L	88.5	Confident	88.6	Confident	13 Å²	13	58.7 Å²	58.7	7%	0.068	31%	0.313	C	S	.	.			trans	-81.2	74.4	-172.7	-65	169.6	0	0	0	111.9	I229 Y231 W284 V292 D294 S299	I229-L301 HydrophobicContact CD1-CD1 3.76Å; I229-L301 HydrophobicContact CD1-CD2 4.05Å; I229-L301 HydrophobicContact CG2-CD1 4.38Å; Y231-L301 HydrophobicContact CE2-CB 3.83Å; Y231-L301 HydrophobicContact CE2-CD1 4.06Å; Y231-L301 WeakPolarHBondContact OH-CD1 3.4Å; W284-L301 HydrophobicContact CD2-CD2 3.93Å; W284-L301 HydrophobicContact CE3-CD2 4.2Å; W284-L301 HydrophobicContact CG-CD2 4.36Å; W284-L301 HydrophobicContact CH2-CB 4.28Å; W284-L301 HydrophobicContact CH2-CD2 4.42Å; W284-L301 HydrophobicContact CZ2-CB 4.33Å; W284-L301 HydrophobicContact CZ2-CD2 4.15Å; W284-L301 HydrophobicContact CZ3-CD2 4.44Å; V292-L301 HydrophobicContact CG1-CD2 3.76Å; V292-L301 HydrophobicContact CG1-CG 3.89Å; D294-L301 HydrophobicContact CB-CD1 3.98Å; S299-L301 PolarHBondContact OG-N 3.05Å
302	D	88.1	Confident	88.8	Confident	56 Å²	56	58.5 Å²	58.5	30%	0.299	31%	0.305	S	S	.	.			trans	-85.6	119.9	174	-179.8	6.5	0	0	0	111.3	W284 D300 L304 Q305 A306	W284-D302 WeakPolarHBondContact CZ2-O 2.97Å; D300-D302 VanDerWaalsContact C-N 3.32Å; D300-D302 PolarHBondContact O-N 3.25Å; D302-L304 PolarHBondContact O-N 3.07Å; D302-L304 VanDerWaalsContact O-N 3.12Å; D302-L304 PolarHBondContact OD1-N 3.24Å; D302-Q305 HydrophobicContact CB-CB 4.38Å; D302-Q305 HydrophobicContact CB-CG 4.13Å; D302-Q305 PolarHBondContact O-N 3.45Å; D302-Q305 PolarHBondContact OD2-NE2 2.9Å; D302-A306 PolarHBondContact O-N 3.01Å
303	P	88.7	Confident	88.9	Confident	13 Å²	13	58.5 Å²	58.5	8%	0.084	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-54.5	-30	179.6	17.4	-29.6	0	0	0	114.5	Y233 T282 Q305 A306 W309 F917	Y233-P303 HydrophobicContact CE2-CB 3.79Å; Y233-P303 HydrophobicContact CE2-CG 4.27Å; Y233-P303 WeakPolarHBondContact OH-CG 3.49Å; T282-P303 HydrophobicContact CG2-CB 3.82Å; P303-Q305 VanDerWaalsContact C-N 3.28Å; P303-Q305 PolarHBondContact O-N 3.09Å; P303-A306 WeakPolarHBondContact O-CB 3.41Å; P303-A306 PolarHBondContact O-N 3.03Å; P303-W309 WeakPolarHBondContact O-CZ2 3.43Å; P303-W309 PolarHBondContact O-NE1 3.49Å; P303-F917 HydrophobicContact CB-CD2 4.24Å; P303-F917 HydrophobicContact CB-CE2 4.27Å; P303-F917 HydrophobicContact CG-CB 4.43Å; P303-F917 HydrophobicContact CG-CD2 3.56Å; P303-F917 HydrophobicContact CG-CE2 3.98Å; P303-F917 HydrophobicContact CG-CG 4.03Å
304	L	88.7	Confident	88.8	Confident	49 Å²	49	60.7 Å²	60.7	26%	0.257	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-69.6	-25.3	177.2	-70.2	174.7	0	0	0	113.6	D302 W309 F917	D302-L304 PolarHBondContact O-N 3.07Å; D302-L304 VanDerWaalsContact O-N 3.12Å; D302-L304 PolarHBondContact OD1-N 3.24Å; L304-W309 HydrophobicContact CD2-CH2 4.21Å; L304-W309 HydrophobicContact CD2-CZ2 4.15Å; L304-F917 HydrophobicContact CD2-CE2 3.92Å; L304-F917 HydrophobicContact CD2-CZ 4.25Å; L304-F917 HydrophobicContact CG-CE2 3.98Å
305	Q	88.5	Confident	88.6	Confident	141 Å²	141	62.8 Å²	62.8	66%	0.659	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-93.1	-0.4	179.5	-59.1	-179.4	30.8	0	0	112.3	D302 P303	D302-Q305 HydrophobicContact CB-CB 4.38Å; D302-Q305 HydrophobicContact CB-CG 4.13Å; D302-Q305 PolarHBondContact O-N 3.45Å; D302-Q305 PolarHBondContact OD2-NE2 2.9Å; P303-Q305 VanDerWaalsContact C-N 3.28Å; P303-Q305 PolarHBondContact O-N 3.09Å
306	A	90.8	Very high	88.2	Confident	4 Å²	4	60.7 Å²	60.7	3%	0.033	31%	0.312	C	S	.	.			trans	-66.1	133.2	179.8	0	0	0	0	0	111.5	T282 W284 D302 P303 H308 A876	T282-A306 HydrophobicContact CG2-CB 4.43Å; W284-A306 HydrophobicContact CD2-CB 4.29Å; W284-A306 HydrophobicContact CH2-CB 4.1Å; W284-A306 HydrophobicContact CZ2-CB 3.62Å; D302-A306 PolarHBondContact O-N 3.01Å; P303-A306 WeakPolarHBondContact O-CB 3.41Å; P303-A306 PolarHBondContact O-N 3.03Å; A306-H308 VanDerWaalsContact C-N 3.3Å; A306-H308 PolarHBondContact O-N 3.32Å; A306-A876 WeakPolarHBondContact O-CB 3.29Å
307	P	89.6	Confident	87.7	Confident	67 Å²	67	60.2 Å²	60.2	44%	0.435	31%	0.309	S	S	.	.	S	Bend	trans	-71.1	-24.7	-176	27.5	-34.7	0	0	0	113.3	T283 W284	T283-P307 VanDerWaalsContact O-CD 3.3Å; T283-P307 WeakPolarHBondContact O-CD 3Å; T283-P307 WeakPolarHBondContact O-CG 3.37Å; W284-P307 VanDerWaalsContact CD1-CD 3.5Å
308	H	90.8	Very high	86.9	Confident	85 Å²	85	61.4 Å²	61.4	39%	0.394	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	129.8	-179.8	-63.6	-47.5	0	0	0	111.3	T283 A306	T283-H308 PolarHBondContact N-O 2.93Å; T283-H308 PolarHBondContact O-N 2.87Å; A306-H308 VanDerWaalsContact C-N 3.3Å; A306-H308 PolarHBondContact O-N 3.32Å
309	W	93.8	Very high	86.4	Confident	1 Å²	1	56.1 Å²	56.1	0%	0.004	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	139.9	167	-72.6	12.9	0	0	0	109.1	L280 A281 T282 P303 L304 V873 A876 G877 G882 I885 H886 F917	L280-W309 HydrophobicContact CD1-CB 4.12Å; L280-W309 HydrophobicContact CD1-CD2 3.93Å; L280-W309 HydrophobicContact CD1-CE3 3.76Å; L280-W309 HydrophobicContact CD1-CG 4.13Å; L280-W309 HydrophobicContact CD1-CZ3 4.4Å; L280-W309 HydrophobicContact CD2-CE3 4.34Å; L280-W309 HydrophobicContact CD2-CH2 4.38Å; L280-W309 HydrophobicContact CD2-CZ3 4.25Å; A281-W309 CarbonylContact O-C 3.55Å; A281-W309 WeakPolarHBondContact O-CA 3.37Å; T282-W309 HydrophobicContact CG2-CG 4.33Å; P303-W309 WeakPolarHBondContact O-CZ2 3.43Å; P303-W309 PolarHBondContact O-NE1 3.49Å; L304-W309 HydrophobicContact CD2-CH2 4.21Å; L304-W309 HydrophobicContact CD2-CZ2 4.15Å; W309-V873 HydrophobicContact CB-CB 4Å; W309-V873 HydrophobicContact CB-CG2 4.2Å; W309-V873 PolarHBondContact O-N 2.92Å; W309-A876 HydrophobicContact CB-CB 4.17Å; W309-A876 HydrophobicContact CD2-CB 4.37Å; W309-A876 HydrophobicContact CG-CB 3.82Å; W309-G877 VanDerWaalsContact CZ2-CA 3.41Å; W309-G882 WeakPolarHBondContact CZ3-O 3.38Å; W309-I885 HydrophobicContact CZ3-CB 4.34Å; W309-I885 HydrophobicContact CZ3-CG2 4.37Å; W309-H886 HydrophobicContact CH2-CB 4.37Å; W309-F917 AromaticContact CH2-CZ 3.98Å; W309-F917 HydrophobicContact CH2-CZ 3.98Å; W309-F917 HydrophobicContact CZ2-CZ 4.25Å
310	S	92.3	Very high	85.8	Confident	12 Å²	12	58.7 Å²	58.7	8%	0.084	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	149.5	168.3	52.3	0	0	0	0	110	A281 E870 V871	A281-S310 WeakPolarHBondContact CB-OG 3.35Å; A281-S310 PolarHBondContact N-O 3.33Å; A281-S310 PolarHBondContact O-N 2.77Å; S310-E870 WeakPolarHBondContact CB-OE1 3.47Å; S310-E870 PolarHBondContact OG-OE1 3.4Å; S310-V871 CarbonylContact C-O 3.59Å; S310-V871 VanDerWaalsContact CA-O 3.23Å; S310-V871 WeakPolarHBondContact CA-O 3.13Å
311	I	92.4	Very high	85.6	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	138.6	-178.4	-64.8	173.7	0	0	0	109.4	L278 H279 L280 V313 F861 L865 E870 V871 V873 I885	L278-I311 HydrophobicContact CD1-CG2 3.42Å; L278-I311 VanDerWaalsContact CD1-CG2 3.42Å; L278-I311 HydrophobicContact CG-CG2 4.09Å; H279-I311 WeakPolarHBondContact O-CA 3.4Å; L280-I311 HydrophobicContact CD1-CG1 4.23Å; I311-V313 HydrophobicContact CG2-CG2 4.43Å; I311-F861 HydrophobicContact CD1-CE1 4.24Å; I311-F861 HydrophobicContact CD1-CZ 3.68Å; I311-L865 HydrophobicContact CB-CD2 4.16Å; I311-L865 HydrophobicContact CG2-CD2 3.88Å; I311-E870 CarbonylContact O-C 3.58Å; I311-E870 VanDerWaalsContact O-CA 3.29Å; I311-E870 WeakPolarHBondContact O-CA 3.48Å; I311-V871 PolarHBondContact N-O 3.06Å; I311-V871 PolarHBondContact O-N 2.82Å; I311-V873 HydrophobicContact CD1-CG2 3.76Å; I311-V873 HydrophobicContact CG1-CG2 3.91Å; I311-I885 HydrophobicContact CD1-CD1 3.11Å; I311-I885 HydrophobicContact CD1-CG1 3.79Å; I311-I885 HydrophobicContact CG1-CD1 4.17Å
312	R	90.4	Very high	85.3	Confident	104 Å²	104	56.1 Å²	56.1	39%	0.392	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	133	165.2	171.5	172.5	-178	-172.5	0.8	109.4	H279 P869	H279-R312 HydrophobicContact CB-CB 4.16Å; H279-R312 PolarHBondContact N-O 2.78Å; H279-R312 PolarHBondContact O-N 3Å; R312-P869 WeakPolarHBondContact CG-O 3.37Å
313	V	89.4	Confident	85.1	Confident	28 Å²	28	53.5 Å²	53.5	17%	0.17	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	134.5	172.7	-179.9	0	0	0	0	108	I275 L278 I311 L839 L865	I275-V313 HydrophobicContact CB-CG1 4.49Å; I275-V313 HydrophobicContact CG1-CG1 4.23Å; I275-V313 HydrophobicContact CG2-CG1 3.64Å; L278-V313 HydrophobicContact CD1-CG2 3.81Å; I311-V313 HydrophobicContact CG2-CG2 4.43Å; V313-L839 HydrophobicContact CG1-CD2 4.39Å; V313-L839 HydrophobicContact CG2-CD2 3.98Å; V313-L865 HydrophobicContact CG2-CD1 4.41Å; V313-L865 HydrophobicContact CG2-CD2 4.15Å
314	R	86.4	Confident	84.9	Confident	111 Å²	111	53 Å²	53	42%	0.419	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	117	167.9	-167.5	179.9	-177.1	-165.5	-6.9	108	S276 E277 D317	S276-R314 PolarHBondContact N-O 3.31Å; S276-R314 PolarHBondContact OG-O 3.22Å; E277-R314 HydrophobicContact CB-CB 4.04Å; E277-R314 PolarHBondContact N-O 2.78Å; E277-R314 PolarHBondContact O-N 2.76Å; E277-R314 WeakPolarHBondContact OE2-CD 3.27Å; E277-R314 IonicContact OE2-NH1 3.57Å; R314-D317 IonicContact NH2-OD2 2.8Å
315	T	84.4	Confident	84.7	Confident	54 Å²	54	53 Å²	53	33%	0.331	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	157.5	173.6	54.2	0	0	0	0	109.7	P274 S276 E835	P274-T315 CarbonylContact O-C 3.14Å; P274-T315 WeakPolarHBondContact O-CA 3.22Å; S276-T315 PolarHBondContact OG-O 3.1Å; T315-E835 VanDerWaalsContact CG2-CD 3.42Å; T315-E835 HydrophobicContact CG2-CG 4.02Å; T315-E835 VanDerWaalsContact CG2-OE1 3.25Å; T315-E835 WeakPolarHBondContact CG2-OE1 3.4Å
316	A	79.7	Confident	84.6	Confident	24 Å²	24	46.7 Å²	46.7	20%	0.198	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-71.3	137.5	176.3	0	0	0	0	0	110.2	P274 L319	P274-A316 PolarHBondContact O-N 2.71Å; A316-L319 HydrophobicContact CB-CD1 4.14Å; A316-L319 HydrophobicContact CB-CG 4.04Å
317	D	72.6	Confident	84.5	Confident	125 Å²	125	46.6 Å²	46.6	67%	0.668	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	129.9	176.1	-63.3	-42.8	0	0	0	108.7	R314	R314-D317 IonicContact NH2-OD2 2.8Å
318	N	69.1	Low	84.4	Confident	158 Å²	158	45.4 Å²	45.4	85%	0.845	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.1	55.5	-180	-56.1	-33	0	0	0	115.6	Q320	N318-Q320 PolarHBondContact O-N 3.2Å
319	L	74.6	Confident	84.1	Confident	25 Å²	25	44.8 Å²	44.8	13%	0.131	23%	0.226	C	C	.	.			trans	-57.5	122.7	171.9	-90.7	146.6	0	0	0	112.8	A270 P274 A316 C321 T831	A270-L319 HydrophobicContact CB-CD2 3.67Å; P274-L319 VanDerWaalsContact CA-CD2 3.47Å; P274-L319 HydrophobicContact CB-CD1 3.78Å; P274-L319 HydrophobicContact CB-CD2 3.78Å; P274-L319 HydrophobicContact CB-CG 4.4Å; A316-L319 HydrophobicContact CB-CD1 4.14Å; A316-L319 HydrophobicContact CB-CG 4.04Å; L319-C321 PolarHBondContact O-N 3.46Å; L319-T831 HydrophobicContact CB-CG2 4.44Å
320	Q	76.2	Confident	83.8	Confident	105 Å²	105	44.8 Å²	44.8	49%	0.491	23%	0.226	S	C	.	.			trans	-81.1	104.2	172	-69.8	-175.6	-3	0	0	109.5	A270 C271 N318	A270-Q320 WeakPolarHBondContact CA-O 3.37Å; C271-Q320 PolarHBondContact N-O 3.38Å; N318-Q320 PolarHBondContact O-N 3.2Å
321	C	81.7	Confident	83.5	Confident	1 Å²	1	45 Å²	45	1%	0.007	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-103.6	127.6	-178.5	-65.8	0	0	0	0	110	L319 L323 G324 D325 E830 T831	L319-C321 PolarHBondContact O-N 3.46Å; C321-L323 PolarHBondContact O-N 2.94Å; C321-G324 PolarHBondContact O-N 2.99Å; C321-D325 WeakPolarHBondContact O-CB 3.48Å; C321-D325 VanDerWaalsContact O-CG 3.29Å; C321-D325 PolarHBondContact O-N 3.28Å; C321-E830 VanDerWaalsContact CB-CD 3.45Å; C321-E830 HydrophobicContact CB-CG 3.94Å; C321-E830 WeakPolarHBondContact CB-OE2 3.43Å; C321-T831 WeakPolarHBondContact SG-CG2 3.31Å
322	L	82.3	Confident	83.2	Confident	16 Å²	16	49.9 Å²	49.9	8%	0.084	25%	0.247	C	C	.	.	H	α-helix	trans	-61.8	-47.9	-171.7	-70.4	169.2	0	0	0	112.2	V258 P267 G269 C271 G324 D325 F326	V258-L322 HydrophobicContact CG1-CD1 4.03Å; P267-L322 HydrophobicContact CB-CB 4.06Å; P267-L322 HydrophobicContact CB-CD1 4.35Å; P267-L322 HydrophobicContact CG-CB 4.4Å; G269-L322 WeakPolarHBondContact O-CB 3.44Å; G269-L322 VanDerWaalsContact O-CG 3.31Å; G269-L322 WeakPolarHBondContact O-CG 3.48Å; G269-L322 PolarHBondContact O-N 3.18Å; C271-L322 WeakPolarHBondContact SG-CD2 2.92Å; L322-G324 VanDerWaalsContact C-N 3.32Å; L322-G324 PolarHBondContact O-N 3.41Å; L322-D325 PolarHBondContact O-N 3.22Å; L322-F326 HydrophobicContact CD2-CE2 4.38Å; L322-F326 WeakPolarHBondContact O-CB 3.41Å; L322-F326 WeakPolarHBondContact O-CD2 3.41Å; L322-F326 PolarHBondContact O-N 3.19Å
323	L	85.1	Confident	82.9	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-63.8	-43.9	-179.4	176.8	69.7	0	0	0	110.3	L266 P267 F268 C321 F326 I327 A778 L782 E830	L266-L323 HydrophobicContact CB-CD1 3.82Å; L266-L323 HydrophobicContact CD1-CD1 3.71Å; L266-L323 HydrophobicContact CG-CD1 4.26Å; P267-L323 WeakPolarHBondContact O-CA 3.18Å; P267-L323 WeakPolarHBondContact O-CB 3.27Å; P267-L323 PolarHBondContact O-N 2.96Å; F268-L323 HydrophobicContact CD2-CB 4.42Å; F268-L323 HydrophobicContact CD2-CD2 4.28Å; C321-L323 PolarHBondContact O-N 2.94Å; L323-F326 PolarHBondContact O-N 3.02Å; L323-I327 HydrophobicContact CD1-CD1 3.78Å; L323-I327 HydrophobicContact CD1-CG1 4.31Å; L323-I327 HydrophobicContact CG-CD1 3.75Å; L323-I327 WeakPolarHBondContact O-CD1 3.25Å; L323-I327 VanDerWaalsContact O-CG1 3.25Å; L323-I327 WeakPolarHBondContact O-CG1 3.44Å; L323-I327 PolarHBondContact O-N 3.43Å; L323-A778 HydrophobicContact CD1-CB 4.17Å; L323-A778 HydrophobicContact CD2-CB 4.42Å; L323-L782 HydrophobicContact CD2-CD1 4.38Å; L323-L782 HydrophobicContact CD2-CD2 4.09Å; L323-L782 HydrophobicContact CD2-CG 3.89Å; L323-E830 VanDerWaalsContact CB-CD 3.46Å; L323-E830 VanDerWaalsContact CB-OE1 3.28Å; L323-E830 WeakPolarHBondContact CB-OE1 3.34Å; L323-E830 VanDerWaalsContact CB-OE2 3.26Å; L323-E830 WeakPolarHBondContact CB-OE2 3.44Å; L323-E830 PolarHBondContact N-OE1 3.06Å; L323-E830 PolarHBondContact N-OE2 3.02Å
324	G	84.5	Confident	82.6	Confident	2 Å²	2	44.6 Å²	44.6	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-58.2	-46.9	176.3	0	0	0	0	0	113.9	C321 L322 I327 T328 E830	C321-G324 PolarHBondContact O-N 2.99Å; L322-G324 VanDerWaalsContact C-N 3.32Å; L322-G324 PolarHBondContact O-N 3.41Å; G324-I327 PolarHBondContact O-N 2.92Å; G324-T328 VanDerWaalsContact O-CB 3.24Å; G324-T328 WeakPolarHBondContact O-CB 3.49Å; G324-T328 PolarHBondContact O-N 2.74Å; G324-T328 PolarHBondContact O-OG1 3.08Å; G324-E830 PolarHBondContact N-OE2 2.7Å
325	D	85.1	Confident	82.3	Confident	49 Å²	49	42.4 Å²	42.4	26%	0.262	23%	0.227	S	C	.	.	H	α-helix	trans	-65.4	-43.5	-179.9	-73.8	-19.7	0	0	0	111.7	C321 L322 I327 T328 E329 Y473	C321-D325 WeakPolarHBondContact O-CB 3.48Å; C321-D325 VanDerWaalsContact O-CG 3.29Å; C321-D325 PolarHBondContact O-N 3.28Å; L322-D325 PolarHBondContact O-N 3.22Å; D325-I327 PolarHBondContact O-N 3.42Å; D325-T328 PolarHBondContact O-N 2.85Å; D325-E329 WeakPolarHBondContact O-CB 3.39Å; D325-E329 WeakPolarHBondContact O-CG 3.34Å; D325-E329 PolarHBondContact O-N 3.45Å; D325-Y473 HydrophobicContact CB-CE2 3.92Å
326	F	85.5	Confident	82	Confident	9 Å²	9	43.8 Å²	43.8	4%	0.039	23%	0.23	C	C	.	.	H	α-helix	trans	-62.6	-44.1	178	-86.6	-110.3	0	0	0	112	P267 L322 L323 F330 M470 Y473	P267-F326 HydrophobicContact CB-CE2 4.38Å; P267-F326 HydrophobicContact CG-CD1 3.92Å; P267-F326 HydrophobicContact CG-CD2 3.62Å; P267-F326 HydrophobicContact CG-CE1 3.84Å; P267-F326 HydrophobicContact CG-CE2 3.48Å; P267-F326 VanDerWaalsContact CG-CE2 3.48Å; P267-F326 HydrophobicContact CG-CG 3.8Å; P267-F326 HydrophobicContact CG-CZ 3.6Å; L322-F326 HydrophobicContact CD2-CE2 4.38Å; L322-F326 WeakPolarHBondContact O-CB 3.41Å; L322-F326 WeakPolarHBondContact O-CD2 3.41Å; L322-F326 PolarHBondContact O-N 3.19Å; L323-F326 PolarHBondContact O-N 3.02Å; F326-F330 VanDerWaalsContact O-CB 3.32Å; F326-F330 WeakPolarHBondContact O-CB 3.46Å; F326-F330 PolarHBondContact O-N 3.19Å; F326-M470 HydrophobicContact CD1-CE 4.35Å; F326-M470 HydrophobicContact CD1-SD 3.81Å; F326-M470 HydrophobicContact CE1-CE 3.39Å; F326-M470 HydrophobicContact CE1-SD 3.4Å; F326-M470 WeakPolarHBondContact CE1-SD 3.31Å; F326-M470 HydrophobicContact CZ-CE 3.79Å; F326-M470 HydrophobicContact CZ-SD 4.33Å; F326-Y473 HydrophobicContact CD1-CD1 4.39Å; F326-Y473 HydrophobicContact CD1-CD2 4.48Å; F326-Y473 AromaticContact CD1-CG 3.95Å; F326-Y473 HydrophobicContact CD1-CG 3.95Å; F326-Y473 AromaticContact CD2-CD1 3.89Å; F326-Y473 HydrophobicContact CD2-CD1 3.89Å; F326-Y473 AromaticContact CD2-CD2 3.83Å; F326-Y473 HydrophobicContact CD2-CD2 3.83Å; F326-Y473 HydrophobicContact CD2-CE1 4.01Å; F326-Y473 AromaticContact CD2-CE2 3.97Å; F326-Y473 HydrophobicContact CD2-CE2 3.97Å; F326-Y473 AromaticContact CD2-CG 3.78Å; F326-Y473 HydrophobicContact CD2-CG 3.78Å; F326-Y473 VanDerWaalsContact CE1-CB 3.45Å; F326-Y473 AromaticContact CE1-CD1 3.72Å; F326-Y473 HydrophobicContact CE1-CD1 3.72Å; F326-Y473 AromaticContact CE1-CG 3.68Å; F326-Y473 HydrophobicContact CE1-CG 3.68Å; F326-Y473 AromaticContact CE2-CD1 3.2Å; F326-Y473 HydrophobicContact CE2-CD1 3.2Å; F326-Y473 HydrophobicContact CE2-CD2 4.02Å; F326-Y473 AromaticContact CE2-CE1 3.28Å; F326-Y473 HydrophobicContact CE2-CE1 3.28Å; F326-Y473 HydrophobicContact CE2-CE2 4.1Å; F326-Y473 AromaticContact CE2-CG 3.57Å; F326-Y473 HydrophobicContact CE2-CG 3.57Å; F326-Y473 AromaticContact CE2-CZ 3.74Å; F326-Y473 HydrophobicContact CG-CD1 4.48Å; F326-Y473 HydrophobicContact CG-CD2 4.13Å; F326-Y473 HydrophobicContact CG-CG 4.02Å; F326-Y473 AromaticContact CZ-CD1 3.09Å; F326-Y473 HydrophobicContact CZ-CD1 3.09Å; F326-Y473 HydrophobicContact CZ-CD2 4.39Å; F326-Y473 AromaticContact CZ-CE1 3.65Å; F326-Y473 HydrophobicContact CZ-CE1 3.65Å; F326-Y473 AromaticContact CZ-CG 3.52Å; F326-Y473 HydrophobicContact CZ-CG 3.52Å
327	I	88	Confident	81.9	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-68.7	-40.8	178.1	-64	166.4	0	0	0	110.8	L323 G324 D325 F330 F331 L774 L775 A778 I823	L323-I327 HydrophobicContact CD1-CD1 3.78Å; L323-I327 HydrophobicContact CD1-CG1 4.31Å; L323-I327 HydrophobicContact CG-CD1 3.75Å; L323-I327 WeakPolarHBondContact O-CD1 3.25Å; L323-I327 VanDerWaalsContact O-CG1 3.25Å; L323-I327 WeakPolarHBondContact O-CG1 3.44Å; L323-I327 PolarHBondContact O-N 3.43Å; G324-I327 PolarHBondContact O-N 2.92Å; D325-I327 PolarHBondContact O-N 3.42Å; I327-F330 PolarHBondContact O-N 3.41Å; I327-F331 WeakPolarHBondContact O-CB 3.42Å; I327-F331 PolarHBondContact O-N 2.98Å; I327-L774 HydrophobicContact CG1-CD2 4.49Å; I327-L775 HydrophobicContact CG2-CD2 4.14Å; I327-A778 HydrophobicContact CD1-CB 3.38Å; I327-A778 HydrophobicContact CG1-CB 4.41Å; I327-I823 HydrophobicContact CB-CG2 4.49Å; I327-I823 HydrophobicContact CG2-CB 4.48Å; I327-I823 HydrophobicContact CG2-CD1 4.01Å; I327-I823 HydrophobicContact CG2-CG1 3.84Å; I327-I823 HydrophobicContact CG2-CG2 3.84Å
328	T	87.4	Confident	82.2	Confident	42 Å²	42	49.3 Å²	49.3	26%	0.258	25%	0.245	S	C	.	.	H	α-helix	trans	-67.1	-42.4	-179.2	-56.6	0	0	0	0	111.2	G324 D325 F331 K332	G324-T328 VanDerWaalsContact O-CB 3.24Å; G324-T328 WeakPolarHBondContact O-CB 3.49Å; G324-T328 PolarHBondContact O-N 2.74Å; G324-T328 PolarHBondContact O-OG1 3.08Å; D325-T328 PolarHBondContact O-N 2.85Å; T328-F331 PolarHBondContact O-N 3.38Å; T328-K332 WeakPolarHBondContact O-CG 3.42Å; T328-K332 PolarHBondContact O-N 2.93Å
329	E	85.7	Confident	82.5	Confident	71 Å²	71	43.3 Å²	43.3	33%	0.332	22%	0.215	S	C	.	.	H	α-helix	trans	-65.1	-39.7	173.1	-75.6	-56.7	139.5	0	0	112.3	D325 F331 K332 L333 N472 Y473	D325-E329 WeakPolarHBondContact O-CB 3.39Å; D325-E329 WeakPolarHBondContact O-CG 3.34Å; D325-E329 PolarHBondContact O-N 3.45Å; E329-F331 VanDerWaalsContact C-N 3.33Å; E329-F331 PolarHBondContact O-N 2.96Å; E329-K332 WeakPolarHBondContact O-CB 3.42Å; E329-K332 PolarHBondContact O-N 3.28Å; E329-K332 IonicContact OE1-NZ 3.5Å; E329-K332 PolarHBondContact OE1-NZ 2.94Å; E329-L333 PolarHBondContact O-N 3.5Å; E329-N472 PolarHBondContact O-ND2 3.23Å; E329-Y473 HydrophobicContact CB-CD2 4.34Å; E329-Y473 HydrophobicContact CG-CD2 4.07Å; E329-Y473 HydrophobicContact CG-CE2 4.34Å
330	F	86.9	Confident	82.3	Confident	1 Å²	1	43.2 Å²	43.2	0%	0.004	22%	0.218	C	C	.	.	H	α-helix	trans	-64.9	-37.7	173.8	-169.6	-90.4	0	0	0	112.1	F326 I327 K332 L333 C334 L468 C469 A767 L770 L771 L774	F326-F330 VanDerWaalsContact O-CB 3.32Å; F326-F330 WeakPolarHBondContact O-CB 3.46Å; F326-F330 PolarHBondContact O-N 3.19Å; I327-F330 PolarHBondContact O-N 3.41Å; F330-K332 VanDerWaalsContact C-N 3.33Å; F330-K332 PolarHBondContact O-N 3.45Å; F330-L333 HydrophobicContact CD2-CD1 4.26Å; F330-L333 VanDerWaalsContact O-CB 3.29Å; F330-L333 WeakPolarHBondContact O-CB 3.46Å; F330-L333 PolarHBondContact O-N 2.9Å; F330-L333 VanDerWaalsContact O-N 3.12Å; F330-C334 PolarHBondContact O-N 3.22Å; F330-L468 HydrophobicContact CE2-CB 4.28Å; F330-C469 HydrophobicContact CD2-CB 4.15Å; F330-A767 HydrophobicContact CE1-CB 4.01Å; F330-A767 WeakPolarHBondContact CE1-O 3.1Å; F330-A767 HydrophobicContact CE2-CB 4.36Å; F330-A767 HydrophobicContact CZ-CB 3.83Å; F330-L770 HydrophobicContact CZ-CB 4.06Å; F330-L771 HydrophobicContact CD1-CD1 4.04Å; F330-L771 HydrophobicContact CE1-CB 4.31Å; F330-L771 HydrophobicContact CE1-CD1 4.25Å; F330-L774 HydrophobicContact CB-CD2 3.66Å; F330-L774 HydrophobicContact CD1-CD2 3.31Å; F330-L774 HydrophobicContact CD2-CD2 4.11Å; F330-L774 HydrophobicContact CE1-CD2 3.9Å; F330-L774 HydrophobicContact CG-CD2 3.41Å; F330-L774 VanDerWaalsContact CG-CD2 3.41Å; F330-L774 HydrophobicContact CZ-CD2 4.5Å
331	F	86.6	Confident	81.9	Confident	17 Å²	17	46 Å²	46	8%	0.075	23%	0.231	C	C	.	.	H	α-helix	trans	-65.1	-36	175.4	176.9	-114.2	0	0	0	112.2	I327 T328 E329 L333 C334 Y816 L819 E820 I823	I327-F331 WeakPolarHBondContact O-CB 3.42Å; I327-F331 PolarHBondContact O-N 2.98Å; T328-F331 PolarHBondContact O-N 3.38Å; E329-F331 VanDerWaalsContact C-N 3.33Å; E329-F331 PolarHBondContact O-N 2.96Å; F331-L333 PolarHBondContact O-N 2.97Å; F331-C334 WeakPolarHBondContact O-CB 3.45Å; F331-C334 PolarHBondContact O-N 3.32Å; F331-C334 VanDerWaalsContact O-N 3.13Å; F331-Y816 AromaticContact CE2-CD1 3.68Å; F331-Y816 HydrophobicContact CE2-CD1 3.68Å; F331-Y816 HydrophobicContact CE2-CE1 4.3Å; F331-Y816 AromaticContact CZ-CD1 3.71Å; F331-Y816 HydrophobicContact CZ-CD1 3.71Å; F331-Y816 HydrophobicContact CZ-CG 4.45Å; F331-Y816 WeakPolarHBondContact CZ-O 3.34Å; F331-L819 HydrophobicContact CD2-CD2 3.84Å; F331-L819 HydrophobicContact CD2-CG 4.13Å; F331-L819 HydrophobicContact CE2-CB 4.14Å; F331-L819 HydrophobicContact CE2-CD2 3.35Å; F331-L819 HydrophobicContact CE2-CG 3.7Å; F331-L819 HydrophobicContact CZ-CB 4.41Å; F331-L819 HydrophobicContact CZ-CD2 4.35Å; F331-L819 HydrophobicContact CZ-CG 4.39Å; F331-E820 HydrophobicContact CE1-CB 4Å; F331-E820 HydrophobicContact CE1-CG 4.44Å; F331-E820 HydrophobicContact CZ-CB 4.37Å; F331-I823 HydrophobicContact CB-CD1 3.63Å; F331-I823 HydrophobicContact CD1-CD1 4.02Å; F331-I823 HydrophobicContact CD2-CD1 3.94Å; F331-I823 HydrophobicContact CG-CD1 3.58Å
332	K	86.1	Confident	81.4	Confident	103 Å²	103	51.2 Å²	51.2	45%	0.448	26%	0.255	S	S	.	.	H	α-helix	trans	-60.5	-32.7	171.8	-69.9	171.9	-170.8	170.4	0	112.2	T328 E329 F330 C335	T328-K332 WeakPolarHBondContact O-CG 3.42Å; T328-K332 PolarHBondContact O-N 2.93Å; E329-K332 WeakPolarHBondContact O-CB 3.42Å; E329-K332 PolarHBondContact O-N 3.28Å; E329-K332 IonicContact OE1-NZ 3.5Å; E329-K332 PolarHBondContact OE1-NZ 2.94Å; F330-K332 VanDerWaalsContact C-N 3.33Å; F330-K332 PolarHBondContact O-N 3.45Å; K332-C335 PolarHBondContact O-N 3.36Å
333	L	84	Confident	80.7	Confident	12 Å²	12	51.9 Å²	51.9	6%	0.063	26%	0.259	C	S	.	.	H	α-helix	trans	-64.5	-37.6	174.2	-66	179.3	0	0	0	112.8	E329 F330 F331 C335 Q336 N472 L478 V481 G764 A767	E329-L333 PolarHBondContact O-N 3.5Å; F330-L333 HydrophobicContact CD2-CD1 4.26Å; F330-L333 VanDerWaalsContact O-CB 3.29Å; F330-L333 WeakPolarHBondContact O-CB 3.46Å; F330-L333 PolarHBondContact O-N 2.9Å; F330-L333 VanDerWaalsContact O-N 3.12Å; F331-L333 PolarHBondContact O-N 2.97Å; L333-C335 PolarHBondContact O-N 3.36Å; L333-C335 VanDerWaalsContact O-N 3.09Å; L333-Q336 WeakPolarHBondContact O-CB 3.38Å; L333-Q336 PolarHBondContact O-N 3.22Å; L333-N472 HydrophobicContact CD1-CB 3.83Å; L333-N472 WeakPolarHBondContact CD1-ND2 3.3Å; L333-N472 WeakPolarHBondContact CD1-OD1 3.23Å; L333-N472 WeakPolarHBondContact CD2-OD1 3.44Å; L333-L478 HydrophobicContact CD2-CB 4.11Å; L333-L478 HydrophobicContact CD2-CD1 3.73Å; L333-L478 HydrophobicContact CD2-CG 4.5Å; L333-V481 HydrophobicContact CD1-CG2 4.34Å; L333-G764 WeakPolarHBondContact O-CA 3.45Å; L333-A767 HydrophobicContact CB-CB 4.06Å
334	C	83.1	Confident	79.8	Confident	8 Å²	8	54.4 Å²	54.4	5%	0.054	27%	0.272	C	S	.	.	H	α-helix	trans	-59.1	-23.5	178.1	-62.9	0	0	0	0	112.7	F330 F331 Y816	F330-C334 PolarHBondContact O-N 3.22Å; F331-C334 WeakPolarHBondContact O-CB 3.45Å; F331-C334 PolarHBondContact O-N 3.32Å; F331-C334 VanDerWaalsContact O-N 3.13Å; C334-Y816 HydrophobicContact CB-CE1 4.49Å
335	C	79.1	Confident	78.4	Confident	66 Å²	66	56.3 Å²	56.3	45%	0.446	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-9	179.2	-63.5	0	0	0	0	113.7	K332 L333	K332-C335 PolarHBondContact O-N 3.36Å; L333-C335 PolarHBondContact O-N 3.36Å; L333-C335 VanDerWaalsContact O-N 3.09Å
336	Q	79.8	Confident	76.5	Confident	82 Å²	82	63.1 Å²	63.1	38%	0.383	31%	0.313	S	S	.	.			trans	-80.4	140.2	-177.1	-61.8	-63.8	-12.6	0	0	111.9	L333 L478	L333-Q336 WeakPolarHBondContact O-CB 3.38Å; L333-Q336 PolarHBondContact O-N 3.22Å; Q336-L478 HydrophobicContact CG-CD2 4.43Å
337	K	77.4	Confident	74.2	Confident	171 Å²	171	68.9 Å²	68.9	74%	0.743	35%	0.349	S	S	*	.			trans	-113.8	-1.4	-175.5	-64.8	-175	-179.5	179.2	0	114.7	K762	K337-K762 PolarHBondContact O-NZ 2.83Å
338	E	77.6	Confident	72	Confident	95 Å²	95	72.6 Å²	72.6	44%	0.444	37%	0.369	S	S	.	.			trans	-70.8	145.1	-177.3	-59.3	-179	171.5	0	0	111.1	I343	E338-I343 HydrophobicContact CB-CD1 3.87Å; E338-I343 HydrophobicContact CB-CG1 3.7Å
339	S	76.7	Confident	69.8	Low	31 Å²	31	72.9 Å²	72.9	22%	0.217	38%	0.376	C	S	.	.			trans	-83.5	154.8	175.2	62.4	0	0	0	0	111.8	E341 E342 I343	S339-E341 PolarHBondContact O-N 3.39Å; S339-E342 PolarHBondContact N-OE2 2.96Å; S339-E342 PolarHBondContact O-N 2.72Å; S339-E342 WeakPolarHBondContact OG-CB 3.48Å; S339-E342 WeakPolarHBondContact OG-CG 3.45Å; S339-E342 PolarHBondContact OG-N 3.45Å; S339-E342 PolarHBondContact OG-OE2 2.82Å; S339-I343 WeakPolarHBondContact O-CD1 3.4Å; S339-I343 VanDerWaalsContact O-CG1 3.29Å; S339-I343 WeakPolarHBondContact O-CG1 3.43Å; S339-I343 PolarHBondContact O-N 3.15Å
340	A	70.8	Confident	67.7	Low	24 Å²	24	78.3 Å²	78.3	20%	0.198	40%	0.401	C	S	.	.	H	α-helix	trans	-56.9	-33.6	179.4	0	0	0	0	0	112.7	L344 A482 P763	A340-L344 WeakPolarHBondContact O-CB 3.4Å; A340-L344 WeakPolarHBondContact O-CG 3.41Å; A340-L344 PolarHBondContact O-N 2.97Å; A340-L344 VanDerWaalsContact O-N 3.11Å; A340-A482 HydrophobicContact CB-CB 4.2Å; A340-P763 HydrophobicContact CB-CG 4.21Å
341	E	67.2	Low	65.6	Low	164 Å²	164	84.6 Å²	84.6	77%	0.766	43%	0.43	S	S	*	.	H	α-helix	trans	-73.1	-31	177.1	-62.7	-178.4	174.4	0	0	113.3	S339	S339-E341 PolarHBondContact O-N 3.39Å
342	E	70.6	Confident	63.5	Low	109 Å²	109	88.4 Å²	88.4	51%	0.509	45%	0.448	S	S	.	.	H	α-helix	trans	-74	-37.7	174.2	-73.8	162.8	161	0	0	111.5	S339 G345	S339-E342 PolarHBondContact N-OE2 2.96Å; S339-E342 PolarHBondContact O-N 2.72Å; S339-E342 WeakPolarHBondContact OG-CB 3.48Å; S339-E342 WeakPolarHBondContact OG-CG 3.45Å; S339-E342 PolarHBondContact OG-N 3.45Å; S339-E342 PolarHBondContact OG-OE2 2.82Å; E342-G345 PolarHBondContact O-N 3.44Å
343	I	68.2	Low	61.5	Low	30 Å²	30	85.8 Å²	85.8	15%	0.154	45%	0.451	C	S	.	.	H	α-helix	trans	-71.9	-40.8	-178	-64.9	157.3	0	0	0	111.8	E338 S339 G345 L478 A479 A482 P763	E338-I343 HydrophobicContact CB-CD1 3.87Å; E338-I343 HydrophobicContact CB-CG1 3.7Å; S339-I343 WeakPolarHBondContact O-CD1 3.4Å; S339-I343 VanDerWaalsContact O-CG1 3.29Å; S339-I343 WeakPolarHBondContact O-CG1 3.43Å; S339-I343 PolarHBondContact O-N 3.15Å; I343-G345 PolarHBondContact O-N 3.46Å; I343-L478 HydrophobicContact CD1-CD1 4.05Å; I343-L478 HydrophobicContact CD1-CD2 3.67Å; I343-L478 HydrophobicContact CD1-CG 3.72Å; I343-L478 HydrophobicContact CG1-CD2 3.87Å; I343-L478 HydrophobicContact CG1-CG 4.22Å; I343-L478 HydrophobicContact CG2-CD2 4.35Å; I343-L478 HydrophobicContact CG2-CG 4.08Å; I343-A479 HydrophobicContact CG2-CB 4.02Å; I343-A482 HydrophobicContact CG2-CB 4.22Å; I343-P763 HydrophobicContact CD1-CB 4.48Å; I343-P763 HydrophobicContact CD1-CG 3.81Å
344	L	66.6	Low	59.7	Low	55 Å²	55	91.5 Å²	91.5	29%	0.288	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-1.8	179.5	-65.4	170.7	0	0	0	113.3	A340 P401 A482 H483	A340-L344 WeakPolarHBondContact O-CB 3.4Å; A340-L344 WeakPolarHBondContact O-CG 3.41Å; A340-L344 PolarHBondContact O-N 2.97Å; A340-L344 VanDerWaalsContact O-N 3.11Å; L344-P401 HydrophobicContact CD2-CG 3.85Å; L344-A482 HydrophobicContact CD1-CB 4.31Å; L344-A482 HydrophobicContact CD2-CB 4.42Å; L344-A482 HydrophobicContact CG-CB 4.18Å; L344-H483 HydrophobicContact CD2-CB 4.08Å
345	G	54.5	Low	57.9	Low	41 Å²	41	94.7 Å²	94.7	42%	0.423	49%	0.491	S	S	.	.			trans	86.7	126.7	174.2	0	0	0	0	0	114.3	E342 I343 V347	E342-G345 PolarHBondContact O-N 3.44Å; I343-G345 PolarHBondContact O-N 3.46Å; G345-V347 VanDerWaalsContact C-N 3.32Å; G345-V347 PolarHBondContact O-N 2.92Å
346	R	44.9	Very low	56.4	Low	193 Å²	193	96.2 Å²	96.2	73%	0.728	50%	0.495	S	S	*	.			trans	-66.3	86.1	160.1	-73	176.7	-178	-116.2	3.8	109.7	N348 A349	R346-N348 PolarHBondContact O-N 3.45Å; R346-A349 HydrophobicContact CB-CB 4.29Å
347	V	37.8	Very low	55.1	Low	130 Å²	130	95 Å²	95	79%	0.788	50%	0.496	S	S	*	.	S	Bend	trans	-72.2	-11.4	164.8	178.5	0	0	0	0	111.5	G345	G345-V347 VanDerWaalsContact C-N 3.32Å; G345-V347 PolarHBondContact O-N 2.92Å
348	N	42.1	Very low	53.9	Low	80 Å²	80	91.3 Å²	91.3	43%	0.428	48%	0.484	S	S	.	.			trans	-117.5	2.9	-165.2	-60.4	-15.4	0	0	0	116.8	R346 E350 E351 E352	R346-N348 PolarHBondContact O-N 3.45Å; N348-E350 VanDerWaalsContact C-N 3.26Å; N348-E350 PolarHBondContact O-N 3.32Å; N348-E351 PolarHBondContact O-N 2.7Å; N348-E352 HydrophobicContact CB-CG 4.39Å; N348-E352 WeakPolarHBondContact O-CB 3.45Å; N348-E352 PolarHBondContact O-N 2.88Å
349	A	40.9	Very low	52.9	Low	48 Å²	48	91.3 Å²	91.3	40%	0.397	49%	0.486	S	S	.	.	H	α-helix	trans	-69.9	-20.6	-174.8	0	0	0	0	0	114.3	R346	R346-A349 HydrophobicContact CB-CB 4.29Å
350	E	41.9	Very low	51.9	Low	185 Å²	185	93.9 Å²	93.9	86%	0.864	50%	0.504	S	S	*	.	H	α-helix	trans	-85.7	-27.3	173.6	-65.1	-171.4	167.6	0	0	112.7	N348	N348-E350 VanDerWaalsContact C-N 3.26Å; N348-E350 PolarHBondContact O-N 3.32Å
351	E	42.3	Very low	51.3	Low	132 Å²	132	94.3 Å²	94.3	62%	0.617	51%	0.506	S	S	*	.	H	α-helix	trans	-84.2	-35.1	175.7	-76.7	-167	154.4	0	0	112.9	N348 G353 Q354 E355	N348-E351 PolarHBondContact O-N 2.7Å; E351-G353 VanDerWaalsContact C-N 3.31Å; E351-G353 PolarHBondContact O-N 3.24Å; E351-Q354 WeakPolarHBondContact O-CB 3.29Å; E351-Q354 PolarHBondContact O-N 3.18Å; E351-Q354 VanDerWaalsContact O-N 3.14Å; E351-E355 PolarHBondContact O-N 3.26Å
352	E	42.6	Very low	50.6	Low	97 Å²	97	88.9 Å²	88.9	45%	0.453	49%	0.489	S	S	.	.	H	α-helix	trans	-68	-28	178.4	-78.2	-172.5	165.7	0	0	113.3	N348 Q354 N356	N348-E352 HydrophobicContact CB-CG 4.39Å; N348-E352 WeakPolarHBondContact O-CB 3.45Å; N348-E352 PolarHBondContact O-N 2.88Å; E352-Q354 VanDerWaalsContact C-N 3.29Å; E352-Q354 PolarHBondContact O-N 3.06Å; E352-N356 VanDerWaalsContact O-CB 3.24Å; E352-N356 WeakPolarHBondContact O-CB 3.29Å; E352-N356 VanDerWaalsContact O-CG 3.32Å; E352-N356 PolarHBondContact O-N 3.03Å; E352-N356 PolarHBondContact O-ND2 3.35Å
353	G	44.1	Very low	49.8	Very low	49 Å²	49	88.5 Å²	88.5	51%	0.505	49%	0.49	S	S	.	.	H	α-helix	trans	-64.5	-35.2	171.9	0	0	0	0	0	112.4	E351 S357	E351-G353 VanDerWaalsContact C-N 3.31Å; E351-G353 PolarHBondContact O-N 3.24Å; G353-S357 WeakPolarHBondContact O-CB 3.46Å; G353-S357 PolarHBondContact O-N 3.43Å
354	Q	45.1	Very low	49.1	Very low	132 Å²	132	89.8 Å²	89.8	62%	0.617	50%	0.502	S	S	*	.	H	α-helix	trans	-75.6	-44.4	176.5	-157	78.1	18.7	0	0	110.7	E351 E352 S357 D358	E351-Q354 WeakPolarHBondContact O-CB 3.29Å; E351-Q354 PolarHBondContact O-N 3.18Å; E351-Q354 VanDerWaalsContact O-N 3.14Å; E352-Q354 VanDerWaalsContact C-N 3.29Å; E352-Q354 PolarHBondContact O-N 3.06Å; Q354-S357 WeakPolarHBondContact O-CB 3.38Å; Q354-S357 PolarHBondContact O-N 3.05Å; Q354-S357 PolarHBondContact O-OG 3.01Å; Q354-D358 PolarHBondContact O-N 2.91Å
355	E	45.3	Very low	48.6	Very low	74 Å²	74	94.1 Å²	94.1	35%	0.346	52%	0.518	S	S	.	.	H	α-helix	trans	-71.1	-37.2	-178.8	-70.2	-169.8	154.6	0	0	113.7	E351 S357 D358 I359 R390	E351-E355 PolarHBondContact O-N 3.26Å; E355-S357 VanDerWaalsContact C-N 3.3Å; E355-S357 PolarHBondContact O-N 3.18Å; E355-D358 WeakPolarHBondContact O-CB 3.4Å; E355-D358 PolarHBondContact O-N 3.24Å; E355-D358 VanDerWaalsContact O-N 3.14Å; E355-I359 WeakPolarHBondContact O-CG1 3.46Å; E355-I359 PolarHBondContact O-N 2.91Å; E355-R390 IonicContact OE1-NH2 3.87Å; E355-R390 PolarHBondContact OE1-NH2 2.89Å; E355-R390 IonicContact OE2-CZ 3.58Å; E355-R390 IonicContact OE2-NH1 3.4Å; E355-R390 IonicContact OE2-NH2 3.88Å; E355-R390 PolarHBondContact OE2-NH2 3.39Å
356	N	47.3	Very low	48.3	Very low	98 Å²	98	98.4 Å²	98.4	52%	0.524	53%	0.53	S	S	.	.	H	α-helix	trans	-69	-31.4	174.5	-74.5	-34.1	0	0	0	111.8	E352 D358 S360	E352-N356 VanDerWaalsContact O-CB 3.24Å; E352-N356 WeakPolarHBondContact O-CB 3.29Å; E352-N356 VanDerWaalsContact O-CG 3.32Å; E352-N356 PolarHBondContact O-N 3.03Å; E352-N356 PolarHBondContact O-ND2 3.35Å; N356-D358 VanDerWaalsContact C-N 3.32Å; N356-S360 WeakPolarHBondContact O-CB 3.39Å; N356-S360 PolarHBondContact O-N 3.29Å
357	S	52.3	Low	48.7	Very low	58 Å²	58	94.7 Å²	94.7	41%	0.406	53%	0.529	S	S	.	.	H	α-helix	trans	-65.3	-37.6	169.7	87.8	0	0	0	0	111.3	G353 Q354 E355 S361	G353-S357 WeakPolarHBondContact O-CB 3.46Å; G353-S357 PolarHBondContact O-N 3.43Å; Q354-S357 WeakPolarHBondContact O-CB 3.38Å; Q354-S357 PolarHBondContact O-N 3.05Å; Q354-S357 PolarHBondContact O-OG 3.01Å; E355-S357 VanDerWaalsContact C-N 3.3Å; E355-S357 PolarHBondContact O-N 3.18Å; S357-S361 WeakPolarHBondContact O-CB 3.41Å; S357-S361 PolarHBondContact O-N 3.15Å
358	D	53	Low	49.2	Very low	92 Å²	92	95.5 Å²	95.5	49%	0.492	52%	0.524	S	S	.	.	H	α-helix	trans	-70.2	-38	177.9	-80.2	-25.3	0	0	0	112.3	Q354 E355 N356 S361 A362	Q354-D358 PolarHBondContact O-N 2.91Å; E355-D358 WeakPolarHBondContact O-CB 3.4Å; E355-D358 PolarHBondContact O-N 3.24Å; E355-D358 VanDerWaalsContact O-N 3.14Å; N356-D358 VanDerWaalsContact C-N 3.32Å; D358-S361 PolarHBondContact O-N 3.49Å; D358-S361 PolarHBondContact O-OG 3.2Å; D358-A362 VanDerWaalsContact O-CB 3.28Å; D358-A362 WeakPolarHBondContact O-CB 3.45Å; D358-A362 PolarHBondContact O-N 2.9Å
359	I	57.3	Low	49.4	Very low	96 Å²	96	97.9 Å²	97.9	49%	0.492	55%	0.545	S	S	.	.	H	α-helix	trans	-70	-44.7	176	-62.6	163.3	0	0	0	111.1	E355 S361 A362 L363	E355-I359 WeakPolarHBondContact O-CG1 3.46Å; E355-I359 PolarHBondContact O-N 2.91Å; I359-S361 VanDerWaalsContact C-N 3.3Å; I359-S361 PolarHBondContact O-N 3.06Å; I359-A362 PolarHBondContact O-N 3.46Å; I359-L363 HydrophobicContact CG2-CD1 4.05Å; I359-L363 WeakPolarHBondContact O-CB 3.34Å; I359-L363 WeakPolarHBondContact O-CG 3.4Å; I359-L363 PolarHBondContact O-N 3.17Å
360	S	55.8	Low	49.7	Very low	84 Å²	84	100.3 Å²	100.3	59%	0.587	56%	0.564	S	S	*	*	H	α-helix	trans	-64	-34.9	172.2	-98.9	0	0	0	0	112.3	N356 S364	N356-S360 WeakPolarHBondContact O-CB 3.39Å; N356-S360 PolarHBondContact O-N 3.29Å; S360-S364 WeakPolarHBondContact O-CB 3.43Å; S360-S364 PolarHBondContact O-N 3.05Å; S360-S364 PolarHBondContact O-OG 3.24Å
361	S	57.9	Low	49.7	Very low	34 Å²	34	95.2 Å²	95.2	24%	0.238	55%	0.554	C	S	.	*	H	α-helix	trans	-70.1	-31.2	174.2	90.3	0	0	0	0	112.5	S357 D358 I359 S364 K365	S357-S361 WeakPolarHBondContact O-CB 3.41Å; S357-S361 PolarHBondContact O-N 3.15Å; D358-S361 PolarHBondContact O-N 3.49Å; D358-S361 PolarHBondContact O-OG 3.2Å; I359-S361 VanDerWaalsContact C-N 3.3Å; I359-S361 PolarHBondContact O-N 3.06Å; S361-S364 VanDerWaalsContact CA-OG 3.27Å; S361-S364 WeakPolarHBondContact CA-OG 3.34Å; S361-S364 PolarHBondContact O-OG 2.89Å; S361-S364 VanDerWaalsContact O-OG 3.08Å; S361-K365 WeakPolarHBondContact O-CB 3.47Å; S361-K365 VanDerWaalsContact O-CD 3.24Å; S361-K365 WeakPolarHBondContact O-CD 3.31Å; S361-K365 WeakPolarHBondContact O-CG 3.41Å; S361-K365 PolarHBondContact O-N 2.79Å; S361-K365 VanDerWaalsContact O-N 3.17Å
362	A	51.6	Low	49.8	Very low	49 Å²	49	95.5 Å²	95.5	41%	0.405	57%	0.568	S	S	.	*	H	α-helix	trans	-76.2	-37.9	177.1	0	0	0	0	0	111.8	D358 I359 K365 L366	D358-A362 VanDerWaalsContact O-CB 3.28Å; D358-A362 WeakPolarHBondContact O-CB 3.45Å; D358-A362 PolarHBondContact O-N 2.9Å; I359-A362 PolarHBondContact O-N 3.46Å; A362-K365 PolarHBondContact O-N 3.4Å; A362-L366 WeakPolarHBondContact O-CG 3.4Å; A362-L366 PolarHBondContact O-N 2.96Å
363	L	53.7	Low	49.8	Very low	101 Å²	101	96.4 Å²	96.4	53%	0.529	58%	0.579	S	S	.	*	H	α-helix	trans	-72.4	-35.7	175.6	-69.1	171.4	0	0	0	112.5	I359 L366	I359-L363 HydrophobicContact CG2-CD1 4.05Å; I359-L363 WeakPolarHBondContact O-CB 3.34Å; I359-L363 WeakPolarHBondContact O-CG 3.4Å; I359-L363 PolarHBondContact O-N 3.17Å; L363-L366 HydrophobicContact CD2-CD1 4.16Å; L363-L366 WeakPolarHBondContact O-CB 3.42Å; L363-L366 PolarHBondContact O-N 2.96Å
364	S	54.8	Low	49.7	Very low	58 Å²	58	98.9 Å²	98.9	41%	0.406	59%	0.586	S	S	.	*	H	α-helix	trans	-69.6	-30.8	171.9	50.4	0	0	0	0	113	S360 S361 L366 T367	S360-S364 WeakPolarHBondContact O-CB 3.43Å; S360-S364 PolarHBondContact O-N 3.05Å; S360-S364 PolarHBondContact O-OG 3.24Å; S361-S364 VanDerWaalsContact CA-OG 3.27Å; S361-S364 WeakPolarHBondContact CA-OG 3.34Å; S361-S364 PolarHBondContact O-OG 2.89Å; S361-S364 VanDerWaalsContact O-OG 3.08Å; S364-L366 VanDerWaalsContact C-N 3.25Å; S364-L366 PolarHBondContact O-N 3.2Å; S364-T367 PolarHBondContact O-N 2.8Å; S364-T367 PolarHBondContact O-OG1 2.84Å
365	K	54.3	Low	49.8	Very low	145 Å²	145	100.2 Å²	100.2	63%	0.63	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-16.1	170.8	-75.1	166.7	-170.7	157.8	0	113.8	S361 A362	S361-K365 WeakPolarHBondContact O-CB 3.47Å; S361-K365 VanDerWaalsContact O-CD 3.24Å; S361-K365 WeakPolarHBondContact O-CD 3.31Å; S361-K365 WeakPolarHBondContact O-CG 3.41Å; S361-K365 PolarHBondContact O-N 2.79Å; S361-K365 VanDerWaalsContact O-N 3.17Å; A362-K365 PolarHBondContact O-N 3.4Å
366	L	48.6	Very low	49.7	Very low	131 Å²	131	101.8 Å²	101.8	69%	0.686	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-16.5	173.9	-79.8	162.3	0	0	0	112.9	A362 L363 S364	A362-L366 WeakPolarHBondContact O-CG 3.4Å; A362-L366 PolarHBondContact O-N 2.96Å; L363-L366 HydrophobicContact CD2-CD1 4.16Å; L363-L366 WeakPolarHBondContact O-CB 3.42Å; L363-L366 PolarHBondContact O-N 2.96Å; S364-L366 VanDerWaalsContact C-N 3.25Å; S364-L366 PolarHBondContact O-N 3.2Å
367	T	53.1	Low	49.4	Very low	115 Å²	115	105.9 Å²	105.9	71%	0.706	63%	0.629	S	S	*	*	S	Bend	trans	-101.1	-4.1	-178.4	50.4	0	0	0	0	114.1	S364	S364-T367 PolarHBondContact O-N 2.8Å; S364-T367 PolarHBondContact O-OG1 2.84Å
368	E	48.9	Very low	49.1	Very low	147 Å²	147	109 Å²	109	69%	0.687	64%	0.641	S	S	*	*			trans	-86.7	122.7	174.9	-73.6	-174.8	173.7	0	0	112.4	A370	E368-A370 PolarHBondContact O-N 2.77Å
369	P	47.3	Very low	48.7	Very low	131 Å²	131	107.6 Å²	107.6	85%	0.851	64%	0.638	S	S	*	*	S	Bend	trans	-93	79.4	-178.7	35.6	-30.2	0	0	0	110.6
370	A	45.9	Very low	48.1	Very low	98 Å²	98	108.2 Å²	108.2	81%	0.81	65%	0.646	S	S	*	*			trans	166.1	81.6	151	0	0	0	0	0	113.1	E368	E368-A370 PolarHBondContact O-N 2.77Å
371	A	41.8	Very low	47.5	Very low	79 Å²	79	107.1 Å²	107.1	65%	0.653	64%	0.638	S	S	*	*			trans	-162.3	132.7	149.6	0	0	0	0	0	111	V373	A371-V373 PolarHBondContact O-N 3.3Å
372	P	45.8	Very low	46.7	Very low	138 Å²	138	108.2 Å²	108.2	90%	0.896	65%	0.646	S	S	*	*			trans	-79.2	109.4	174.6	31	-28.4	0	0	0	109.4
373	V	42.6	Very low	46.3	Very low	116 Å²	116	111.7 Å²	111.7	70%	0.703	66%	0.655	S	S	*	*			trans	-101.8	139	174	-175.3	0	0	0	0	109.6	A371 L375	A371-V373 PolarHBondContact O-N 3.3Å; V373-L375 PolarHBondContact O-N 3.15Å
374	P	42.2	Very low	45.8	Very low	100 Å²	100	110.4 Å²	110.4	65%	0.649	65%	0.652	S	S	*	*			trans	-69.2	126.5	-176.2	-11.8	26.7	0	0	0	111.8	S376	P374-S376 PolarHBondContact O-N 2.97Å
375	L	46.5	Very low	45.2	Very low	160 Å²	160	113.2 Å²	113.2	84%	0.838	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-65	4.2	-175.2	-78.1	157.8	0	0	0	116.1	V373 K377	V373-L375 PolarHBondContact O-N 3.15Å; L375-K377 PolarHBondContact O-N 2.91Å
376	S	42.9	Very low	44.5	Very low	107 Å²	107	109.6 Å²	109.6	75%	0.748	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-88.1	1.2	-173.2	68.6	0	0	0	0	115.3	P374	P374-S376 PolarHBondContact O-N 2.97Å
377	K	41.1	Very low	43.9	Very low	184 Å²	184	105.8 Å²	105.8	80%	0.8	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-114.4	2.4	178.8	-74.2	-170.1	177.8	-178.3	0	115.4	L375	L375-K377 PolarHBondContact O-N 2.91Å
378	L	45.2	Very low	43.1	Very low	125 Å²	125	106.8 Å²	106.8	65%	0.654	63%	0.629	S	S	*	*			trans	-106	44	179.3	-67.8	170.3	0	0	0	112.2
379	S	46.2	Very low	42.4	Very low	61 Å²	61	108.2 Å²	108.2	43%	0.427	63%	0.628	S	S	.	*			trans	-84.7	120.3	174.3	-171.8	0	0	0	0	110.1	S381 S382	S379-S381 PolarHBondContact O-N 3.31Å; S379-S381 VanDerWaalsContact O-N 3.09Å; S379-S381 PolarHBondContact OG-N 3.49Å; S379-S381 PolarHBondContact OG-OG 2.86Å; S379-S382 WeakPolarHBondContact O-CB 3.35Å; S379-S382 PolarHBondContact O-N 3.08Å; S379-S382 PolarHBondContact O-OG 3.48Å
380	V	43.5	Very low	42.1	Very low	109 Å²	109	108.8 Å²	108.8	66%	0.661	61%	0.614	S	S	*	*	H	α-helix	trans	-50.8	-29.9	171.6	-176.7	0	0	0	0	111.3	S382 M383 V384	V380-S382 VanDerWaalsContact C-N 3.28Å; V380-S382 PolarHBondContact O-N 3.4Å; V380-M383 PolarHBondContact O-N 2.9Å; V380-V384 HydrophobicContact CG1-CG2 4.17Å; V380-V384 VanDerWaalsContact O-CG2 3.31Å; V380-V384 WeakPolarHBondContact O-CG2 3.49Å; V380-V384 PolarHBondContact O-N 2.82Å
381	S	43.9	Very low	41.8	Very low	61 Å²	61	110.5 Å²	110.5	43%	0.427	61%	0.608	S	S	.	*	H	α-helix	trans	-57.8	-36.6	173.9	70.9	0	0	0	0	113.1	S379 V384 H385	S379-S381 PolarHBondContact O-N 3.31Å; S379-S381 VanDerWaalsContact O-N 3.09Å; S379-S381 PolarHBondContact OG-N 3.49Å; S379-S381 PolarHBondContact OG-OG 2.86Å; S381-V384 PolarHBondContact O-N 3.22Å; S381-H385 VanDerWaalsContact O-CB 3.27Å; S381-H385 WeakPolarHBondContact O-CB 3.44Å; S381-H385 PolarHBondContact O-CD2 3.09Å; S381-H385 VanDerWaalsContact O-CG 3.28Å; S381-H385 PolarHBondContact O-N 3.39Å
382	S	40.8	Very low	41.4	Very low	57 Å²	57	117.2 Å²	117.2	40%	0.399	62%	0.616	S	S	.	*	H	α-helix	trans	-72.4	-34	-179.7	73	0	0	0	0	112.7	S379 V380 S386	S379-S382 WeakPolarHBondContact O-CB 3.35Å; S379-S382 PolarHBondContact O-N 3.08Å; S379-S382 PolarHBondContact O-OG 3.48Å; V380-S382 VanDerWaalsContact C-N 3.28Å; V380-S382 PolarHBondContact O-N 3.4Å; S382-S386 WeakPolarHBondContact O-CB 3.41Å; S382-S386 PolarHBondContact O-N 3.04Å; S382-S386 PolarHBondContact O-OG 2.65Å
383	M	43.3	Very low	40.8	Very low	123 Å²	123	120.2 Å²	120.2	61%	0.606	61%	0.61	S	S	*	*	H	α-helix	trans	-70.8	-42.4	173.7	-69.9	-177.5	-160	0	0	111.2	V380 H385 S386 A387	V380-M383 PolarHBondContact O-N 2.9Å; M383-H385 PolarHBondContact O-N 3.09Å; M383-S386 PolarHBondContact O-N 3.44Å; M383-S386 VanDerWaalsContact O-N 3.15Å; M383-A387 PolarHBondContact O-N 3.31Å
384	V	43.8	Very low	40.7	Very low	74 Å²	74	122.6 Å²	122.6	45%	0.448	61%	0.613	S	S	.	*	H	α-helix	trans	-67.7	-35.2	176.6	179.4	0	0	0	0	111.5	V380 S381 S386 R388	V380-V384 HydrophobicContact CG1-CG2 4.17Å; V380-V384 VanDerWaalsContact O-CG2 3.31Å; V380-V384 WeakPolarHBondContact O-CG2 3.49Å; V380-V384 PolarHBondContact O-N 2.82Å; S381-V384 PolarHBondContact O-N 3.22Å; V384-S386 VanDerWaalsContact C-N 3.33Å; V384-R388 WeakPolarHBondContact O-CB 3.24Å; V384-R388 PolarHBondContact O-N 2.78Å
385	H	40.6	Very low	40.6	Very low	116 Å²	116	128.3 Å²	128.3	54%	0.537	62%	0.621	S	S	.	*	H	α-helix	trans	-69.9	-28.6	172	-78.3	-54.6	0	0	0	113.2	S381 M383 R389	S381-H385 VanDerWaalsContact O-CB 3.27Å; S381-H385 WeakPolarHBondContact O-CB 3.44Å; S381-H385 PolarHBondContact O-CD2 3.09Å; S381-H385 VanDerWaalsContact O-CG 3.28Å; S381-H385 PolarHBondContact O-N 3.39Å; M383-H385 PolarHBondContact O-N 3.09Å; H385-R389 WeakPolarHBondContact O-CB 3.47Å; H385-R389 WeakPolarHBondContact O-CG 3.42Å; H385-R389 PolarHBondContact O-N 2.93Å
386	S	40.2	Very low	40	Very low	69 Å²	69	128.4 Å²	128.4	48%	0.483	62%	0.617	S	S	.	*	H	α-helix	trans	-75.7	-40.2	174.5	-56.6	0	0	0	0	111.4	S382 M383 V384 R389 R390	S382-S386 WeakPolarHBondContact O-CB 3.41Å; S382-S386 PolarHBondContact O-N 3.04Å; S382-S386 PolarHBondContact O-OG 2.65Å; M383-S386 PolarHBondContact O-N 3.44Å; M383-S386 VanDerWaalsContact O-N 3.15Å; V384-S386 VanDerWaalsContact C-N 3.33Å; S386-R389 PolarHBondContact O-N 3.28Å; S386-R390 PolarHBondContact O-N 3.38Å
387	A	35.8	Very low	39.9	Very low	52 Å²	52	129.7 Å²	129.7	43%	0.43	61%	0.614	S	S	.	*	H	α-helix	trans	-65.8	-42.4	171.9	0	0	0	0	0	112.5	M383 R389 R390 I391	M383-A387 PolarHBondContact O-N 3.31Å; A387-R389 VanDerWaalsContact C-N 3.29Å; A387-R389 PolarHBondContact O-N 3.15Å; A387-R390 WeakPolarHBondContact O-CB 3.37Å; A387-R390 PolarHBondContact O-N 2.88Å; A387-R390 VanDerWaalsContact O-N 3.14Å; A387-I391 PolarHBondContact O-N 2.89Å; A387-I391 VanDerWaalsContact O-N 3.14Å
388	R	36.9	Very low	39.7	Very low	136 Å²	136	128.4 Å²	128.4	51%	0.513	62%	0.616	S	S	.	*	H	α-helix	trans	-66	-28.7	171.9	-85.3	-176.3	171.1	176.3	1.8	113	V384 R392	V384-R388 WeakPolarHBondContact O-CB 3.24Å; V384-R388 PolarHBondContact O-N 2.78Å; R388-R392 PolarHBondContact O-N 3.25Å; R388-R392 VanDerWaalsContact O-N 3.14Å
389	R	34.8	Very low	39.8	Very low	176 Å²	176	131.4 Å²	131.4	66%	0.664	63%	0.627	S	S	*	*	H	α-helix	trans	-72.4	-31.9	170.4	-84.8	-176.7	-179.8	-176.9	1.5	112.6	H385 S386 A387 R392 R393	H385-R389 WeakPolarHBondContact O-CB 3.47Å; H385-R389 WeakPolarHBondContact O-CG 3.42Å; H385-R389 PolarHBondContact O-N 2.93Å; S386-R389 PolarHBondContact O-N 3.28Å; A387-R389 VanDerWaalsContact C-N 3.29Å; A387-R389 PolarHBondContact O-N 3.15Å; R389-R392 PolarHBondContact O-N 2.89Å; R389-R393 WeakPolarHBondContact O-CB 3.33Å; R389-R393 WeakPolarHBondContact O-CG 3.42Å; R389-R393 PolarHBondContact O-N 2.96Å
390	R	40.3	Very low	40.4	Very low	144 Å²	144	131.6 Å²	131.6	54%	0.543	63%	0.628	S	S	.	*	H	α-helix	trans	-64.8	-38.4	171.1	-74.8	-175	-173.7	-172.3	1.2	112.4	E355 S386 A387 H394	E355-R390 IonicContact OE1-NH2 3.87Å; E355-R390 PolarHBondContact OE1-NH2 2.89Å; E355-R390 IonicContact OE2-CZ 3.58Å; E355-R390 IonicContact OE2-NH1 3.4Å; E355-R390 IonicContact OE2-NH2 3.88Å; E355-R390 PolarHBondContact OE2-NH2 3.39Å; S386-R390 PolarHBondContact O-N 3.38Å; A387-R390 WeakPolarHBondContact O-CB 3.37Å; A387-R390 PolarHBondContact O-N 2.88Å; A387-R390 VanDerWaalsContact O-N 3.14Å; R390-H394 PolarHBondContact O-ND1 3.42Å
391	I	40.7	Very low	41.5	Very low	134 Å²	134	129 Å²	129	69%	0.687	61%	0.614	S	S	*	*	H	α-helix	trans	-71.6	-32.6	176	-62.9	165.8	0	0	0	111.7	A387	A387-I391 PolarHBondContact O-N 2.89Å; A387-I391 VanDerWaalsContact O-N 3.14Å
392	R	33.1	Very low	42.9	Very low	219 Å²	219	126.2 Å²	126.2	83%	0.826	59%	0.594	S	S	*	*	H	α-helix	trans	-85.3	-16.8	176.7	-109.3	-179.3	177.7	-177.8	-0.9	115.1	R388 R389	R388-R392 PolarHBondContact O-N 3.25Å; R388-R392 VanDerWaalsContact O-N 3.14Å; R389-R392 PolarHBondContact O-N 2.89Å
393	R	33	Very low	44.5	Very low	202 Å²	202	129.6 Å²	129.6	76%	0.762	60%	0.603	S	S	*	*	H	α-helix	trans	-85	-10.2	176	-84	-174.9	175.5	178.9	-3.4	114.2	R389 R395	R389-R393 WeakPolarHBondContact O-CB 3.33Å; R389-R393 WeakPolarHBondContact O-CG 3.42Å; R389-R393 PolarHBondContact O-N 2.96Å; R393-R395 PolarHBondContact O-N 3.14Å; R393-R395 VanDerWaalsContact O-N 3.09Å
394	H	39.6	Very low	45.9	Very low	166 Å²	166	127.7 Å²	127.7	77%	0.769	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	3.1	167.4	-87.3	74.2	0	0	0	114.2	R390	R390-H394 PolarHBondContact O-ND1 3.42Å
395	R	40.4	Very low	47.3	Very low	219 Å²	219	129.4 Å²	129.4	83%	0.826	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.7	15.4	-171.9	-131.2	-179.3	-168.8	-178.2	5.3	115.7	R393	R393-R395 PolarHBondContact O-N 3.14Å; R393-R395 VanDerWaalsContact O-N 3.09Å
396	H	33.1	Very low	48.9	Very low	163 Å²	163	124.8 Å²	124.8	76%	0.755	58%	0.584	S	S	*	*	S	Bend	trans	-143.5	95	171.2	-98.7	-74	0	0	0	113
397	I	42.8	Very low	50.8	Low	134 Å²	134	122.2 Å²	122.2	69%	0.687	56%	0.564	S	S	*	*				49.8	97.7	129.1	-52.1	167.2	0	0	0	116.2
398	D	34.9	Very low	52.9	Low	156 Å²	156	124 Å²	124	83%	0.834	57%	0.567	S	S	*	*	S	Bend		-147.9	119.4	100.6	-94.7	-26.9	0	0	0	109.1
399	E	47.9	Very low	54.9	Low	188 Å²	188	119 Å²	119	88%	0.879	55%	0.553	S	S	*	*			trans	60.3	70.8	174.9	-63.1	-177.6	174	0	0	119
400	S	59.4	Low	57.1	Low	65 Å²	65	110.6 Å²	110.6	46%	0.455	52%	0.521	S	S	.	.			trans	-68.9	132.7	156.3	55.8	0	0	0	0	110	L402	S400-L402 PolarHBondContact O-N 3.23Å; S400-L402 PolarHBondContact OG-O 3.19Å; S400-L402 VanDerWaalsContact OG-O 3.12Å
401	P	65.6	Low	59.1	Low	55 Å²	55	105.1 Å²	105.1	36%	0.357	50%	0.502	S	S	.	.	S	Bend	trans	-59.7	-23.3	-175.9	-25.4	32.9	0	0	0	115.2	L344 A479	L344-P401 HydrophobicContact CD2-CG 3.85Å; P401-A479 HydrophobicContact CB-CB 4.02Å; P401-A479 HydrophobicContact CG-CB 4Å
402	L	73.4	Confident	61.1	Low	2 Å²	2	102.7 Å²	102.7	1%	0.01	49%	0.49	C	S	.	.	S	Bend	trans	-113.1	139	174.7	-74.8	169.4	0	0	0	110.7	S400 V471 A480 L484	S400-L402 PolarHBondContact O-N 3.23Å; S400-L402 PolarHBondContact OG-O 3.19Å; S400-L402 VanDerWaalsContact OG-O 3.12Å; L402-V471 HydrophobicContact CD1-CG1 4.24Å; L402-V471 HydrophobicContact CD2-CG1 4.16Å; L402-A480 HydrophobicContact CD1-CB 4.09Å; L402-A480 WeakPolarHBondContact CD1-O 2.94Å; L402-A480 HydrophobicContact CD2-CB 3.72Å; L402-A480 HydrophobicContact CG-CB 3.67Å; L402-L484 HydrophobicContact CD1-CB 4.12Å
403	H	74.3	Confident	63.4	Low	129 Å²	129	95.1 Å²	95.1	60%	0.597	46%	0.462	S	S	*	.			trans	-65.6	137.9	172.2	-167.5	-100.9	0	0	0	110.8	D405 M406 L407	H403-D405 VanDerWaalsContact C-N 3.29Å; H403-D405 IonicContact CE1-OD2 3.22Å; H403-D405 PolarHBondContact CE1-OD2 2.68Å; H403-D405 PolarHBondContact ND1-N 2.88Å; H403-D405 IonicContact ND1-OD2 2.73Å; H403-D405 PolarHBondContact O-N 3.41Å; H403-M406 HydrophobicContact CB-CB 4.41Å; H403-M406 WeakPolarHBondContact O-CB 3.37Å; H403-M406 PolarHBondContact O-N 3.16Å; H403-M406 VanDerWaalsContact O-N 3.07Å; H403-L407 PolarHBondContact O-N 3.47Å
404	V	73.9	Confident	65.7	Low	83 Å²	83	85.5 Å²	85.5	50%	0.503	43%	0.426	S	S	.	.	H	α-helix	trans	-59.3	-38	-172.6	177.6	0	0	0	0	112.5	L407 N408	V404-L407 PolarHBondContact O-N 2.95Å; V404-N408 VanDerWaalsContact O-CG 3.26Å; V404-N408 PolarHBondContact O-N 2.89Å; V404-N408 PolarHBondContact O-ND2 3.45Å; V404-N408 VanDerWaalsContact O-ND2 3.09Å
405	D	73.1	Confident	67.8	Low	109 Å²	109	77.7 Å²	77.7	58%	0.583	39%	0.39	S	S	*	.	H	α-helix	trans	-68.3	-36.3	179.1	-63.3	-30.2	0	0	0	112.2	H403 N408 S409	H403-D405 VanDerWaalsContact C-N 3.29Å; H403-D405 IonicContact CE1-OD2 3.22Å; H403-D405 PolarHBondContact CE1-OD2 2.68Å; H403-D405 PolarHBondContact ND1-N 2.88Å; H403-D405 IonicContact ND1-OD2 2.73Å; H403-D405 PolarHBondContact O-N 3.41Å; D405-N408 PolarHBondContact O-N 3.24Å; D405-S409 PolarHBondContact O-N 3.49Å; D405-S409 PolarHBondContact O-OG 3.46Å
406	M	74.1	Confident	69.6	Low	20 Å²	20	69.4 Å²	69.4	10%	0.099	37%	0.365	C	S	.	.	H	α-helix	trans	-67.3	-46	176	-177.1	58.2	64.2	0	0	110.6	F263 H403 N408 S409 I410 Y475	F263-M406 HydrophobicContact CZ-SD 3.92Å; H403-M406 HydrophobicContact CB-CB 4.41Å; H403-M406 WeakPolarHBondContact O-CB 3.37Å; H403-M406 PolarHBondContact O-N 3.16Å; H403-M406 VanDerWaalsContact O-N 3.07Å; M406-N408 VanDerWaalsContact C-N 3.31Å; M406-N408 PolarHBondContact O-N 3.28Å; M406-S409 WeakPolarHBondContact CA-OG 3.4Å; M406-S409 PolarHBondContact O-N 3.05Å; M406-S409 VanDerWaalsContact O-N 3.16Å; M406-S409 PolarHBondContact O-OG 2.9Å; M406-I410 HydrophobicContact CG-CD1 3.91Å; M406-I410 VanDerWaalsContact O-CG1 3.29Å; M406-I410 WeakPolarHBondContact O-CG1 3.49Å; M406-I410 PolarHBondContact O-N 3.46Å; M406-I410 HydrophobicContact SD-CD1 4.31Å; M406-I410 HydrophobicContact SD-CG1 4.45Å; M406-Y475 HydrophobicContact CE-CD1 4.3Å; M406-Y475 HydrophobicContact CE-CE1 3.6Å; M406-Y475 HydrophobicContact CE-CE2 4.31Å; M406-Y475 HydrophobicContact SD-CE1 4.47Å; M406-Y475 HydrophobicContact SD-CE2 4.34Å
407	L	79.3	Confident	71.7	Confident	14 Å²	14	64 Å²	64	7%	0.073	34%	0.341	C	S	.	.	H	α-helix	trans	-57.5	-44.1	175.2	179.4	66.3	0	0	0	111.6	H403 V404 S409 I410 L411 L484 E487	H403-L407 PolarHBondContact O-N 3.47Å; V404-L407 PolarHBondContact O-N 2.95Å; L407-S409 PolarHBondContact O-N 3.36Å; L407-I410 PolarHBondContact O-N 2.96Å; L407-L411 HydrophobicContact CD1-CD1 4.27Å; L407-L411 HydrophobicContact CD1-CG 4.31Å; L407-L411 HydrophobicContact CG-CD1 4.1Å; L407-L411 WeakPolarHBondContact O-CB 3.24Å; L407-L411 WeakPolarHBondContact O-CG 3.45Å; L407-L411 PolarHBondContact O-N 3.02Å; L407-L484 HydrophobicContact CD1-CD1 3.84Å; L407-E487 HydrophobicContact CD1-CB 4.34Å; L407-E487 HydrophobicContact CD1-CG 4.42Å; L407-E487 HydrophobicContact CD2-CG 4.03Å
408	N	80.2	Confident	73	Confident	89 Å²	89	60 Å²	60	48%	0.476	33%	0.328	S	S	.	.	H	α-helix	trans	-63.9	-39.5	177.1	-72	-35.6	0	0	0	112.4	V404 D405 M406 L412	V404-N408 VanDerWaalsContact O-CG 3.26Å; V404-N408 PolarHBondContact O-N 2.89Å; V404-N408 PolarHBondContact O-ND2 3.45Å; V404-N408 VanDerWaalsContact O-ND2 3.09Å; D405-N408 PolarHBondContact O-N 3.24Å; M406-N408 VanDerWaalsContact C-N 3.31Å; M406-N408 PolarHBondContact O-N 3.28Å; N408-L412 VanDerWaalsContact O-CB 3.27Å; N408-L412 WeakPolarHBondContact O-CB 3.27Å; N408-L412 PolarHBondContact O-N 3.46Å
409	S	78.8	Confident	74.3	Confident	32 Å²	32	55.3 Å²	55.3	22%	0.224	31%	0.311	C	S	.	.	H	α-helix	trans	-65.7	-39.9	174.6	58	0	0	0	0	112.8	D405 M406 L407 L412 Y413	D405-S409 PolarHBondContact O-N 3.49Å; D405-S409 PolarHBondContact O-OG 3.46Å; M406-S409 WeakPolarHBondContact CA-OG 3.4Å; M406-S409 PolarHBondContact O-N 3.05Å; M406-S409 VanDerWaalsContact O-N 3.16Å; M406-S409 PolarHBondContact O-OG 2.9Å; L407-S409 PolarHBondContact O-N 3.36Å; S409-L412 PolarHBondContact O-N 3.49Å; S409-Y413 WeakPolarHBondContact O-CB 3.43Å; S409-Y413 PolarHBondContact O-N 3.4Å
410	I	80.7	Confident	74.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-65.2	-48.1	177.3	-66.3	161.5	0	0	0	110.1	F263 M406 L407 L412 Y413 L414 C467 V471 L484	F263-I410 HydrophobicContact CE1-CD1 4.42Å; F263-I410 HydrophobicContact CE1-CG1 3.54Å; F263-I410 HydrophobicContact CE2-CG1 4.41Å; F263-I410 HydrophobicContact CZ-CD1 4.43Å; F263-I410 HydrophobicContact CZ-CG1 3.45Å; F263-I410 VanDerWaalsContact CZ-CG1 3.45Å; M406-I410 HydrophobicContact CG-CD1 3.91Å; M406-I410 VanDerWaalsContact O-CG1 3.29Å; M406-I410 WeakPolarHBondContact O-CG1 3.49Å; M406-I410 PolarHBondContact O-N 3.46Å; M406-I410 HydrophobicContact SD-CD1 4.31Å; M406-I410 HydrophobicContact SD-CG1 4.45Å; L407-I410 PolarHBondContact O-N 2.96Å; I410-L412 VanDerWaalsContact C-N 3.3Å; I410-L412 PolarHBondContact O-N 3.44Å; I410-Y413 WeakPolarHBondContact O-CB 3.06Å; I410-Y413 PolarHBondContact O-N 2.85Å; I410-Y413 VanDerWaalsContact O-N 3.16Å; I410-L414 HydrophobicContact CG2-CD1 3.93Å; I410-L414 HydrophobicContact CG2-CG 4.34Å; I410-L414 WeakPolarHBondContact O-CG 3.2Å; I410-L414 PolarHBondContact O-N 3.06Å; I410-C467 HydrophobicContact CG2-CB 4.44Å; I410-V471 HydrophobicContact CD1-CG2 3.66Å; I410-L484 HydrophobicContact CB-CD1 4.44Å; I410-L484 HydrophobicContact CG2-CD1 3.64Å; I410-L484 HydrophobicContact CG2-CD2 4.02Å
411	L	82.6	Confident	74.1	Confident	28 Å²	28	53.2 Å²	53.2	15%	0.147	30%	0.301	C	S	.	.	H	α-helix	trans	-61.9	-39.7	178.2	-71.9	175.5	0	0	0	111.3	L407 Y413 L414 F415	L407-L411 HydrophobicContact CD1-CD1 4.27Å; L407-L411 HydrophobicContact CD1-CG 4.31Å; L407-L411 HydrophobicContact CG-CD1 4.1Å; L407-L411 WeakPolarHBondContact O-CB 3.24Å; L407-L411 WeakPolarHBondContact O-CG 3.45Å; L407-L411 PolarHBondContact O-N 3.02Å; L411-Y413 VanDerWaalsContact C-N 3.34Å; L411-Y413 PolarHBondContact O-N 3.48Å; L411-L414 PolarHBondContact O-N 3.32Å; L411-F415 HydrophobicContact CD2-CD2 4.49Å; L411-F415 HydrophobicContact CD2-CE2 4.49Å; L411-F415 WeakPolarHBondContact O-CA 3.25Å; L411-F415 VanDerWaalsContact O-CB 3.27Å; L411-F415 WeakPolarHBondContact O-CB 3.48Å; L411-F415 PolarHBondContact O-N 2.93Å
412	L	82.7	Confident	72.9	Confident	83 Å²	83	60.3 Å²	60.3	44%	0.435	33%	0.326	S	S	.	.	H	α-helix	trans	-65.5	-36.2	175.4	-178.7	59.9	0	0	0	112.6	N408 S409 I410 F415 P416 A419	N408-L412 VanDerWaalsContact O-CB 3.27Å; N408-L412 WeakPolarHBondContact O-CB 3.27Å; N408-L412 PolarHBondContact O-N 3.46Å; S409-L412 PolarHBondContact O-N 3.49Å; I410-L412 VanDerWaalsContact C-N 3.3Å; I410-L412 PolarHBondContact O-N 3.44Å; L412-F415 CarbonylContact O-C 3.31Å; L412-P416 VanDerWaalsContact O-CA 3.26Å; L412-P416 WeakPolarHBondContact O-CA 3.37Å; L412-P416 VanDerWaalsContact O-N 3.1Å; L412-A419 HydrophobicContact CD1-CB 3.34Å
413	Y	81.9	Confident	70.8	Confident	61 Å²	61	64.6 Å²	64.6	24%	0.239	36%	0.356	C	S	.	.	H	α-helix	trans	-67.5	-45.1	174.8	174.9	-97.3	0	0	0	112.2	F263 G264 S409 I410 L411 F415 R463 C467	F263-Y413 VanDerWaalsContact C-CZ 3.46Å; F263-Y413 HydrophobicContact CB-CD1 3.68Å; F263-Y413 HydrophobicContact CB-CD2 3.46Å; F263-Y413 VanDerWaalsContact CB-CD2 3.46Å; F263-Y413 HydrophobicContact CB-CE1 3.76Å; F263-Y413 HydrophobicContact CB-CE2 3.53Å; F263-Y413 HydrophobicContact CB-CG 3.53Å; F263-Y413 HydrophobicContact CD2-CG 4.37Å; F263-Y413 HydrophobicContact CG-CD1 4.26Å; F263-Y413 HydrophobicContact CG-CD2 4.33Å; F263-Y413 HydrophobicContact CG-CG 4.05Å; F263-Y413 WeakPolarHBondContact O-CE2 3.44Å; F263-Y413 PolarHBondContact O-OH 3.48Å; F263-Y413 VanDerWaalsContact O-OH 3.07Å; G264-Y413 WeakPolarHBondContact CA-OH 3.3Å; G264-Y413 PolarHBondContact N-OH 3.43Å; S409-Y413 WeakPolarHBondContact O-CB 3.43Å; S409-Y413 PolarHBondContact O-N 3.4Å; I410-Y413 WeakPolarHBondContact O-CB 3.06Å; I410-Y413 PolarHBondContact O-N 2.85Å; I410-Y413 VanDerWaalsContact O-N 3.16Å; L411-Y413 VanDerWaalsContact C-N 3.34Å; L411-Y413 PolarHBondContact O-N 3.48Å; Y413-F415 VanDerWaalsContact C-N 3.3Å; Y413-F415 PolarHBondContact O-N 2.82Å; Y413-R463 HydrophobicContact CE1-CB 3.82Å; Y413-R463 HydrophobicContact CE1-CG 4.02Å; Y413-R463 PolarHBondContact O-NH1 3.28Å; Y413-C467 WeakPolarHBondContact CD1-SG 3.27Å; Y413-C467 VanDerWaalsContact CE1-SG 3.5Å
414	L	81.6	Confident	68.9	Low	0 Å²	0	63.6 Å²	63.6	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-64.2	-39	176	-67.2	174.4	0	0	0	111	I410 L411 P416 L460 R463 L464 C467 F488	I410-L414 HydrophobicContact CG2-CD1 3.93Å; I410-L414 HydrophobicContact CG2-CG 4.34Å; I410-L414 WeakPolarHBondContact O-CG 3.2Å; I410-L414 PolarHBondContact O-N 3.06Å; L411-L414 PolarHBondContact O-N 3.32Å; L414-P416 WeakPolarHBondContact O-CD 3.41Å; L414-L460 HydrophobicContact CB-CD1 4.14Å; L414-L460 HydrophobicContact CD2-CD1 4.28Å; L414-L460 WeakPolarHBondContact O-CD1 3.43Å; L414-R463 HydrophobicContact CD2-CB 4.3Å; L414-R463 PolarHBondContact O-NH2 3.25Å; L414-L464 HydrophobicContact CD1-CD1 3.98Å; L414-L464 HydrophobicContact CD2-CB 4.21Å; L414-L464 HydrophobicContact CD2-CD1 4.2Å; L414-C467 HydrophobicContact CD2-CB 4.49Å; L414-F488 HydrophobicContact CD1-CD2 3.95Å; L414-F488 HydrophobicContact CD1-CE2 4.31Å
415	F	84.2	Confident	66.8	Low	1 Å²	1	67 Å²	67	0%	0.004	38%	0.379	C	S	.	.			trans	-126.2	74.4	-175	-61.4	-59	0	0	0	112.5	L411 L412 Y413 D417 A418 L460 F488 E491 L492 R495 V502	L411-F415 HydrophobicContact CD2-CD2 4.49Å; L411-F415 HydrophobicContact CD2-CE2 4.49Å; L411-F415 WeakPolarHBondContact O-CA 3.25Å; L411-F415 VanDerWaalsContact O-CB 3.27Å; L411-F415 WeakPolarHBondContact O-CB 3.48Å; L411-F415 PolarHBondContact O-N 2.93Å; L412-F415 CarbonylContact O-C 3.31Å; Y413-F415 VanDerWaalsContact C-N 3.3Å; Y413-F415 PolarHBondContact O-N 2.82Å; F415-D417 VanDerWaalsContact C-OD1 3.26Å; F415-D417 WeakPolarHBondContact CA-OD1 3.27Å; F415-D417 PolarHBondContact O-N 3.27Å; F415-D417 VanDerWaalsContact O-N 3.14Å; F415-A418 HydrophobicContact CB-CB 4.33Å; F415-A418 WeakPolarHBondContact O-CB 3.36Å; F415-A418 PolarHBondContact O-N 3.16Å; F415-A418 VanDerWaalsContact O-N 3.09Å; F415-L460 HydrophobicContact CE1-CD1 4.14Å; F415-L460 HydrophobicContact CE1-CD2 3.88Å; F415-L460 HydrophobicContact CZ-CD2 4.34Å; F415-F488 HydrophobicContact CE1-CE2 4.32Å; F415-F488 AromaticContact CE2-CD2 3.71Å; F415-F488 HydrophobicContact CE2-CD2 3.71Å; F415-F488 AromaticContact CE2-CE2 3.78Å; F415-F488 HydrophobicContact CE2-CE2 3.78Å; F415-F488 AromaticContact CZ-CD2 3.76Å; F415-F488 HydrophobicContact CZ-CD2 3.76Å; F415-F488 AromaticContact CZ-CE2 3.37Å; F415-F488 HydrophobicContact CZ-CE2 3.37Å; F415-F488 HydrophobicContact CZ-CZ 4.12Å; F415-E491 HydrophobicContact CD2-CG 3.79Å; F415-E491 HydrophobicContact CE2-CB 4.14Å; F415-E491 HydrophobicContact CE2-CG 3.58Å; F415-E491 HydrophobicContact CZ-CG 4.17Å; F415-L492 HydrophobicContact CE1-CD2 4.48Å; F415-L492 HydrophobicContact CZ-CD2 4.2Å; F415-R495 VanDerWaalsContact CG-NH2 3.28Å; F415-V502 HydrophobicContact CE1-CG1 4.31Å
416	P	77.3	Confident	65.2	Low	46 Å²	46	71.8 Å²	71.8	30%	0.299	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-62.3	-24.4	-178.8	-22.6	33.9	0	0	0	113.6	L412 L414 A418 A419 Y503	L412-P416 VanDerWaalsContact O-CA 3.26Å; L412-P416 WeakPolarHBondContact O-CA 3.37Å; L412-P416 VanDerWaalsContact O-N 3.1Å; L414-P416 WeakPolarHBondContact O-CD 3.41Å; P416-A418 VanDerWaalsContact C-N 3.27Å; P416-A418 PolarHBondContact O-N 2.96Å; P416-A419 PolarHBondContact O-N 3.37Å; P416-Y503 HydrophobicContact CG-CD1 4.3Å; P416-Y503 HydrophobicContact CG-CE1 3.97Å
417	D	77.1	Confident	63	Low	48 Å²	48	79.5 Å²	79.5	26%	0.257	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-65.7	-25.8	177.1	56.3	-24.9	0	0	0	113.2	F415 A419 V420 R495 Y503	F415-D417 VanDerWaalsContact C-OD1 3.26Å; F415-D417 WeakPolarHBondContact CA-OD1 3.27Å; F415-D417 PolarHBondContact O-N 3.27Å; F415-D417 VanDerWaalsContact O-N 3.14Å; D417-A419 VanDerWaalsContact C-N 3.28Å; D417-A419 PolarHBondContact O-N 2.9Å; D417-V420 PolarHBondContact O-N 3.31Å; D417-R495 VanDerWaalsContact CG-NH2 3.29Å; D417-R495 IonicContact OD1-CZ 2.57Å; D417-R495 IonicContact OD1-NH1 3.41Å; D417-R495 IonicContact OD1-NH2 3.76Å; D417-R495 PolarHBondContact OD1-NH2 3.49Å; D417-R495 IonicContact OD2-CZ 3.59Å; D417-R495 IonicContact OD2-NH1 3.01Å; D417-R495 PolarHBondContact OD2-NH1 3.49Å; D417-R495 IonicContact OD2-NH2 3.83Å; D417-R495 PolarHBondContact OD2-NH2 3.3Å; D417-R495 VanDerWaalsContact OD2-NH2 3.16Å; D417-Y503 HydrophobicContact CB-CD2 4.38Å
418	A	70.6	Confident	60.7	Low	50 Å²	50	88 Å²	88	41%	0.413	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-68.4	-22	179.5	0	0	0	0	0	113.8	F415 P416	F415-A418 HydrophobicContact CB-CB 4.33Å; F415-A418 WeakPolarHBondContact O-CB 3.36Å; F415-A418 PolarHBondContact O-N 3.16Å; F415-A418 VanDerWaalsContact O-N 3.09Å; P416-A418 VanDerWaalsContact C-N 3.27Å; P416-A418 PolarHBondContact O-N 2.96Å
419	A	61.9	Low	58.1	Low	58 Å²	58	90.9 Å²	90.9	48%	0.479	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-75.6	-27.7	174.3	0	0	0	0	0	113.7	L412 P416 D417	L412-A419 HydrophobicContact CD1-CB 3.34Å; P416-A419 PolarHBondContact O-N 3.37Å; D417-A419 VanDerWaalsContact C-N 3.28Å; D417-A419 PolarHBondContact O-N 2.9Å
420	V	55.8	Low	55.8	Low	101 Å²	101	95.2 Å²	95.2	61%	0.612	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-79.3	-21.2	-169.8	-175.4	0	0	0	0	112	D417 K422 S423	D417-V420 PolarHBondContact O-N 3.31Å; V420-K422 VanDerWaalsContact C-N 3.29Å; V420-K422 PolarHBondContact O-N 3Å; V420-S423 PolarHBondContact O-OG 2.93Å
421	E	47.3	Very low	53.2	Low	109 Å²	109	104.2 Å²	104.2	51%	0.509	56%	0.555	S	S	.	*	G	3₁₀ helix	trans	-74	-7.2	-176.2	-67.9	-153.7	131.8	0	0	115.7	Y500	E421-Y500 WeakPolarHBondContact OE1-CE1 3.48Å; E421-Y500 PolarHBondContact OE1-OH 3.44Å; E421-Y500 PolarHBondContact OE2-OH 3.1Å
422	K	39.6	Very low	50.7	Low	204 Å²	204	107 Å²	107	89%	0.887	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-82.4	-10.9	177.8	-77.5	-177.3	-178.4	171.1	0	114.8	V420	V420-K422 VanDerWaalsContact C-N 3.29Å; V420-K422 PolarHBondContact O-N 3Å
423	S	30.9	Very low	48.1	Very low	92 Å²	92	110.6 Å²	110.6	64%	0.643	60%	0.602	S	S	*	*	S	Bend	trans	-100.8	97.1	171.3	55.6	0	0	0	0	110.2	V420 D425	V420-S423 PolarHBondContact O-OG 2.93Å; S423-D425 PolarHBondContact O-N 2.85Å; S423-D425 VanDerWaalsContact O-N 3.15Å
424	S	34	Very low	45.4	Very low	107 Å²	107	112.9 Å²	112.9	75%	0.748	63%	0.627	S	S	*	*			trans	-62.1	110.8	166.3	55.9	0	0	0	0	109.8
425	D	30.4	Very low	42.6	Very low	154 Å²	154	118.5 Å²	118.5	82%	0.824	67%	0.665	S	S	*	*			trans	-167.7	143.3	131.6	-97.9	-31.2	0	0	0	112.6	S423 E427	S423-D425 PolarHBondContact O-N 2.85Å; S423-D425 VanDerWaalsContact O-N 3.15Å; D425-E427 PolarHBondContact O-N 3.49Å
426	K	39.3	Very low	39.6	Very low	210 Å²	210	129.7 Å²	129.7	91%	0.913	71%	0.707	S	S	*	*			trans	-68.6	90.9	177.4	-70.1	172.5	176	173.2	0	110
427	E	27	Very low	37.1	Very low	183 Å²	183	132.9 Å²	132.9	86%	0.855	73%	0.728	S	S	*	*			trans	-120.1	113	158.7	-71.7	-164.7	159.9	0	0	110.5	D425 T429	D425-E427 PolarHBondContact O-N 3.49Å; E427-T429 PolarHBondContact O-N 3.31Å
428	K	29.9	Very low	34.6	Very low	192 Å²	192	134.7 Å²	134.7	84%	0.835	74%	0.744	S	S	*	*			trans	-5.2	108.6	168.4	-65	170.8	-179.3	173.8	0	115.3	T430	K428-T430 VanDerWaalsContact C-N 3.31Å; K428-T430 PolarHBondContact O-N 3.04Å; K428-T430 PolarHBondContact O-OG1 3.15Å
429	T	27.1	Very low	32.6	Very low	149 Å²	149	141.5 Å²	141.5	91%	0.914	77%	0.767	S	S	*	*	S	Bend	trans	-51.6	89.8	161.9	-11.1	0	0	0	0	110.5	E427	E427-T429 PolarHBondContact O-N 3.31Å
430	T	29.6	Very low	31.1	Very low	123 Å²	123	146.4 Å²	146.4	76%	0.755	78%	0.78	S	S	*	*			trans	-143.6	26.6	166.4	8.4	0	0	0	0	111.3	K428	K428-T430 VanDerWaalsContact C-N 3.31Å; K428-T430 PolarHBondContact O-N 3.04Å; K428-T430 PolarHBondContact O-OG1 3.15Å
431	Q	27	Very low	29.8	Very low	189 Å²	189	150.2 Å²	150.2	88%	0.883	79%	0.792	S	S	*	*			trans	-116.9	65.1	165.1	-76	-178.8	-3.9	0	0	109
432	A	29.3	Very low	29.2	Very low	87 Å²	87	154.3 Å²	154.3	72%	0.719	81%	0.807	S	S	*	*			trans	-85.8	133.3	149.2	0	0	0	0	0	106.5
433	N	29	Very low	29.1	Very low	158 Å²	158	146.7 Å²	146.7	85%	0.845	78%	0.78	S	S	*	*			trans	72.3	82.2	172.2	-58.5	-12.7	0	0	0	117.1
434	S	25	Very low	29.7	Very low	110 Å²	110	147.3 Å²	147.3	77%	0.769	78%	0.782	S	S	*	*			trans	-128.5	53.8	147.3	69.6	0	0	0	0	111.5
435	C	22.4	Very low	30.1	Very low	118 Å²	118	144.8 Å²	144.8	80%	0.797	76%	0.76	S	S	*	*			trans	-108.7	100.5	132.5	-103.4	0	0	0	0	104.2	P437	C435-P437 WeakPolarHBondContact O-CD 3.46Å
436	R	20.6	Very low	31.1	Very low	236 Å²	236	140.8 Å²	140.8	89%	0.891	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-56.8	124.5	156	-77.5	179.3	174.5	173.7	-2.7	104.7	S438	R436-S438 PolarHBondContact O-N 3.2Å
437	P	25.3	Very low	31.8	Very low	113 Å²	113	135.7 Å²	135.7	73%	0.734	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-58.2	118.1	151.4	16.4	-7.2	0	0	0	103.4	C435 E439	C435-P437 WeakPolarHBondContact O-CD 3.46Å; P437-E439 PolarHBondContact O-N 3.43Å; P437-E439 VanDerWaalsContact O-N 3.09Å
438	S	23.6	Very low	33.1	Very low	86 Å²	86	130.7 Å²	130.7	60%	0.601	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-46.6	124.6	148.5	45.8	0	0	0	0	104.4	R436 Q440	R436-S438 PolarHBondContact O-N 3.2Å; S438-Q440 PolarHBondContact O-N 3.38Å
439	E	28.8	Very low	34.4	Very low	192 Å²	192	122.5 Å²	122.5	90%	0.897	66%	0.664	S	S	*	*			trans	-59.1	79.3	167.6	-67.6	175.5	159.7	0	0	106.3	P437 E441	P437-E439 PolarHBondContact O-N 3.43Å; P437-E439 VanDerWaalsContact O-N 3.09Å; E439-E441 VanDerWaalsContact C-N 3.32Å; E439-E441 PolarHBondContact O-N 2.91Å; E439-E441 VanDerWaalsContact O-N 3.14Å
440	Q	31.7	Very low	35.9	Very low	162 Å²	162	120.2 Å²	120.2	76%	0.757	65%	0.646	S	S	*	*			trans	-64.6	107.6	155.7	-81.6	175.7	-27.1	0	0	102.5	S438 K442	S438-Q440 PolarHBondContact O-N 3.38Å; Q440-K442 PolarHBondContact O-N 2.82Å; Q440-K442 VanDerWaalsContact O-N 3.07Å
441	E	28.4	Very low	37.5	Very low	181 Å²	181	119.3 Å²	119.3	85%	0.846	63%	0.633	S	S	*	*			trans	-38.8	119.4	167.6	-66.7	177.8	149	0	0	107.7	E439 S443	E439-E441 VanDerWaalsContact C-N 3.32Å; E439-E441 PolarHBondContact O-N 2.91Å; E439-E441 VanDerWaalsContact O-N 3.14Å; E441-S443 VanDerWaalsContact C-N 3.28Å; E441-S443 PolarHBondContact O-N 3.33Å
442	K	34.4	Very low	39.5	Very low	194 Å²	194	110.5 Å²	110.5	84%	0.843	59%	0.592	S	S	*	*			trans	-57.3	97.5	176.9	-75.2	180	177	179.4	0	107.6	Q440	Q440-K442 PolarHBondContact O-N 2.82Å; Q440-K442 VanDerWaalsContact O-N 3.07Å
443	S	36.3	Very low	41.7	Very low	44 Å²	44	108.1 Å²	108.1	31%	0.308	57%	0.565	S	S	.	*			trans	-64.1	146	172.6	70.5	0	0	0	0	107.6	E441 D445 D446	E441-S443 VanDerWaalsContact C-N 3.28Å; E441-S443 PolarHBondContact O-N 3.33Å; S443-D445 PolarHBondContact O-N 2.99Å; S443-D446 PolarHBondContact O-N 3.2Å
444	P	44.9	Very low	44.1	Very low	105 Å²	105	101.1 Å²	101.1	68%	0.682	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-18.4	176.4	22.6	-32.6	0	0	0	112.9
445	D	42.9	Very low	46.8	Very low	54 Å²	54	96 Å²	96	29%	0.289	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-24.4	-179.3	-65.1	-17.7	0	0	0	114.7	S443 N447 L448 Y449 K783	S443-D445 PolarHBondContact O-N 2.99Å; D445-N447 PolarHBondContact O-N 3.41Å; D445-N447 VanDerWaalsContact O-N 3.1Å; D445-L448 WeakPolarHBondContact O-CB 3.29Å; D445-L448 PolarHBondContact O-N 2.99Å; D445-Y449 HydrophobicContact CB-CE2 4.22Å; D445-Y449 WeakPolarHBondContact O-CD2 3.35Å; D445-K783 VanDerWaalsContact CB-NZ 3.28Å; D445-K783 IonicContact OD2-NZ 3.54Å; D445-K783 PolarHBondContact OD2-NZ 3.49Å
446	D	50.7	Low	49.5	Very low	70 Å²	70	93.3 Å²	93.3	37%	0.374	47%	0.474	S	S	.	.	H	α-helix	trans	-59.9	-26.8	177.3	-71.9	-21.7	0	0	0	111.5	S443 L448 Y449 L450	S443-D446 PolarHBondContact O-N 3.2Å; D446-L448 VanDerWaalsContact C-N 3.34Å; D446-L448 PolarHBondContact O-N 2.9Å; D446-Y449 PolarHBondContact O-N 3.13Å; D446-L450 WeakPolarHBondContact O-CB 3.28Å; D446-L450 WeakPolarHBondContact O-CD1 3.26Å; D446-L450 VanDerWaalsContact O-CG 3.23Å; D446-L450 WeakPolarHBondContact O-CG 3.4Å; D446-L450 PolarHBondContact O-N 2.93Å; D446-L450 VanDerWaalsContact O-N 3.11Å
447	N	54.1	Low	52	Low	104 Å²	104	85 Å²	85	56%	0.556	45%	0.452	S	S	*	.	H	α-helix	trans	-71.4	-23.5	176.3	-66.2	-52.4	0	0	0	113.9	D445	D445-N447 PolarHBondContact O-N 3.41Å; D445-N447 VanDerWaalsContact O-N 3.1Å
448	L	53.2	Low	54.5	Low	78 Å²	78	86.7 Å²	86.7	41%	0.408	45%	0.454	S	S	.	.	H	α-helix	trans	-74.9	-39.2	175.9	-70.6	163.9	0	0	0	110.5	D445 D446 Q451	D445-L448 WeakPolarHBondContact O-CB 3.29Å; D445-L448 PolarHBondContact O-N 2.99Å; D446-L448 VanDerWaalsContact C-N 3.34Å; D446-L448 PolarHBondContact O-N 2.9Å; L448-Q451 PolarHBondContact O-N 3.4Å
449	Y	57.3	Low	57.3	Low	20 Å²	20	82.8 Å²	82.8	8%	0.078	43%	0.427	C	S	.	.	H	α-helix	trans	-77.2	-26.7	179.8	-58.9	-67	0	0	0	113.1	D445 D446 Q451 L452 H776 I779 M780 K783 A802	D445-Y449 HydrophobicContact CB-CE2 4.22Å; D445-Y449 WeakPolarHBondContact O-CD2 3.35Å; D446-Y449 PolarHBondContact O-N 3.13Å; Y449-Q451 PolarHBondContact O-N 3.07Å; Y449-L452 HydrophobicContact CD1-CD1 4.03Å; Y449-L452 WeakPolarHBondContact O-CB 3.49Å; Y449-L452 PolarHBondContact O-N 3.07Å; Y449-H776 AromaticContact CD1-NE2 3.99Å; Y449-I779 HydrophobicContact CE1-CG2 3.77Å; Y449-M780 HydrophobicContact CD1-SD 4Å; Y449-M780 HydrophobicContact CD2-SD 3.94Å; Y449-M780 HydrophobicContact CE1-SD 3.96Å; Y449-M780 HydrophobicContact CE2-SD 3.91Å; Y449-M780 HydrophobicContact CG-SD 4.01Å; Y449-K783 HydrophobicContact CE2-CD 4.32Å; Y449-A802 HydrophobicContact CE1-CB 4.34Å
450	L	59.5	Low	60.1	Low	101 Å²	101	73.7 Å²	73.7	53%	0.529	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-14.7	170.6	-79.5	163.3	0	0	0	114.2	D446	D446-L450 WeakPolarHBondContact O-CB 3.28Å; D446-L450 WeakPolarHBondContact O-CD1 3.26Å; D446-L450 VanDerWaalsContact O-CG 3.23Å; D446-L450 WeakPolarHBondContact O-CG 3.4Å; D446-L450 PolarHBondContact O-N 2.93Å; D446-L450 VanDerWaalsContact O-N 3.11Å
451	Q	63	Low	62.7	Low	103 Å²	103	66 Å²	66	48%	0.481	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-17.2	176.7	-63.8	177.2	20.8	0	0	113	L448 Y449 N806 H810	L448-Q451 PolarHBondContact O-N 3.4Å; Y449-Q451 PolarHBondContact O-N 3.07Å; Q451-N806 PolarHBondContact O-OD1 2.7Å; Q451-N806 VanDerWaalsContact O-OD1 3.09Å; Q451-N806 PolarHBondContact OE1-ND2 2.9Å; Q451-N806 VanDerWaalsContact OE1-ND2 3.13Å; Q451-H810 PolarHBondContact O-NE2 3.25Å; Q451-H810 VanDerWaalsContact O-NE2 3.11Å
452	L	69.9	Low	65.4	Low	5 Å²	5	58.7 Å²	58.7	3%	0.026	31%	0.313	C	S	.	.	S	Bend	trans	-71.4	135.4	176.2	-62.5	167.6	0	0	0	109.1	Y449 S454 H776 A805 N806 L809	Y449-L452 HydrophobicContact CD1-CD1 4.03Å; Y449-L452 WeakPolarHBondContact O-CB 3.49Å; Y449-L452 PolarHBondContact O-N 3.07Å; L452-S454 PolarHBondContact O-N 3.34Å; L452-H776 HydrophobicContact CD1-CB 4.15Å; L452-A805 HydrophobicContact CD2-CB 3.63Å; L452-N806 HydrophobicContact CD2-CB 4.4Å; L452-L809 HydrophobicContact CD2-CD1 3.97Å
453	K	73.6	Confident	67.9	Low	37 Å²	37	50.7 Å²	50.7	16%	0.161	28%	0.278	C	S	.	.	S	Bend	trans	-72	53.6	174.8	-161.5	173.8	-179.4	172.5	0	111.9	C515 E638 P772	K453-C515 WeakPolarHBondContact O-CB 3.41Å; K453-E638 WeakPolarHBondContact CE-OE2 3.27Å; K453-E638 IonicContact NZ-OE1 3.38Å; K453-E638 PolarHBondContact NZ-OE1 3.04Å; K453-E638 IonicContact NZ-OE2 3.12Å; K453-E638 PolarHBondContact NZ-OE2 3.29Å; K453-P772 WeakPolarHBondContact O-CB 3.4Å
454	S	80.8	Confident	70.4	Confident	10 Å²	10	48.6 Å²	48.6	7%	0.07	26%	0.263	C	S	.	.			trans	-115.8	169.5	-175.4	72.1	0	0	0	0	110.5	L452 C514 H776	L452-S454 PolarHBondContact O-N 3.34Å; S454-C514 WeakPolarHBondContact O-CA 3.47Å; S454-H776 PolarHBondContact OG-ND1 3.11Å
455	A	80.9	Confident	72.4	Confident	2 Å²	2	43.6 Å²	43.6	2%	0.017	23%	0.231	C	C	.	.			trans	-89.5	154.7	173.9	0	0	0	0	0	111.2	S459 T461 H518 C773	A455-S459 VanDerWaalsContact CB-OG 3.26Å; A455-S459 WeakPolarHBondContact CB-OG 3.39Å; A455-T461 HydrophobicContact CB-CG2 4.16Å; A455-H518 HydrophobicContact CB-CB 4.13Å; A455-C773 PolarHBondContact N-SG 2.74Å; A455-C773 VanDerWaalsContact N-SG 3.39Å
456	P	79.9	Confident	74.4	Confident	62 Å²	62	41.2 Å²	41.2	40%	0.403	22%	0.218	S	C	.	.			trans	-55.7	146.1	175.8	-23.1	32	0	0	0	112.3	N458 S459 Y462	P456-N458 PolarHBondContact O-N 3.23Å; P456-N458 VanDerWaalsContact O-N 3.11Å; P456-S459 WeakPolarHBondContact O-CB 3.49Å; P456-S459 PolarHBondContact O-N 3.07Å; P456-S459 PolarHBondContact O-OG 3.18Å; P456-Y462 WeakPolarHBondContact O-CB 3.3Å
457	C	73.1	Confident	76	Confident	63 Å²	63	38 Å²	38	43%	0.426	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-30.9	-172.8	-33.8	0	0	0	0	113.5	S459 Y462	C457-S459 VanDerWaalsContact C-N 3.34Å; C457-Y462 WeakPolarHBondContact O-CD1 3.17Å
458	N	76.4	Confident	77.5	Confident	148 Å²	148	33 Å²	33	79%	0.791	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.2	6.6	178.2	-64.9	-24.7	0	0	0	113.6	P456	P456-N458 PolarHBondContact O-N 3.23Å; P456-N458 VanDerWaalsContact O-N 3.11Å
459	S	84.3	Confident	79	Confident	4 Å²	4	29.4 Å²	29.4	3%	0.028	16%	0.156	C	C	.	.	S	Bend	trans	-80.7	159.8	-174.6	71.3	0	0	0	0	113.2	A455 P456 C457 T461 Y462 R463 G504	A455-S459 VanDerWaalsContact CB-OG 3.26Å; A455-S459 WeakPolarHBondContact CB-OG 3.39Å; P456-S459 WeakPolarHBondContact O-CB 3.49Å; P456-S459 PolarHBondContact O-N 3.07Å; P456-S459 PolarHBondContact O-OG 3.18Å; C457-S459 VanDerWaalsContact C-N 3.34Å; S459-T461 VanDerWaalsContact C-N 3.31Å; S459-T461 PolarHBondContact O-N 3.37Å; S459-Y462 PolarHBondContact O-N 3.23Å; S459-Y462 WeakPolarHBondContact OG-CB 3.29Å; S459-Y462 PolarHBondContact OG-N 3.41Å; S459-R463 PolarHBondContact O-N 2.7Å; S459-R463 VanDerWaalsContact O-N 3.14Å; S459-G504 VanDerWaalsContact CA-O 3.26Å; S459-G504 WeakPolarHBondContact CA-O 3.37Å
460	L	86.5	Confident	80	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58.1	-42.9	171.1	-178.9	63.1	0	0	0	112.2	L414 F415 Y462 R463 L464 F488 V502 G504 L505	L414-L460 HydrophobicContact CB-CD1 4.14Å; L414-L460 HydrophobicContact CD2-CD1 4.28Å; L414-L460 WeakPolarHBondContact O-CD1 3.43Å; F415-L460 HydrophobicContact CE1-CD1 4.14Å; F415-L460 HydrophobicContact CE1-CD2 3.88Å; F415-L460 HydrophobicContact CZ-CD2 4.34Å; L460-Y462 VanDerWaalsContact C-N 3.33Å; L460-Y462 PolarHBondContact O-N 3.39Å; L460-R463 PolarHBondContact O-N 2.76Å; L460-L464 VanDerWaalsContact O-CB 3.29Å; L460-L464 WeakPolarHBondContact O-CB 3.44Å; L460-L464 PolarHBondContact O-N 2.97Å; L460-F488 HydrophobicContact CD1-CE2 4.26Å; L460-F488 HydrophobicContact CD2-CE2 4.16Å; L460-F488 HydrophobicContact CD2-CZ 3.89Å; L460-F488 HydrophobicContact CG-CE2 4.39Å; L460-F488 HydrophobicContact CG-CZ 4.31Å; L460-V502 HydrophobicContact CD2-CG1 3.33Å; L460-G504 PolarHBondContact N-O 3.48Å; L460-L505 HydrophobicContact CB-CD2 4.44Å
461	T	86.5	Confident	81.1	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64.6	-38	-177.3	-44.5	0	0	0	0	112	A455 S459 L464 A465 L517 H518 F521 L770	A455-T461 HydrophobicContact CB-CG2 4.16Å; S459-T461 VanDerWaalsContact C-N 3.31Å; S459-T461 PolarHBondContact O-N 3.37Å; T461-L464 PolarHBondContact O-N 2.97Å; T461-A465 PolarHBondContact O-N 3.22Å; T461-L517 HydrophobicContact CG2-CB 4.49Å; T461-L517 HydrophobicContact CG2-CD2 4.32Å; T461-L517 HydrophobicContact CG2-CG 4.43Å; T461-H518 HydrophobicContact CG2-CB 4.28Å; T461-H518 PolarHBondContact OG1-ND1 3.01Å; T461-F521 HydrophobicContact CG2-CE2 4.5Å; T461-F521 WeakPolarHBondContact OG1-CD2 3.34Å; T461-L770 HydrophobicContact CG2-CD2 3.85Å
462	Y	85.9	Confident	82	Confident	28 Å²	28	19.7 Å²	19.7	11%	0.11	11%	0.109	C	C	.	.	H	α-helix	trans	-66.9	-46.6	175.3	-171.3	-89	0	0	0	111.4	P456 C457 S459 L460 L464 A465 L466 C773 A777	P456-Y462 WeakPolarHBondContact O-CB 3.3Å; C457-Y462 WeakPolarHBondContact O-CD1 3.17Å; S459-Y462 PolarHBondContact O-N 3.23Å; S459-Y462 WeakPolarHBondContact OG-CB 3.29Å; S459-Y462 PolarHBondContact OG-N 3.41Å; L460-Y462 VanDerWaalsContact C-N 3.33Å; L460-Y462 PolarHBondContact O-N 3.39Å; Y462-L464 VanDerWaalsContact C-N 3.31Å; Y462-L464 PolarHBondContact O-N 3.12Å; Y462-A465 PolarHBondContact O-N 2.74Å; Y462-L466 HydrophobicContact CD1-CD1 3.93Å; Y462-L466 HydrophobicContact CD1-CG 4.45Å; Y462-L466 HydrophobicContact CE1-CD1 3.54Å; Y462-L466 HydrophobicContact CE1-CG 4.29Å; Y462-L466 WeakPolarHBondContact O-CG 3.05Å; Y462-L466 PolarHBondContact O-N 2.87Å; Y462-C773 HydrophobicContact CD2-CB 4.47Å; Y462-A777 HydrophobicContact CE1-CB 4.46Å; Y462-A777 HydrophobicContact CE2-CB 3.79Å; Y462-A777 VanDerWaalsContact OH-CA 3.24Å; Y462-A777 WeakPolarHBondContact OH-CA 3.11Å; Y462-A777 WeakPolarHBondContact OH-CB 3.48Å
463	R	86.5	Confident	82.4	Confident	26 Å²	26	24 Å²	24	10%	0.098	13%	0.125	C	C	.	.	H	α-helix	trans	-61.1	-38.7	175	-71.8	-172.9	-64.1	153.1	15.9	112.6	Y413 L414 S459 L460 L466 C467	Y413-R463 HydrophobicContact CE1-CB 3.82Å; Y413-R463 HydrophobicContact CE1-CG 4.02Å; Y413-R463 PolarHBondContact O-NH1 3.28Å; L414-R463 HydrophobicContact CD2-CB 4.3Å; L414-R463 PolarHBondContact O-NH2 3.25Å; S459-R463 PolarHBondContact O-N 2.7Å; S459-R463 VanDerWaalsContact O-N 3.14Å; L460-R463 PolarHBondContact O-N 2.76Å; R463-L466 PolarHBondContact O-N 3.37Å; R463-C467 WeakPolarHBondContact O-CB 3.32Å; R463-C467 PolarHBondContact O-N 3.27Å; R463-C467 PolarHBondContact O-SG 3.07Å
464	L	87.7	Confident	82.2	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.6	-45.4	175.6	-176	69.7	0	0	0	111.5	L414 L460 T461 Y462 L466 C467 L468 W485 F488 F521 L770	L414-L464 HydrophobicContact CD1-CD1 3.98Å; L414-L464 HydrophobicContact CD2-CB 4.21Å; L414-L464 HydrophobicContact CD2-CD1 4.2Å; L460-L464 VanDerWaalsContact O-CB 3.29Å; L460-L464 WeakPolarHBondContact O-CB 3.44Å; L460-L464 PolarHBondContact O-N 2.97Å; T461-L464 PolarHBondContact O-N 2.97Å; Y462-L464 VanDerWaalsContact C-N 3.31Å; Y462-L464 PolarHBondContact O-N 3.12Å; L464-L466 VanDerWaalsContact C-N 3.32Å; L464-L466 PolarHBondContact O-N 2.77Å; L464-C467 PolarHBondContact O-N 2.78Å; L464-L468 HydrophobicContact CD1-CD1 3.42Å; L464-L468 VanDerWaalsContact CD1-CD1 3.42Å; L464-L468 HydrophobicContact CG-CD1 3.85Å; L464-L468 VanDerWaalsContact O-CD1 3.3Å; L464-L468 WeakPolarHBondContact O-CD1 3.39Å; L464-L468 PolarHBondContact O-N 3.3Å; L464-W485 HydrophobicContact CD2-CZ3 3.95Å; L464-F488 HydrophobicContact CD1-CD2 4.09Å; L464-F488 HydrophobicContact CD1-CE2 4.09Å; L464-F488 HydrophobicContact CD1-CG 4.45Å; L464-F488 HydrophobicContact CD1-CZ 4.47Å; L464-F488 HydrophobicContact CD2-CE1 4.15Å; L464-F488 HydrophobicContact CD2-CE2 4.49Å; L464-F488 HydrophobicContact CD2-CZ 4.06Å; L464-F521 HydrophobicContact CD2-CE2 4.39Å; L464-F521 HydrophobicContact CD2-CZ 4.35Å; L464-L770 HydrophobicContact CD2-CD1 4.33Å; L464-L770 HydrophobicContact CD2-CD2 4.3Å; L464-L770 HydrophobicContact CG-CD1 4.3Å
465	A	87.8	Confident	81.6	Confident	1 Å²	1	27.8 Å²	27.8	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-56.9	-45.8	177.2	0	0	0	0	0	111.9	T461 Y462 C469 L770 C773	T461-A465 PolarHBondContact O-N 3.22Å; Y462-A465 PolarHBondContact O-N 2.74Å; A465-C469 WeakPolarHBondContact O-CB 3.34Å; A465-C469 PolarHBondContact O-N 2.66Å; A465-C469 VanDerWaalsContact O-N 3.08Å; A465-L770 HydrophobicContact CB-CB 4.1Å; A465-L770 HydrophobicContact CB-CD2 4.05Å; A465-C773 HydrophobicContact CB-CB 3.78Å
466	L	85.1	Confident	81	Confident	4 Å²	4	29.9 Å²	29.9	2%	0.021	17%	0.167	C	C	.	.	H	α-helix	trans	-65.5	-46.1	177.8	-64.3	-177.3	0	0	0	112.1	G264 L266 Y462 R463 L464 L468 C469 M470 L774 A777	G264-L466 WeakPolarHBondContact O-CD1 3.34Å; L266-L466 HydrophobicContact CD1-CD2 4.03Å; L266-L466 HydrophobicContact CD2-CD2 3.55Å; L266-L466 HydrophobicContact CG-CD2 3.59Å; Y462-L466 HydrophobicContact CD1-CD1 3.93Å; Y462-L466 HydrophobicContact CD1-CG 4.45Å; Y462-L466 HydrophobicContact CE1-CD1 3.54Å; Y462-L466 HydrophobicContact CE1-CG 4.29Å; Y462-L466 WeakPolarHBondContact O-CG 3.05Å; Y462-L466 PolarHBondContact O-N 2.87Å; R463-L466 PolarHBondContact O-N 3.37Å; L464-L466 VanDerWaalsContact C-N 3.32Å; L464-L466 PolarHBondContact O-N 2.77Å; L466-L468 PolarHBondContact O-N 2.63Å; L466-C469 WeakPolarHBondContact O-CB 3.48Å; L466-C469 PolarHBondContact O-N 3.35Å; L466-M470 WeakPolarHBondContact O-CG 3.29Å; L466-M470 PolarHBondContact O-N 3.04Å; L466-L774 HydrophobicContact CD2-CD1 4.33Å; L466-A777 HydrophobicContact CD2-CB 3.76Å
467	C	84.1	Confident	80.9	Confident	1 Å²	1	27.9 Å²	27.9	1%	0.007	16%	0.158	C	C	.	.	H	α-helix	trans	-61.2	-43	178.3	-68	0	0	0	0	112.2	I410 Y413 L414 R463 L464 C469 M470 V471	I410-C467 HydrophobicContact CG2-CB 4.44Å; Y413-C467 WeakPolarHBondContact CD1-SG 3.27Å; Y413-C467 VanDerWaalsContact CE1-SG 3.5Å; L414-C467 HydrophobicContact CD2-CB 4.49Å; R463-C467 WeakPolarHBondContact O-CB 3.32Å; R463-C467 PolarHBondContact O-N 3.27Å; R463-C467 PolarHBondContact O-SG 3.07Å; L464-C467 PolarHBondContact O-N 2.78Å; C467-C469 VanDerWaalsContact C-N 3.35Å; C467-M470 PolarHBondContact O-N 3.49Å; C467-V471 WeakPolarHBondContact O-CB 3.21Å; C467-V471 VanDerWaalsContact O-CG2 3.27Å; C467-V471 WeakPolarHBondContact O-CG2 3.43Å; C467-V471 PolarHBondContact O-N 3.14Å
468	L	85.3	Confident	81.2	Confident	1 Å²	1	26.5 Å²	26.5	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-66	-38.7	178.8	-95.5	71.5	0	0	0	112	F330 L464 L466 M470 V471 N472 V481 L484 L766 L770	F330-L468 HydrophobicContact CE2-CB 4.28Å; L464-L468 HydrophobicContact CD1-CD1 3.42Å; L464-L468 VanDerWaalsContact CD1-CD1 3.42Å; L464-L468 HydrophobicContact CG-CD1 3.85Å; L464-L468 VanDerWaalsContact O-CD1 3.3Å; L464-L468 WeakPolarHBondContact O-CD1 3.39Å; L464-L468 PolarHBondContact O-N 3.3Å; L466-L468 PolarHBondContact O-N 2.63Å; L468-M470 VanDerWaalsContact C-N 3.34Å; L468-V471 PolarHBondContact O-N 3.42Å; L468-N472 WeakPolarHBondContact O-CB 3.35Å; L468-N472 PolarHBondContact O-N 2.99Å; L468-V481 HydrophobicContact CD2-CG1 3.85Å; L468-V481 HydrophobicContact CG-CG1 4.2Å; L468-L484 HydrophobicContact CD1-CD2 3.66Å; L468-L484 HydrophobicContact CD1-CG 4.45Å; L468-L484 HydrophobicContact CG-CD2 4.4Å; L468-L766 HydrophobicContact CD2-CD2 3.51Å; L468-L766 HydrophobicContact CD2-CG 4Å; L468-L770 HydrophobicContact CD2-CD1 3.67Å
469	C	84.1	Confident	81.4	Confident	1 Å²	1	20.8 Å²	20.8	1%	0.007	12%	0.119	C	C	.	.	H	α-helix	trans	-58.3	-47.6	173	-170	0	0	0	0	111.1	F330 A465 L466 C467 N472 Y473 L774	F330-C469 HydrophobicContact CD2-CB 4.15Å; A465-C469 WeakPolarHBondContact O-CB 3.34Å; A465-C469 PolarHBondContact O-N 2.66Å; A465-C469 VanDerWaalsContact O-N 3.08Å; L466-C469 WeakPolarHBondContact O-CB 3.48Å; L466-C469 PolarHBondContact O-N 3.35Å; C467-C469 VanDerWaalsContact C-N 3.35Å; C469-N472 PolarHBondContact O-N 3.39Å; C469-Y473 PolarHBondContact O-N 3.26Å; C469-L774 HydrophobicContact CB-CD1 3.91Å; C469-L774 HydrophobicContact CB-CD2 4.48Å
470	M	79.9	Confident	81.4	Confident	5 Å²	5	20.6 Å²	20.6	3%	0.025	12%	0.118	C	C	.	.	H	α-helix	trans	-64.1	-44.5	178.4	-63.3	-44.3	-69.7	0	0	113.1	V261 P267 F326 L466 C467 L468 N472 Y473 S474	V261-M470 HydrophobicContact CB-CE 3.82Å; V261-M470 HydrophobicContact CG1-CB 3.89Å; V261-M470 HydrophobicContact CG1-CE 3.28Å; V261-M470 HydrophobicContact CG1-CG 3.79Å; V261-M470 HydrophobicContact CG1-SD 4.33Å; V261-M470 HydrophobicContact CG2-CE 3.42Å; V261-M470 VanDerWaalsContact CG2-CE 3.42Å; P267-M470 HydrophobicContact CG-CE 4.3Å; P267-M470 HydrophobicContact CG-SD 4.41Å; F326-M470 HydrophobicContact CD1-CE 4.35Å; F326-M470 HydrophobicContact CD1-SD 3.81Å; F326-M470 HydrophobicContact CE1-CE 3.39Å; F326-M470 HydrophobicContact CE1-SD 3.4Å; F326-M470 WeakPolarHBondContact CE1-SD 3.31Å; F326-M470 HydrophobicContact CZ-CE 3.79Å; F326-M470 HydrophobicContact CZ-SD 4.33Å; L466-M470 WeakPolarHBondContact O-CG 3.29Å; L466-M470 PolarHBondContact O-N 3.04Å; C467-M470 PolarHBondContact O-N 3.49Å; L468-M470 VanDerWaalsContact C-N 3.34Å; M470-N472 VanDerWaalsContact C-N 3.34Å; M470-N472 PolarHBondContact O-N 2.93Å; M470-Y473 PolarHBondContact O-N 2.7Å; M470-S474 VanDerWaalsContact O-CB 3.29Å; M470-S474 WeakPolarHBondContact O-CB 3.48Å; M470-S474 PolarHBondContact O-N 3.21Å; M470-S474 PolarHBondContact O-OG 2.88Å
471	V	81.1	Confident	81.3	Confident	1 Å²	1	20.7 Å²	20.7	1%	0.006	12%	0.119	C	C	.	.	H	α-helix	trans	-64.2	-40.7	-179.7	167.3	0	0	0	0	111.5	L402 I410 C467 L468 Y475 A480 V481 L484	L402-V471 HydrophobicContact CD1-CG1 4.24Å; L402-V471 HydrophobicContact CD2-CG1 4.16Å; I410-V471 HydrophobicContact CD1-CG2 3.66Å; C467-V471 WeakPolarHBondContact O-CB 3.21Å; C467-V471 VanDerWaalsContact O-CG2 3.27Å; C467-V471 WeakPolarHBondContact O-CG2 3.43Å; C467-V471 PolarHBondContact O-N 3.14Å; L468-V471 PolarHBondContact O-N 3.42Å; V471-Y475 PolarHBondContact O-N 2.99Å; V471-Y475 VanDerWaalsContact O-N 3.16Å; V471-A480 HydrophobicContact CG1-CB 3.56Å; V471-V481 HydrophobicContact CG1-CG2 4.36Å; V471-L484 HydrophobicContact CG2-CD2 4.14Å
472	N	82.6	Confident	81.2	Confident	15 Å²	15	20.7 Å²	20.7	8%	0.08	12%	0.119	C	C	.	.	H	α-helix	trans	-59.5	-49.9	177.1	-177.3	47.9	0	0	0	111.5	E329 L333 L468 C469 M470 G477 V481	E329-N472 PolarHBondContact O-ND2 3.23Å; L333-N472 HydrophobicContact CD1-CB 3.83Å; L333-N472 WeakPolarHBondContact CD1-ND2 3.3Å; L333-N472 WeakPolarHBondContact CD1-OD1 3.23Å; L333-N472 WeakPolarHBondContact CD2-OD1 3.44Å; L468-N472 WeakPolarHBondContact O-CB 3.35Å; L468-N472 PolarHBondContact O-N 2.99Å; C469-N472 PolarHBondContact O-N 3.39Å; M470-N472 VanDerWaalsContact C-N 3.34Å; M470-N472 PolarHBondContact O-N 2.93Å; N472-G477 VanDerWaalsContact O-CA 3.24Å; N472-G477 WeakPolarHBondContact O-CA 3.44Å; N472-G477 PolarHBondContact O-N 2.96Å; N472-G477 WeakPolarHBondContact OD1-CA 3.5Å; N472-V481 HydrophobicContact CB-CG2 3.93Å
473	Y	77.4	Confident	81.2	Confident	94 Å²	94	20.8 Å²	20.8	37%	0.369	12%	0.12	S	C	.	.	H	α-helix	trans	-75.9	-39.6	-175.2	-169.4	-87.3	0	0	0	113	D325 F326 E329 C469 M470	D325-Y473 HydrophobicContact CB-CE2 3.92Å; F326-Y473 HydrophobicContact CD1-CD1 4.39Å; F326-Y473 HydrophobicContact CD1-CD2 4.48Å; F326-Y473 AromaticContact CD1-CG 3.95Å; F326-Y473 HydrophobicContact CD1-CG 3.95Å; F326-Y473 AromaticContact CD2-CD1 3.89Å; F326-Y473 HydrophobicContact CD2-CD1 3.89Å; F326-Y473 AromaticContact CD2-CD2 3.83Å; F326-Y473 HydrophobicContact CD2-CD2 3.83Å; F326-Y473 HydrophobicContact CD2-CE1 4.01Å; F326-Y473 AromaticContact CD2-CE2 3.97Å; F326-Y473 HydrophobicContact CD2-CE2 3.97Å; F326-Y473 AromaticContact CD2-CG 3.78Å; F326-Y473 HydrophobicContact CD2-CG 3.78Å; F326-Y473 VanDerWaalsContact CE1-CB 3.45Å; F326-Y473 AromaticContact CE1-CD1 3.72Å; F326-Y473 HydrophobicContact CE1-CD1 3.72Å; F326-Y473 AromaticContact CE1-CG 3.68Å; F326-Y473 HydrophobicContact CE1-CG 3.68Å; F326-Y473 AromaticContact CE2-CD1 3.2Å; F326-Y473 HydrophobicContact CE2-CD1 3.2Å; F326-Y473 HydrophobicContact CE2-CD2 4.02Å; F326-Y473 AromaticContact CE2-CE1 3.28Å; F326-Y473 HydrophobicContact CE2-CE1 3.28Å; F326-Y473 HydrophobicContact CE2-CE2 4.1Å; F326-Y473 AromaticContact CE2-CG 3.57Å; F326-Y473 HydrophobicContact CE2-CG 3.57Å; F326-Y473 AromaticContact CE2-CZ 3.74Å; F326-Y473 HydrophobicContact CG-CD1 4.48Å; F326-Y473 HydrophobicContact CG-CD2 4.13Å; F326-Y473 HydrophobicContact CG-CG 4.02Å; F326-Y473 AromaticContact CZ-CD1 3.09Å; F326-Y473 HydrophobicContact CZ-CD1 3.09Å; F326-Y473 HydrophobicContact CZ-CD2 4.39Å; F326-Y473 AromaticContact CZ-CE1 3.65Å; F326-Y473 HydrophobicContact CZ-CE1 3.65Å; F326-Y473 AromaticContact CZ-CG 3.52Å; F326-Y473 HydrophobicContact CZ-CG 3.52Å; E329-Y473 HydrophobicContact CB-CD2 4.34Å; E329-Y473 HydrophobicContact CG-CD2 4.07Å; E329-Y473 HydrophobicContact CG-CE2 4.34Å; C469-Y473 PolarHBondContact O-N 3.26Å; M470-Y473 PolarHBondContact O-N 2.7Å
474	S	71.2	Confident	81.2	Confident	49 Å²	49	19.5 Å²	19.5	34%	0.343	12%	0.115	S	C	.	.	H	α-helix	trans	-104.3	-23.5	-164	-50.3	0	0	0	0	115.3	M470	M470-S474 VanDerWaalsContact O-CB 3.29Å; M470-S474 WeakPolarHBondContact O-CB 3.48Å; M470-S474 PolarHBondContact O-N 3.21Å; M470-S474 PolarHBondContact O-OG 2.88Å
475	Y	68.3	Low	81.3	Confident	78 Å²	78	19.9 Å²	19.9	31%	0.306	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-132.3	5.6	-162.7	-64.2	-70.6	0	0	0	116.4	M406 V471	M406-Y475 HydrophobicContact CE-CD1 4.3Å; M406-Y475 HydrophobicContact CE-CE1 3.6Å; M406-Y475 HydrophobicContact CE-CE2 4.31Å; M406-Y475 HydrophobicContact SD-CE1 4.47Å; M406-Y475 HydrophobicContact SD-CE2 4.34Å; V471-Y475 PolarHBondContact O-N 2.99Å; V471-Y475 VanDerWaalsContact O-N 3.16Å
476	G	66.6	Low	81.2	Confident	46 Å²	46	24 Å²	24	47%	0.474	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	142.5	21	172	0	0	0	0	0	116.9	A480	G476-A480 PolarHBondContact O-N 3.22Å
477	G	78.5	Confident	81.2	Confident	21 Å²	21	26.9 Å²	26.9	22%	0.216	15%	0.149	C	C	.	.	H	α-helix	trans	60.3	-145.1	169.9	0	0	0	0	0	114.3	N472 A479 A480 V481	N472-G477 VanDerWaalsContact O-CA 3.24Å; N472-G477 WeakPolarHBondContact O-CA 3.44Å; N472-G477 PolarHBondContact O-N 2.96Å; N472-G477 WeakPolarHBondContact OD1-CA 3.5Å; G477-A479 VanDerWaalsContact C-N 3.3Å; G477-A479 PolarHBondContact O-N 2.9Å; G477-A480 PolarHBondContact O-N 3.36Å; G477-V481 WeakPolarHBondContact O-CG2 3.48Å; G477-V481 PolarHBondContact O-N 2.92Å; G477-V481 VanDerWaalsContact O-N 3.14Å
478	L	80.1	Confident	81.5	Confident	33 Å²	33	26.9 Å²	26.9	17%	0.173	15%	0.149	C	C	.	.	H	α-helix	trans	-58.6	-36.4	-175.9	-176	67.9	0	0	0	113.4	L333 Q336 I343 V481 A482 P763	L333-L478 HydrophobicContact CD2-CB 4.11Å; L333-L478 HydrophobicContact CD2-CD1 3.73Å; L333-L478 HydrophobicContact CD2-CG 4.5Å; Q336-L478 HydrophobicContact CG-CD2 4.43Å; I343-L478 HydrophobicContact CD1-CD1 4.05Å; I343-L478 HydrophobicContact CD1-CD2 3.67Å; I343-L478 HydrophobicContact CD1-CG 3.72Å; I343-L478 HydrophobicContact CG1-CD2 3.87Å; I343-L478 HydrophobicContact CG1-CG 4.22Å; I343-L478 HydrophobicContact CG2-CD2 4.35Å; I343-L478 HydrophobicContact CG2-CG 4.08Å; L478-V481 PolarHBondContact O-N 3.34Å; L478-A482 WeakPolarHBondContact O-CB 3.33Å; L478-A482 PolarHBondContact O-N 2.99Å; L478-P763 HydrophobicContact CD1-CB 3.94Å
479	A	80.6	Confident	81.6	Confident	28 Å²	28	27.6 Å²	27.6	23%	0.231	15%	0.154	C	C	.	.	H	α-helix	trans	-69	-39.4	-179.9	0	0	0	0	0	112.4	I343 P401 G477 A482 H483	I343-A479 HydrophobicContact CG2-CB 4.02Å; P401-A479 HydrophobicContact CB-CB 4.02Å; P401-A479 HydrophobicContact CG-CB 4Å; G477-A479 VanDerWaalsContact C-N 3.3Å; G477-A479 PolarHBondContact O-N 2.9Å; A479-A482 PolarHBondContact O-N 2.95Å; A479-H483 WeakPolarHBondContact O-CB 3.18Å; A479-H483 PolarHBondContact O-N 3.11Å
480	A	82.8	Confident	81.8	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.7	-40.7	174.4	0	0	0	0	0	112	L402 V471 G476 G477 H483 L484	L402-A480 HydrophobicContact CD1-CB 4.09Å; L402-A480 WeakPolarHBondContact CD1-O 2.94Å; L402-A480 HydrophobicContact CD2-CB 3.72Å; L402-A480 HydrophobicContact CG-CB 3.67Å; V471-A480 HydrophobicContact CG1-CB 3.56Å; G476-A480 PolarHBondContact O-N 3.22Å; G477-A480 PolarHBondContact O-N 3.36Å; A480-H483 PolarHBondContact O-N 2.87Å; A480-L484 WeakPolarHBondContact O-CB 3.38Å; A480-L484 PolarHBondContact O-N 2.63Å
481	V	85.6	Confident	82	Confident	3 Å²	3	33.8 Å²	33.8	2%	0.018	18%	0.184	C	C	.	.	H	α-helix	trans	-62.5	-44.3	175.4	173.8	0	0	0	0	111.4	L333 L468 V471 N472 G477 L478 L484 W485 P763	L333-V481 HydrophobicContact CD1-CG2 4.34Å; L468-V481 HydrophobicContact CD2-CG1 3.85Å; L468-V481 HydrophobicContact CG-CG1 4.2Å; V471-V481 HydrophobicContact CG1-CG2 4.36Å; N472-V481 HydrophobicContact CB-CG2 3.93Å; G477-V481 WeakPolarHBondContact O-CG2 3.48Å; G477-V481 PolarHBondContact O-N 2.92Å; G477-V481 VanDerWaalsContact O-N 3.14Å; L478-V481 PolarHBondContact O-N 3.34Å; V481-L484 PolarHBondContact O-N 2.76Å; V481-W485 WeakPolarHBondContact O-CB 3.43Å; V481-W485 PolarHBondContact O-N 2.68Å; V481-P763 HydrophobicContact CG1-CB 4.47Å
482	A	84.8	Confident	82.3	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.8	-44.9	177.4	0	0	0	0	0	112	A340 I343 L344 L478 A479 W485 Q486 P763	A340-A482 HydrophobicContact CB-CB 4.2Å; I343-A482 HydrophobicContact CG2-CB 4.22Å; L344-A482 HydrophobicContact CD1-CB 4.31Å; L344-A482 HydrophobicContact CD2-CB 4.42Å; L344-A482 HydrophobicContact CG-CB 4.18Å; L478-A482 WeakPolarHBondContact O-CB 3.33Å; L478-A482 PolarHBondContact O-N 2.99Å; A479-A482 PolarHBondContact O-N 2.95Å; A482-W485 PolarHBondContact O-N 3.15Å; A482-Q486 PolarHBondContact O-N 3.21Å; A482-Q486 VanDerWaalsContact O-N 3.1Å; A482-P763 HydrophobicContact CB-CG 3.98Å
483	H	84.8	Confident	82.6	Confident	29 Å²	29	38.9 Å²	38.9	13%	0.134	20%	0.202	C	C	.	.	H	α-helix	trans	-62.6	-46.3	177.4	-178.8	-142.6	0	0	0	112	L344 A479 A480 W485 Q486 E487	L344-H483 HydrophobicContact CD2-CB 4.08Å; A479-H483 WeakPolarHBondContact O-CB 3.18Å; A479-H483 PolarHBondContact O-N 3.11Å; A480-H483 PolarHBondContact O-N 2.87Å; H483-W485 VanDerWaalsContact C-N 3.33Å; H483-W485 PolarHBondContact O-N 3Å; H483-Q486 PolarHBondContact O-N 3.48Å; H483-E487 PolarHBondContact O-N 3.03Å
484	L	86.9	Confident	83	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.4	-40.8	177	177.4	62.4	0	0	0	112	L402 L407 I410 L468 V471 A480 V481 E487 F488	L402-L484 HydrophobicContact CD1-CB 4.12Å; L407-L484 HydrophobicContact CD1-CD1 3.84Å; I410-L484 HydrophobicContact CB-CD1 4.44Å; I410-L484 HydrophobicContact CG2-CD1 3.64Å; I410-L484 HydrophobicContact CG2-CD2 4.02Å; L468-L484 HydrophobicContact CD1-CD2 3.66Å; L468-L484 HydrophobicContact CD1-CG 4.45Å; L468-L484 HydrophobicContact CG-CD2 4.4Å; V471-L484 HydrophobicContact CG2-CD2 4.14Å; A480-L484 WeakPolarHBondContact O-CB 3.38Å; A480-L484 PolarHBondContact O-N 2.63Å; V481-L484 PolarHBondContact O-N 2.76Å; L484-E487 PolarHBondContact O-N 2.8Å; L484-F488 VanDerWaalsContact O-CB 3.31Å; L484-F488 WeakPolarHBondContact O-CB 3.4Å; L484-F488 PolarHBondContact O-N 3.47Å
485	W	89.7	Confident	83.7	Confident	7 Å²	7	37.3 Å²	37.3	3%	0.027	19%	0.189	C	C	.	.	H	α-helix	trans	-63.5	-42.9	178.9	-178.1	-119.7	0	0	0	112.3	L464 V481 A482 H483 E487 F488 V489 L517 F521 L758 M761 L766	L464-W485 HydrophobicContact CD2-CZ3 3.95Å; V481-W485 WeakPolarHBondContact O-CB 3.43Å; V481-W485 PolarHBondContact O-N 2.68Å; A482-W485 PolarHBondContact O-N 3.15Å; H483-W485 VanDerWaalsContact C-N 3.33Å; H483-W485 PolarHBondContact O-N 3Å; W485-E487 PolarHBondContact O-N 2.92Å; W485-F488 HydrophobicContact CE3-CB 4.45Å; W485-F488 AromaticContact CE3-CD1 3.81Å; W485-F488 HydrophobicContact CE3-CD1 3.81Å; W485-F488 HydrophobicContact CE3-CG 4.42Å; W485-F488 HydrophobicContact CH2-CD1 4.25Å; W485-F488 HydrophobicContact CH2-CE1 4.34Å; W485-F488 AromaticContact CZ3-CD1 3.45Å; W485-F488 HydrophobicContact CZ3-CD1 3.45Å; W485-F488 VanDerWaalsContact CZ3-CD1 3.45Å; W485-F488 AromaticContact CZ3-CE1 3.73Å; W485-F488 HydrophobicContact CZ3-CE1 3.73Å; W485-F488 HydrophobicContact CZ3-CG 4.41Å; W485-F488 PolarHBondContact O-N 3.01Å; W485-V489 HydrophobicContact CD2-CG2 4.09Å; W485-V489 HydrophobicContact CH2-CG2 4.42Å; W485-V489 HydrophobicContact CZ2-CG2 3.92Å; W485-V489 WeakPolarHBondContact O-CG2 3.33Å; W485-V489 PolarHBondContact O-N 2.98Å; W485-L517 HydrophobicContact CH2-CD1 4.29Å; W485-F521 HydrophobicContact CH2-CZ 4.43Å; W485-L758 HydrophobicContact CH2-CD2 3.89Å; W485-L758 HydrophobicContact CZ2-CB 4.13Å; W485-L758 HydrophobicContact CZ2-CD2 3.94Å; W485-L758 PolarHBondContact NE1-O 3.25Å; W485-L758 VanDerWaalsContact NE1-O 3.1Å; W485-M761 HydrophobicContact CZ2-CB 4.46Å; W485-M761 HydrophobicContact CZ2-SD 4.01Å; W485-L766 HydrophobicContact CB-CD2 3.91Å; W485-L766 HydrophobicContact CD2-CD1 4.15Å; W485-L766 HydrophobicContact CD2-CD2 3.37Å; W485-L766 HydrophobicContact CD2-CG 4.34Å; W485-L766 HydrophobicContact CE3-CD1 3.83Å; W485-L766 HydrophobicContact CE3-CD2 3.45Å; W485-L766 VanDerWaalsContact CE3-CD2 3.45Å; W485-L766 HydrophobicContact CE3-CG 4.28Å; W485-L766 HydrophobicContact CG-CD2 3.59Å; W485-L766 HydrophobicContact CH2-CD1 3.59Å; W485-L766 HydrophobicContact CZ2-CD1 3.94Å; W485-L766 HydrophobicContact CZ3-CD1 3.55Å; W485-L766 HydrophobicContact CZ3-CD2 4.1Å; W485-L766 HydrophobicContact CZ3-CG 4.48Å
486	Q	86	Confident	84.6	Confident	89 Å²	89	34.3 Å²	34.3	42%	0.416	18%	0.177	S	C	.	.	H	α-helix	trans	-60.7	-46.9	178	-174.2	174.5	0.3	0	0	111.7	A482 H483 F488 V489 L490	A482-Q486 PolarHBondContact O-N 3.21Å; A482-Q486 VanDerWaalsContact O-N 3.1Å; H483-Q486 PolarHBondContact O-N 3.48Å; Q486-F488 VanDerWaalsContact C-N 3.34Å; Q486-F488 PolarHBondContact O-N 3.11Å; Q486-V489 PolarHBondContact O-N 3.04Å; Q486-L490 HydrophobicContact CG-CD1 4.49Å; Q486-L490 WeakPolarHBondContact O-CG 3.48Å; Q486-L490 PolarHBondContact O-N 3.4Å
487	E	85.5	Confident	85.5	Confident	64 Å²	64	37.3 Å²	37.3	30%	0.299	18%	0.179	S	C	.	.	H	α-helix	trans	-65.1	-38	177.4	-69.7	-65.2	138.9	0	0	112	L407 H483 L484 W485 L490 E491	L407-E487 HydrophobicContact CD1-CB 4.34Å; L407-E487 HydrophobicContact CD1-CG 4.42Å; L407-E487 HydrophobicContact CD2-CG 4.03Å; H483-E487 PolarHBondContact O-N 3.03Å; L484-E487 PolarHBondContact O-N 2.8Å; W485-E487 PolarHBondContact O-N 2.92Å; E487-L490 PolarHBondContact O-N 3.47Å; E487-E491 WeakPolarHBondContact O-CB 3.46Å; E487-E491 PolarHBondContact O-N 3.01Å
488	F	89.5	Confident	85.7	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.7	-43.7	174.4	-179.3	-93.9	0	0	0	112.4	L414 F415 L460 L464 L484 W485 Q486 E491 L492 F521	L414-F488 HydrophobicContact CD1-CD2 3.95Å; L414-F488 HydrophobicContact CD1-CE2 4.31Å; F415-F488 HydrophobicContact CE1-CE2 4.32Å; F415-F488 AromaticContact CE2-CD2 3.71Å; F415-F488 HydrophobicContact CE2-CD2 3.71Å; F415-F488 AromaticContact CE2-CE2 3.78Å; F415-F488 HydrophobicContact CE2-CE2 3.78Å; F415-F488 AromaticContact CZ-CD2 3.76Å; F415-F488 HydrophobicContact CZ-CD2 3.76Å; F415-F488 AromaticContact CZ-CE2 3.37Å; F415-F488 HydrophobicContact CZ-CE2 3.37Å; F415-F488 HydrophobicContact CZ-CZ 4.12Å; L460-F488 HydrophobicContact CD1-CE2 4.26Å; L460-F488 HydrophobicContact CD2-CE2 4.16Å; L460-F488 HydrophobicContact CD2-CZ 3.89Å; L460-F488 HydrophobicContact CG-CE2 4.39Å; L460-F488 HydrophobicContact CG-CZ 4.31Å; L464-F488 HydrophobicContact CD1-CD2 4.09Å; L464-F488 HydrophobicContact CD1-CE2 4.09Å; L464-F488 HydrophobicContact CD1-CG 4.45Å; L464-F488 HydrophobicContact CD1-CZ 4.47Å; L464-F488 HydrophobicContact CD2-CE1 4.15Å; L464-F488 HydrophobicContact CD2-CE2 4.49Å; L464-F488 HydrophobicContact CD2-CZ 4.06Å; L484-F488 VanDerWaalsContact O-CB 3.31Å; L484-F488 WeakPolarHBondContact O-CB 3.4Å; L484-F488 PolarHBondContact O-N 3.47Å; W485-F488 HydrophobicContact CE3-CB 4.45Å; W485-F488 AromaticContact CE3-CD1 3.81Å; W485-F488 HydrophobicContact CE3-CD1 3.81Å; W485-F488 HydrophobicContact CE3-CG 4.42Å; W485-F488 HydrophobicContact CH2-CD1 4.25Å; W485-F488 HydrophobicContact CH2-CE1 4.34Å; W485-F488 AromaticContact CZ3-CD1 3.45Å; W485-F488 HydrophobicContact CZ3-CD1 3.45Å; W485-F488 VanDerWaalsContact CZ3-CD1 3.45Å; W485-F488 AromaticContact CZ3-CE1 3.73Å; W485-F488 HydrophobicContact CZ3-CE1 3.73Å; W485-F488 HydrophobicContact CZ3-CG 4.41Å; W485-F488 PolarHBondContact O-N 3.01Å; Q486-F488 VanDerWaalsContact C-N 3.34Å; Q486-F488 PolarHBondContact O-N 3.11Å; F488-E491 PolarHBondContact O-N 3.01Å; F488-L492 HydrophobicContact CD1-CD1 4.02Å; F488-L492 HydrophobicContact CD1-CG 4.38Å; F488-L492 HydrophobicContact CE1-CD1 3.49Å; F488-L492 VanDerWaalsContact CE1-CD1 3.49Å; F488-L492 HydrophobicContact CE1-CG 4.04Å; F488-L492 HydrophobicContact CZ-CD1 4.12Å; F488-L492 HydrophobicContact CZ-CD2 4.48Å; F488-L492 HydrophobicContact CZ-CG 4.37Å; F488-L492 WeakPolarHBondContact O-CG 2.74Å; F488-L492 PolarHBondContact O-N 3.33Å; F488-F521 AromaticContact CE1-CE1 3.96Å; F488-F521 HydrophobicContact CE1-CE1 3.96Å; F488-F521 HydrophobicContact CE1-CE2 4.42Å; F488-F521 AromaticContact CE1-CZ 3.61Å; F488-F521 HydrophobicContact CE1-CZ 3.61Å; F488-F521 HydrophobicContact CZ-CE1 4.45Å; F488-F521 HydrophobicContact CZ-CE2 4.29Å; F488-F521 AromaticContact CZ-CZ 3.91Å; F488-F521 HydrophobicContact CZ-CZ 3.91Å
489	V	88.6	Confident	86	Confident	17 Å²	17	40 Å²	40	10%	0.103	19%	0.189	C	C	.	.	H	α-helix	trans	-67	-38.2	177.1	174.4	0	0	0	0	111.5	W485 Q486 E491 L492 R493 L758 A759	W485-V489 HydrophobicContact CD2-CG2 4.09Å; W485-V489 HydrophobicContact CH2-CG2 4.42Å; W485-V489 HydrophobicContact CZ2-CG2 3.92Å; W485-V489 WeakPolarHBondContact O-CG2 3.33Å; W485-V489 PolarHBondContact O-N 2.98Å; Q486-V489 PolarHBondContact O-N 3.04Å; V489-E491 VanDerWaalsContact C-N 3.34Å; V489-L492 PolarHBondContact O-N 3.14Å; V489-R493 PolarHBondContact O-N 3.4Å; V489-L758 HydrophobicContact CG2-CB 4.1Å; V489-A759 HydrophobicContact CG1-CB 4.33Å
490	L	87.1	Confident	86.2	Confident	85 Å²	85	42.3 Å²	42.3	45%	0.445	19%	0.192	S	C	.	.	H	α-helix	trans	-62.3	-41.2	174.2	-72.6	174	0	0	0	111.9	Q486 E487 R493 Y494	Q486-L490 HydrophobicContact CG-CD1 4.49Å; Q486-L490 WeakPolarHBondContact O-CG 3.48Å; Q486-L490 PolarHBondContact O-N 3.4Å; E487-L490 PolarHBondContact O-N 3.47Å; L490-R493 WeakPolarHBondContact O-CB 3.02Å; L490-R493 PolarHBondContact O-N 2.64Å; L490-Y494 PolarHBondContact O-N 2.95Å
491	E	85.1	Confident	86.3	Confident	50 Å²	50	45 Å²	45	23%	0.234	21%	0.206	C	C	.	.	H	α-helix	trans	-65.4	-40.7	175.8	-176.3	57.7	-151.9	0	0	111.8	F415 E487 F488 V489 R493 Y494 R495	F415-E491 HydrophobicContact CD2-CG 3.79Å; F415-E491 HydrophobicContact CE2-CB 4.14Å; F415-E491 HydrophobicContact CE2-CG 3.58Å; F415-E491 HydrophobicContact CZ-CG 4.17Å; E487-E491 WeakPolarHBondContact O-CB 3.46Å; E487-E491 PolarHBondContact O-N 3.01Å; F488-E491 PolarHBondContact O-N 3.01Å; V489-E491 VanDerWaalsContact C-N 3.34Å; E491-R493 VanDerWaalsContact C-N 3.31Å; E491-R493 PolarHBondContact O-N 3.05Å; E491-Y494 WeakPolarHBondContact O-CB 3.39Å; E491-Y494 PolarHBondContact O-N 3.31Å; E491-R495 WeakPolarHBondContact O-CG 3.48Å; E491-R495 PolarHBondContact O-N 3.4Å; E491-R495 IonicContact OE1-NE 3.68Å
492	L	86.9	Confident	86.2	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.5	-39.4	173	-71.2	-176.9	0	0	0	112.3	F415 F488 V489 R495 W496 V502 F521 L524 L755 L758	F415-L492 HydrophobicContact CE1-CD2 4.48Å; F415-L492 HydrophobicContact CZ-CD2 4.2Å; F488-L492 HydrophobicContact CD1-CD1 4.02Å; F488-L492 HydrophobicContact CD1-CG 4.38Å; F488-L492 HydrophobicContact CE1-CD1 3.49Å; F488-L492 VanDerWaalsContact CE1-CD1 3.49Å; F488-L492 HydrophobicContact CE1-CG 4.04Å; F488-L492 HydrophobicContact CZ-CD1 4.12Å; F488-L492 HydrophobicContact CZ-CD2 4.48Å; F488-L492 HydrophobicContact CZ-CG 4.37Å; F488-L492 WeakPolarHBondContact O-CG 2.74Å; F488-L492 PolarHBondContact O-N 3.33Å; V489-L492 PolarHBondContact O-N 3.14Å; L492-R495 PolarHBondContact O-N 3.14Å; L492-W496 PolarHBondContact O-N 3.14Å; L492-V502 HydrophobicContact CD2-CG1 4.11Å; L492-V502 HydrophobicContact CD2-CG2 3.74Å; L492-F521 HydrophobicContact CD1-CD1 4.18Å; L492-F521 HydrophobicContact CD1-CE1 3.81Å; L492-L524 HydrophobicContact CB-CD2 4.34Å; L492-L524 HydrophobicContact CD2-CD2 4.43Å; L492-L755 HydrophobicContact CB-CD2 4.23Å; L492-L758 HydrophobicContact CD1-CD1 3.81Å
493	R	88.3	Confident	86	Confident	123 Å²	123	50.6 Å²	50.6	46%	0.464	23%	0.228	S	C	.	.	H	α-helix	trans	-64.5	-44.2	174.7	-174.3	177.7	-176.5	146.9	10.8	111.6	V489 L490 E491 R495 W496 E497	V489-R493 PolarHBondContact O-N 3.4Å; L490-R493 WeakPolarHBondContact O-CB 3.02Å; L490-R493 PolarHBondContact O-N 2.64Å; E491-R493 VanDerWaalsContact C-N 3.31Å; E491-R493 PolarHBondContact O-N 3.05Å; R493-R495 VanDerWaalsContact C-N 3.28Å; R493-R495 PolarHBondContact O-N 2.98Å; R493-W496 PolarHBondContact O-N 3.41Å; R493-E497 WeakPolarHBondContact CG-OE1 3.47Å; R493-E497 IonicContact NE-OE1 3.64Å; R493-E497 PolarHBondContact NE-OE1 3.12Å; R493-E497 VanDerWaalsContact NE-OE1 3.14Å; R493-E497 WeakPolarHBondContact O-CG 3.36Å; R493-E497 PolarHBondContact O-N 3.33Å
494	Y	87.1	Confident	85.5	Confident	106 Å²	106	50.4 Å²	50.4	42%	0.416	23%	0.234	S	C	.	.	H	α-helix	trans	-57.4	-41.5	174.7	174.3	-97.4	0	0	0	111.8	L490 E491 E497 N498 Y500	L490-Y494 PolarHBondContact O-N 2.95Å; E491-Y494 WeakPolarHBondContact O-CB 3.39Å; E491-Y494 PolarHBondContact O-N 3.31Å; Y494-E497 PolarHBondContact O-N 3.29Å; Y494-N498 WeakPolarHBondContact CD2-ND2 3.18Å; Y494-N498 WeakPolarHBondContact CE2-ND2 3.39Å; Y494-N498 VanDerWaalsContact CZ-ND2 3.26Å; Y494-N498 WeakPolarHBondContact O-CB 3.29Å; Y494-N498 PolarHBondContact O-N 3.2Å; Y494-N498 PolarHBondContact O-ND2 3.46Å; Y494-Y500 HydrophobicContact CE1-CD2 4.36Å; Y494-Y500 HydrophobicContact CE1-CE2 4.29Å
495	R	84.5	Confident	85.2	Confident	5 Å²	5	51.7 Å²	51.7	2%	0.019	24%	0.241	C	C	.	.	H	α-helix	trans	-65.6	-41.8	176.1	-72.1	175.8	178.5	-120.7	-6.8	112.8	F415 D417 E491 L492 R493 N499 Y500 L501	F415-R495 VanDerWaalsContact CG-NH2 3.28Å; D417-R495 VanDerWaalsContact CG-NH2 3.29Å; D417-R495 IonicContact OD1-CZ 2.57Å; D417-R495 IonicContact OD1-NH1 3.41Å; D417-R495 IonicContact OD1-NH2 3.76Å; D417-R495 PolarHBondContact OD1-NH2 3.49Å; D417-R495 IonicContact OD2-CZ 3.59Å; D417-R495 IonicContact OD2-NH1 3.01Å; D417-R495 PolarHBondContact OD2-NH1 3.49Å; D417-R495 IonicContact OD2-NH2 3.83Å; D417-R495 PolarHBondContact OD2-NH2 3.3Å; D417-R495 VanDerWaalsContact OD2-NH2 3.16Å; E491-R495 WeakPolarHBondContact O-CG 3.48Å; E491-R495 PolarHBondContact O-N 3.4Å; E491-R495 IonicContact OE1-NE 3.68Å; L492-R495 PolarHBondContact O-N 3.14Å; R493-R495 VanDerWaalsContact C-N 3.28Å; R493-R495 PolarHBondContact O-N 2.98Å; R495-N499 CarbonylContact O-C 3.45Å; R495-N499 WeakPolarHBondContact O-CA 3.45Å; R495-N499 PolarHBondContact O-N 2.95Å; R495-Y500 PolarHBondContact O-N 2.73Å; R495-L501 PolarHBondContact NH1-O 3.47Å; R495-L501 VanDerWaalsContact NH1-O 3.13Å
496	W	86.8	Confident	84.5	Confident	14 Å²	14	55.7 Å²	55.7	5%	0.053	27%	0.266	C	S	.	.	H	α-helix	trans	-61.3	-45.8	174.5	168.5	-113.9	0	0	0	112.5	L492 R493 N498 N499 L524 C527 I528 K531 D747 T748 A751 L755	L492-W496 PolarHBondContact O-N 3.14Å; R493-W496 PolarHBondContact O-N 3.41Å; W496-N498 PolarHBondContact O-N 3.49Å; W496-N499 PolarHBondContact O-N 3.35Å; W496-L524 HydrophobicContact CE3-CD1 4.36Å; W496-C527 HydrophobicContact CH2-CB 4.12Å; W496-C527 HydrophobicContact CZ3-CB 3.67Å; W496-I528 HydrophobicContact CE3-CG1 3.58Å; W496-I528 HydrophobicContact CZ3-CG1 4.02Å; W496-K531 HydrophobicContact CE3-CD 4.4Å; W496-K531 HydrophobicContact CH2-CB 4.32Å; W496-K531 HydrophobicContact CH2-CD 3.64Å; W496-K531 HydrophobicContact CZ2-CD 4Å; W496-K531 HydrophobicContact CZ3-CB 4.33Å; W496-K531 HydrophobicContact CZ3-CD 3.85Å; W496-K531 PolarHBondContact O-NZ 3.41Å; W496-D747 WeakPolarHBondContact CH2-O 3.46Å; W496-T748 HydrophobicContact CZ2-CG2 4.42Å; W496-A751 HydrophobicContact CD2-CB 3.89Å; W496-A751 HydrophobicContact CE3-CB 3.88Å; W496-A751 HydrophobicContact CH2-CB 3.5Å; W496-A751 VanDerWaalsContact CH2-CB 3.5Å; W496-A751 HydrophobicContact CZ2-CB 3.49Å; W496-A751 VanDerWaalsContact CZ2-CB 3.49Å; W496-A751 HydrophobicContact CZ3-CB 3.7Å; W496-L755 HydrophobicContact CB-CD1 4.28Å; W496-L755 HydrophobicContact CG-CD1 4.17Å
497	E	85.6	Confident	83.7	Confident	110 Å²	110	54.1 Å²	54.1	51%	0.514	27%	0.274	S	S	.	.	H	α-helix	trans	-64.1	-40.8	-179.1	-72.6	175.7	-172.8	0	0	111.6	R493 Y494	R493-E497 WeakPolarHBondContact CG-OE1 3.47Å; R493-E497 IonicContact NE-OE1 3.64Å; R493-E497 PolarHBondContact NE-OE1 3.12Å; R493-E497 VanDerWaalsContact NE-OE1 3.14Å; R493-E497 WeakPolarHBondContact O-CG 3.36Å; R493-E497 PolarHBondContact O-N 3.33Å; Y494-E497 PolarHBondContact O-N 3.29Å
498	N	84.3	Confident	83.2	Confident	75 Å²	75	52.8 Å²	52.8	40%	0.401	28%	0.278	S	S	.	.	H	α-helix	trans	-91.9	4.3	-178.8	-64.8	-62.6	0	0	0	115	Y494 W496 Y500	Y494-N498 WeakPolarHBondContact CD2-ND2 3.18Å; Y494-N498 WeakPolarHBondContact CE2-ND2 3.39Å; Y494-N498 VanDerWaalsContact CZ-ND2 3.26Å; Y494-N498 WeakPolarHBondContact O-CB 3.29Å; Y494-N498 PolarHBondContact O-N 3.2Å; Y494-N498 PolarHBondContact O-ND2 3.46Å; W496-N498 PolarHBondContact O-N 3.49Å; N498-Y500 HydrophobicContact CB-CD2 3.46Å; N498-Y500 VanDerWaalsContact CB-CD2 3.46Å; N498-Y500 HydrophobicContact CB-CE2 3.4Å; N498-Y500 VanDerWaalsContact CB-CE2 3.4Å
499	N	84.8	Confident	82.8	Confident	36 Å²	36	57.1 Å²	57.1	19%	0.193	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	42.4	-176.7	-59.3	-36.4	0	0	0	113.3	R495 W496 K531 R532 D535	R495-N499 CarbonylContact O-C 3.45Å; R495-N499 WeakPolarHBondContact O-CA 3.45Å; R495-N499 PolarHBondContact O-N 2.95Å; W496-N499 PolarHBondContact O-N 3.35Å; N499-K531 WeakPolarHBondContact OD1-CD 3.3Å; N499-K531 WeakPolarHBondContact OD1-CE 3.34Å; N499-K531 WeakPolarHBondContact OD1-CG 3.34Å; N499-K531 PolarHBondContact OD1-NZ 3.48Å; N499-R532 HydrophobicContact CB-CG 4.07Å; N499-R532 PolarHBondContact O-NE 3.42Å; N499-R532 PolarHBondContact O-NH2 3.36Å; N499-D535 PolarHBondContact ND2-OD2 2.97Å
500	Y	85.6	Confident	82.6	Confident	76 Å²	76	56.8 Å²	56.8	30%	0.298	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-94.6	134.4	171.2	-68.1	-63.1	0	0	0	111.1	E421 Y494 R495 N498 I528	E421-Y500 WeakPolarHBondContact OE1-CE1 3.48Å; E421-Y500 PolarHBondContact OE1-OH 3.44Å; E421-Y500 PolarHBondContact OE2-OH 3.1Å; Y494-Y500 HydrophobicContact CE1-CD2 4.36Å; Y494-Y500 HydrophobicContact CE1-CE2 4.29Å; R495-Y500 PolarHBondContact O-N 2.73Å; N498-Y500 HydrophobicContact CB-CD2 3.46Å; N498-Y500 VanDerWaalsContact CB-CD2 3.46Å; N498-Y500 HydrophobicContact CB-CE2 3.4Å; N498-Y500 VanDerWaalsContact CB-CE2 3.4Å; Y500-I528 WeakPolarHBondContact O-CD1 3.3Å
501	L	84.4	Confident	82.4	Confident	56 Å²	56	54.9 Å²	54.9	29%	0.293	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-71.3	145.7	174.1	-67	171	0	0	0	110.1	R495 I528 E529	R495-L501 PolarHBondContact NH1-O 3.47Å; R495-L501 VanDerWaalsContact NH1-O 3.13Å; L501-I528 HydrophobicContact CD2-CB 4.07Å; L501-I528 HydrophobicContact CD2-CG2 3.72Å; L501-I528 HydrophobicContact CG-CG2 4.41Å; L501-E529 HydrophobicContact CD2-CG 3.71Å
502	V	83.8	Confident	82.3	Confident	5 Å²	5	56.8 Å²	56.8	3%	0.03	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-75.9	123.7	174.1	-179.2	0	0	0	0	108.9	F415 L460 L492 L505 L524 N525 I528	F415-V502 HydrophobicContact CE1-CG1 4.31Å; L460-V502 HydrophobicContact CD2-CG1 3.33Å; L492-V502 HydrophobicContact CD2-CG1 4.11Å; L492-V502 HydrophobicContact CD2-CG2 3.74Å; V502-L505 HydrophobicContact CB-CD1 3.8Å; V502-L505 HydrophobicContact CG1-CD1 3.69Å; V502-L505 HydrophobicContact CG1-CG 4.38Å; V502-L524 HydrophobicContact CG2-CD2 4.42Å; V502-N525 VanDerWaalsContact CB-OD1 3.26Å; V502-N525 WeakPolarHBondContact CB-OD1 3.22Å; V502-N525 WeakPolarHBondContact CG2-OD1 3.35Å; V502-N525 PolarHBondContact N-OD1 3.29Å; V502-N525 PolarHBondContact O-ND2 3.02Å; V502-N525 VanDerWaalsContact O-ND2 3.11Å; V502-I528 HydrophobicContact CG2-CD1 4.49Å
503	Y	81.6	Confident	81.9	Confident	115 Å²	115	64.1 Å²	64.1	45%	0.451	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	144.3	-177.2	-177.8	-87.7	0	0	0	112.1	P416 D417	P416-Y503 HydrophobicContact CG-CD1 4.3Å; P416-Y503 HydrophobicContact CG-CE1 3.97Å; D417-Y503 HydrophobicContact CB-CD2 4.38Å
504	G	72.9	Confident	81.7	Confident	26 Å²	26	58.8 Å²	58.8	27%	0.268	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	25	174.6	0	0	0	0	0	115.1	S459 L460	S459-G504 VanDerWaalsContact CA-O 3.26Å; S459-G504 WeakPolarHBondContact CA-O 3.37Å; L460-G504 PolarHBondContact N-O 3.48Å
505	L	81.8	Confident	81.7	Confident	27 Å²	27	53.9 Å²	53.9	14%	0.141	30%	0.298	C	S	.	.			trans	-123.3	143.8	173.8	-59.5	173	0	0	0	109.9	L460 V502 H518 F521	L460-L505 HydrophobicContact CB-CD2 4.44Å; V502-L505 HydrophobicContact CB-CD1 3.8Å; V502-L505 HydrophobicContact CG1-CD1 3.69Å; V502-L505 HydrophobicContact CG1-CG 4.38Å; L505-H518 WeakPolarHBondContact CD2-CE1 3.49Å; L505-F521 HydrophobicContact CD1-CB 3.58Å; L505-F521 HydrophobicContact CD2-CB 4.14Å
506	T	74.7	Confident	81.7	Confident	90 Å²	90	55 Å²	55	55%	0.552	30%	0.304	S	S	*	.			trans	-72	136.7	172	51.3	0	0	0	0	110.2	Q522	T506-Q522 PolarHBondContact OG1-NE2 2.9Å; T506-Q522 VanDerWaalsContact OG1-NE2 3.15Å
507	G	69.1	Low	81.8	Confident	56 Å²	56	54.4 Å²	54.4	58%	0.577	30%	0.302	S	S	*	.	S	Bend	trans	-71.2	154.7	172.3	0	0	0	0	0	112
508	G	75.4	Confident	81.9	Confident	37 Å²	37	49.2 Å²	49.2	38%	0.381	28%	0.278	S	S	.	.	S	Bend	trans	104.9	-170.9	-177.9	0	0	0	0	0	114.2	C526	G508-C526 PolarHBondContact O-SG 3.18Å
509	S	79.5	Confident	82.1	Confident	90 Å²	90	45.7 Å²	45.7	63%	0.629	26%	0.259	S	S	*	.	S	Bend	trans	-64	150.8	-176.2	55.3	0	0	0	0	112.9	D511	S509-D511 PolarHBondContact O-N 3.3Å
510	P	84.9	Confident	82.4	Confident	10 Å²	10	44.5 Å²	44.5	7%	0.065	25%	0.252	C	S	.	.			trans	-53.9	135.1	176.8	-23.4	31.7	0	0	0	113	Q519 Q522 M523 P635 T637	P510-Q519 HydrophobicContact CB-CB 4.12Å; P510-Q519 HydrophobicContact CB-CG 4.47Å; P510-Q522 HydrophobicContact CB-CB 4.46Å; P510-M523 HydrophobicContact CG-CB 4.4Å; P510-M523 HydrophobicContact CG-CE 3.78Å; P510-P635 HydrophobicContact CG-CB 4.45Å; P510-T637 HydrophobicContact CB-CG2 4.32Å; P510-T637 HydrophobicContact CG-CG2 4.11Å
511	D	82.9	Confident	82.6	Confident	46 Å²	46	40.9 Å²	40.9	25%	0.246	24%	0.238	C	C	.	.			trans	-88	111.6	176.7	-171	-11.4	0	0	0	110.2	S509 R513 C514 Q519	S509-D511 PolarHBondContact O-N 3.3Å; D511-R513 PolarHBondContact O-N 2.99Å; D511-R513 VanDerWaalsContact O-N 3.09Å; D511-R513 WeakPolarHBondContact OD1-CB 3.39Å; D511-R513 WeakPolarHBondContact OD1-CG 3.47Å; D511-R513 IonicContact OD1-CZ 3.07Å; D511-R513 PolarHBondContact OD1-N 3.33Å; D511-R513 IonicContact OD1-NE 2.96Å; D511-R513 PolarHBondContact OD1-NE 3.22Å; D511-R513 VanDerWaalsContact OD1-NE 3.08Å; D511-R513 IonicContact OD1-NH2 3.42Å; D511-R513 IonicContact OD2-CZ 3.6Å; D511-R513 IonicContact OD2-NE 3.45Å; D511-R513 PolarHBondContact OD2-NE 3.16Å; D511-R513 IonicContact OD2-NH2 2.65Å; D511-R513 PolarHBondContact OD2-NH2 2.81Å; D511-C514 PolarHBondContact O-N 2.99Å; D511-C514 VanDerWaalsContact O-N 3.08Å; D511-Q519 WeakPolarHBondContact O-CG 3.29Å
512	L	82.9	Confident	82.8	Confident	89 Å²	89	38.4 Å²	38.4	47%	0.466	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-11.6	-178.2	-59.6	178.1	0	0	0	113.8	E638	L512-E638 HydrophobicContact CD2-CB 4.21Å
513	R	79.7	Confident	83.1	Confident	155 Å²	155	38.2 Å²	38.2	59%	0.585	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-22.8	174.8	-59.6	176.4	-63.9	165.9	6.3	112.7	D511	D511-R513 PolarHBondContact O-N 2.99Å; D511-R513 VanDerWaalsContact O-N 3.09Å; D511-R513 WeakPolarHBondContact OD1-CB 3.39Å; D511-R513 WeakPolarHBondContact OD1-CG 3.47Å; D511-R513 IonicContact OD1-CZ 3.07Å; D511-R513 PolarHBondContact OD1-N 3.33Å; D511-R513 IonicContact OD1-NE 2.96Å; D511-R513 PolarHBondContact OD1-NE 3.22Å; D511-R513 VanDerWaalsContact OD1-NE 3.08Å; D511-R513 IonicContact OD1-NH2 3.42Å; D511-R513 IonicContact OD2-CZ 3.6Å; D511-R513 IonicContact OD2-NE 3.45Å; D511-R513 PolarHBondContact OD2-NE 3.16Å; D511-R513 IonicContact OD2-NH2 2.65Å; D511-R513 PolarHBondContact OD2-NH2 2.81Å
514	C	84	Confident	83.4	Confident	10 Å²	10	32.7 Å²	32.7	7%	0.068	20%	0.202	C	C	.	.	S	Bend	trans	-84.1	165.4	-177.6	-64.4	0	0	0	0	111.7	S454 D511 H518 Q519	S454-C514 WeakPolarHBondContact O-CA 3.47Å; D511-C514 PolarHBondContact O-N 2.99Å; D511-C514 VanDerWaalsContact O-N 3.08Å; C514-H518 HydrophobicContact CB-CB 4.11Å; C514-Q519 PolarHBondContact O-NE2 2.91Å
515	C	85.4	Confident	84.2	Confident	4 Å²	4	31.8 Å²	31.8	3%	0.027	19%	0.191	C	C	.	.			trans	-61.4	152.2	174.8	65	0	0	0	0	112.5	K453 L517 H518 Q519	K453-C515 WeakPolarHBondContact O-CB 3.41Å; C515-L517 VanDerWaalsContact C-N 3.27Å; C515-L517 PolarHBondContact O-N 2.91Å; C515-H518 WeakPolarHBondContact O-CB 3.44Å; C515-H518 PolarHBondContact O-N 3.29Å; C515-H518 VanDerWaalsContact SG-CB 3.58Å; C515-Q519 PolarHBondContact O-N 3.08Å; C515-Q519 VanDerWaalsContact O-N 3.09Å
516	L	85.9	Confident	84.4	Confident	29 Å²	29	30.9 Å²	30.9	15%	0.152	19%	0.187	C	C	.	.	H	α-helix	trans	-54.7	-42.5	-176.1	-178.5	63.7	0	0	0	112.4	H518 Q519 K520 E638 D639	L516-H518 VanDerWaalsContact C-N 3.3Å; L516-H518 PolarHBondContact O-N 3.49Å; L516-Q519 WeakPolarHBondContact O-CB 3.3Å; L516-Q519 PolarHBondContact O-N 2.93Å; L516-Q519 VanDerWaalsContact O-N 3.13Å; L516-K520 WeakPolarHBondContact O-CG 3.47Å; L516-K520 PolarHBondContact O-N 3.43Å; L516-E638 HydrophobicContact CD1-CB 4.45Å; L516-D639 HydrophobicContact CD1-CB 3.98Å; L516-D639 HydrophobicContact CD2-CB 4.4Å
517	L	88.4	Confident	85	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.3	-38.3	179.2	-175.1	62.2	0	0	0	112.1	T461 W485 C515 K520 F521 L758 M761 L766 H769 L770	T461-L517 HydrophobicContact CG2-CB 4.49Å; T461-L517 HydrophobicContact CG2-CD2 4.32Å; T461-L517 HydrophobicContact CG2-CG 4.43Å; W485-L517 HydrophobicContact CH2-CD1 4.29Å; C515-L517 VanDerWaalsContact C-N 3.27Å; C515-L517 PolarHBondContact O-N 2.91Å; L517-K520 PolarHBondContact O-N 3.49Å; L517-F521 HydrophobicContact CD1-CE1 3.86Å; L517-F521 HydrophobicContact CD1-CE2 4.24Å; L517-F521 HydrophobicContact CD1-CZ 3.63Å; L517-F521 HydrophobicContact CD2-CE2 4.28Å; L517-F521 HydrophobicContact CD2-CZ 4.14Å; L517-F521 HydrophobicContact CG-CE1 4.35Å; L517-F521 HydrophobicContact CG-CE2 3.81Å; L517-F521 HydrophobicContact CG-CZ 3.7Å; L517-F521 WeakPolarHBondContact O-CG 3.49Å; L517-F521 PolarHBondContact O-N 3.43Å; L517-F521 VanDerWaalsContact O-N 3.11Å; L517-L758 HydrophobicContact CD1-CD2 3.56Å; L517-M761 HydrophobicContact CD1-CE 4.25Å; L517-L766 HydrophobicContact CD2-CD1 3.87Å; L517-H769 HydrophobicContact CB-CB 4.19Å; L517-H769 HydrophobicContact CD2-CB 4.48Å; L517-L770 HydrophobicContact CD2-CD2 3.63Å; L517-L770 HydrophobicContact CD2-CG 4.01Å
518	H	88.6	Confident	85.8	Confident	2 Å²	2	24 Å²	24	1%	0.009	13%	0.133	C	C	.	.	H	α-helix	trans	-64.6	-42.4	173.9	-170	75.4	0	0	0	111.7	A455 T461 L505 C514 C515 L516 K520 F521 Q522	A455-H518 HydrophobicContact CB-CB 4.13Å; T461-H518 HydrophobicContact CG2-CB 4.28Å; T461-H518 PolarHBondContact OG1-ND1 3.01Å; L505-H518 WeakPolarHBondContact CD2-CE1 3.49Å; C514-H518 HydrophobicContact CB-CB 4.11Å; C515-H518 WeakPolarHBondContact O-CB 3.44Å; C515-H518 PolarHBondContact O-N 3.29Å; C515-H518 VanDerWaalsContact SG-CB 3.58Å; L516-H518 VanDerWaalsContact C-N 3.3Å; L516-H518 PolarHBondContact O-N 3.49Å; H518-K520 VanDerWaalsContact C-N 3.31Å; H518-K520 PolarHBondContact O-N 2.95Å; H518-F521 PolarHBondContact O-N 2.95Å; H518-Q522 PolarHBondContact NE2-NE2 3.16Å; H518-Q522 WeakPolarHBondContact O-CG 3.45Å; H518-Q522 PolarHBondContact O-N 3.02Å
519	Q	88.7	Confident	86.4	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61.6	-38.1	176	-62.3	175.7	27.7	0	0	112	P510 D511 C514 C515 L516 Q522 M523 T637 E638	P510-Q519 HydrophobicContact CB-CB 4.12Å; P510-Q519 HydrophobicContact CB-CG 4.47Å; D511-Q519 WeakPolarHBondContact O-CG 3.29Å; C514-Q519 PolarHBondContact O-NE2 2.91Å; C515-Q519 PolarHBondContact O-N 3.08Å; C515-Q519 VanDerWaalsContact O-N 3.09Å; L516-Q519 WeakPolarHBondContact O-CB 3.3Å; L516-Q519 PolarHBondContact O-N 2.93Å; L516-Q519 VanDerWaalsContact O-N 3.13Å; Q519-Q522 PolarHBondContact O-N 3.4Å; Q519-M523 WeakPolarHBondContact O-CB 3.3Å; Q519-M523 PolarHBondContact O-N 3.4Å; Q519-T637 HydrophobicContact CB-CG2 4.02Å; Q519-E638 PolarHBondContact NE2-OE2 3.41Å
520	K	89.2	Confident	86.5	Confident	11 Å²	11	24.4 Å²	24.4	5%	0.048	11%	0.113	C	C	.	.	H	α-helix	trans	-64.5	-41.3	175	-67.5	-66.2	-179.5	-167.2	0	112	L516 L517 H518 M523 L524 T637 D639 V754 Y757	L516-K520 WeakPolarHBondContact O-CG 3.47Å; L516-K520 PolarHBondContact O-N 3.43Å; L517-K520 PolarHBondContact O-N 3.49Å; H518-K520 VanDerWaalsContact C-N 3.31Å; H518-K520 PolarHBondContact O-N 2.95Å; K520-M523 WeakPolarHBondContact O-CB 3.34Å; K520-M523 PolarHBondContact O-N 3.25Å; K520-L524 PolarHBondContact O-N 2.77Å; K520-T637 HydrophobicContact CD-CG2 4.29Å; K520-T637 PolarHBondContact NZ-OG1 3.11Å; K520-T637 VanDerWaalsContact NZ-OG1 3.09Å; K520-D639 WeakPolarHBondContact CE-OD1 3.35Å; K520-D639 VanDerWaalsContact CE-OD2 3.27Å; K520-D639 WeakPolarHBondContact CE-OD2 3.22Å; K520-D639 IonicContact NZ-OD1 2.72Å; K520-D639 PolarHBondContact NZ-OD1 3.21Å; K520-D639 IonicContact NZ-OD2 2.84Å; K520-D639 PolarHBondContact NZ-OD2 2.93Å; K520-V754 HydrophobicContact CB-CG1 4.2Å; K520-V754 HydrophobicContact CD-CG2 4.27Å; K520-Y757 HydrophobicContact CD-CD1 4.39Å; K520-Y757 HydrophobicContact CD-CE1 4.48Å; K520-Y757 HydrophobicContact CG-CD1 4.3Å; K520-Y757 HydrophobicContact CG-CE1 4.06Å
521	F	90.3	Very high	86.5	Confident	1 Å²	1	25.4 Å²	25.4	0%	0.004	12%	0.116	C	C	.	.	H	α-helix	trans	-66.8	-38.8	174.4	-59.9	-29	0	0	0	112.4	T461 L464 W485 F488 L492 L505 L517 H518 M523 L524 N525 L758	T461-F521 HydrophobicContact CG2-CE2 4.5Å; T461-F521 WeakPolarHBondContact OG1-CD2 3.34Å; L464-F521 HydrophobicContact CD2-CE2 4.39Å; L464-F521 HydrophobicContact CD2-CZ 4.35Å; W485-F521 HydrophobicContact CH2-CZ 4.43Å; F488-F521 AromaticContact CE1-CE1 3.96Å; F488-F521 HydrophobicContact CE1-CE1 3.96Å; F488-F521 HydrophobicContact CE1-CE2 4.42Å; F488-F521 AromaticContact CE1-CZ 3.61Å; F488-F521 HydrophobicContact CE1-CZ 3.61Å; F488-F521 HydrophobicContact CZ-CE1 4.45Å; F488-F521 HydrophobicContact CZ-CE2 4.29Å; F488-F521 AromaticContact CZ-CZ 3.91Å; F488-F521 HydrophobicContact CZ-CZ 3.91Å; L492-F521 HydrophobicContact CD1-CD1 4.18Å; L492-F521 HydrophobicContact CD1-CE1 3.81Å; L505-F521 HydrophobicContact CD1-CB 3.58Å; L505-F521 HydrophobicContact CD2-CB 4.14Å; L517-F521 HydrophobicContact CD1-CE1 3.86Å; L517-F521 HydrophobicContact CD1-CE2 4.24Å; L517-F521 HydrophobicContact CD1-CZ 3.63Å; L517-F521 HydrophobicContact CD2-CE2 4.28Å; L517-F521 HydrophobicContact CD2-CZ 4.14Å; L517-F521 HydrophobicContact CG-CE1 4.35Å; L517-F521 HydrophobicContact CG-CE2 3.81Å; L517-F521 HydrophobicContact CG-CZ 3.7Å; L517-F521 WeakPolarHBondContact O-CG 3.49Å; L517-F521 PolarHBondContact O-N 3.43Å; L517-F521 VanDerWaalsContact O-N 3.11Å; H518-F521 PolarHBondContact O-N 2.95Å; F521-M523 VanDerWaalsContact C-N 3.34Å; F521-L524 PolarHBondContact O-N 2.94Å; F521-N525 PolarHBondContact O-N 2.97Å; F521-N525 VanDerWaalsContact O-N 3.07Å; F521-L758 HydrophobicContact CD1-CD1 4.29Å; F521-L758 HydrophobicContact CE1-CD1 3.89Å; F521-L758 HydrophobicContact CE1-CD2 3.95Å
522	Q	89.1	Confident	86.6	Confident	3 Å²	3	27.3 Å²	27.3	1%	0.014	12%	0.119	C	C	.	.	H	α-helix	trans	-60.8	-43.9	172.6	-73	175.5	-34.2	0	0	111.2	T506 P510 H518 Q519 L524 N525 C526	T506-Q522 PolarHBondContact OG1-NE2 2.9Å; T506-Q522 VanDerWaalsContact OG1-NE2 3.15Å; P510-Q522 HydrophobicContact CB-CB 4.46Å; H518-Q522 PolarHBondContact NE2-NE2 3.16Å; H518-Q522 WeakPolarHBondContact O-CG 3.45Å; H518-Q522 PolarHBondContact O-N 3.02Å; Q519-Q522 PolarHBondContact O-N 3.4Å; Q522-L524 VanDerWaalsContact C-N 3.31Å; Q522-L524 PolarHBondContact O-N 3.29Å; Q522-N525 WeakPolarHBondContact O-CB 3.31Å; Q522-N525 PolarHBondContact O-N 3.39Å; Q522-N525 VanDerWaalsContact O-N 3.12Å; Q522-C526 PolarHBondContact O-N 2.99Å; Q522-C526 PolarHBondContact O-SG 2.95Å
523	M	89.1	Confident	86.6	Confident	1 Å²	1	25.8 Å²	25.8	1%	0.005	12%	0.12	C	C	.	.	H	α-helix	trans	-57.7	-42.3	175.1	-176.1	59.5	74.4	0	0	112	P510 Q519 K520 F521 N525 C526 C527 P635 T637 F745 V754	P510-M523 HydrophobicContact CG-CB 4.4Å; P510-M523 HydrophobicContact CG-CE 3.78Å; Q519-M523 WeakPolarHBondContact O-CB 3.3Å; Q519-M523 PolarHBondContact O-N 3.4Å; K520-M523 WeakPolarHBondContact O-CB 3.34Å; K520-M523 PolarHBondContact O-N 3.25Å; F521-M523 VanDerWaalsContact C-N 3.34Å; M523-N525 PolarHBondContact O-N 3.47Å; M523-C526 WeakPolarHBondContact O-CB 3.45Å; M523-C526 PolarHBondContact O-N 3.12Å; M523-C527 PolarHBondContact O-N 3.16Å; M523-C527 PolarHBondContact O-SG 2.97Å; M523-P635 HydrophobicContact CE-CB 4.13Å; M523-P635 HydrophobicContact CE-CG 4.19Å; M523-P635 VanDerWaalsContact CE-O 3.3Å; M523-P635 WeakPolarHBondContact CE-O 3.36Å; M523-P635 HydrophobicContact SD-CG 4.04Å; M523-T637 HydrophobicContact CB-CG2 4.07Å; M523-T637 HydrophobicContact CE-CG2 3.86Å; M523-F745 HydrophobicContact SD-CE2 3.89Å; M523-F745 HydrophobicContact SD-CZ 3.99Å; M523-V754 HydrophobicContact CB-CG2 4.34Å; M523-V754 HydrophobicContact CG-CG2 4.01Å
524	L	88.4	Confident	86.7	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-62.1	-42.8	175.9	-173.8	62.5	0	0	0	111.5	L492 W496 V502 K520 F521 Q522 C527 I528 A751 V754 L755	L492-L524 HydrophobicContact CB-CD2 4.34Å; L492-L524 HydrophobicContact CD2-CD2 4.43Å; W496-L524 HydrophobicContact CE3-CD1 4.36Å; V502-L524 HydrophobicContact CG2-CD2 4.42Å; K520-L524 PolarHBondContact O-N 2.77Å; F521-L524 PolarHBondContact O-N 2.94Å; Q522-L524 VanDerWaalsContact C-N 3.31Å; Q522-L524 PolarHBondContact O-N 3.29Å; L524-C527 WeakPolarHBondContact O-CB 3.39Å; L524-C527 PolarHBondContact O-N 3.47Å; L524-I528 HydrophobicContact CG-CD1 4.14Å; L524-I528 WeakPolarHBondContact O-CD1 3.1Å; L524-I528 VanDerWaalsContact O-CG1 3.31Å; L524-I528 WeakPolarHBondContact O-CG1 3.44Å; L524-I528 PolarHBondContact O-N 2.73Å; L524-A751 HydrophobicContact CD1-CB 4.09Å; L524-V754 HydrophobicContact CB-CG1 4.39Å; L524-L755 HydrophobicContact CD1-CG 4.43Å; L524-L755 HydrophobicContact CD2-CD2 4.25Å
525	N	89.6	Confident	86.5	Confident	7 Å²	7	21.9 Å²	21.9	4%	0.037	11%	0.106	C	C	.	.	H	α-helix	trans	-62	-42	173.3	-93	4.3	0	0	0	112.6	V502 F521 Q522 M523 C527 I528 E529	V502-N525 VanDerWaalsContact CB-OD1 3.26Å; V502-N525 WeakPolarHBondContact CB-OD1 3.22Å; V502-N525 WeakPolarHBondContact CG2-OD1 3.35Å; V502-N525 PolarHBondContact N-OD1 3.29Å; V502-N525 PolarHBondContact O-ND2 3.02Å; V502-N525 VanDerWaalsContact O-ND2 3.11Å; F521-N525 PolarHBondContact O-N 2.97Å; F521-N525 VanDerWaalsContact O-N 3.07Å; Q522-N525 WeakPolarHBondContact O-CB 3.31Å; Q522-N525 PolarHBondContact O-N 3.39Å; Q522-N525 VanDerWaalsContact O-N 3.12Å; M523-N525 PolarHBondContact O-N 3.47Å; N525-C527 VanDerWaalsContact C-N 3.26Å; N525-C527 PolarHBondContact O-N 3.06Å; N525-I528 PolarHBondContact O-N 2.74Å; N525-I528 VanDerWaalsContact O-N 3.14Å; N525-E529 WeakPolarHBondContact O-CG 3.48Å; N525-E529 PolarHBondContact O-N 3.46Å
526	C	86.7	Confident	86.3	Confident	8 Å²	8	27.7 Å²	27.7	5%	0.054	13%	0.133	C	C	.	.	H	α-helix	trans	-57.2	-41.8	173.5	-58.1	0	0	0	0	111.7	G508 Q522 M523 R530	G508-C526 PolarHBondContact O-SG 3.18Å; Q522-C526 PolarHBondContact O-N 2.99Å; Q522-C526 PolarHBondContact O-SG 2.95Å; M523-C526 WeakPolarHBondContact O-CB 3.45Å; M523-C526 PolarHBondContact O-N 3.12Å; C526-R530 WeakPolarHBondContact O-CB 3.44Å; C526-R530 WeakPolarHBondContact O-CG 3.32Å; C526-R530 PolarHBondContact O-N 3.42Å
527	C	87.2	Confident	85.9	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-63.6	-43.5	177.4	-62.6	0	0	0	0	111.1	W496 M523 L524 N525 R530 K531 A751	W496-C527 HydrophobicContact CH2-CB 4.12Å; W496-C527 HydrophobicContact CZ3-CB 3.67Å; M523-C527 PolarHBondContact O-N 3.16Å; M523-C527 PolarHBondContact O-SG 2.97Å; L524-C527 WeakPolarHBondContact O-CB 3.39Å; L524-C527 PolarHBondContact O-N 3.47Å; N525-C527 VanDerWaalsContact C-N 3.26Å; N525-C527 PolarHBondContact O-N 3.06Å; C527-R530 PolarHBondContact O-N 3.29Å; C527-K531 WeakPolarHBondContact O-CB 3.42Å; C527-K531 PolarHBondContact O-N 2.55Å; C527-A751 HydrophobicContact CB-CB 3.89Å
528	I	86.1	Confident	85.4	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-64.5	-43.6	179.2	-65.3	158	0	0	0	110.9	W496 Y500 L501 V502 L524 N525 R530 K531 R532	W496-I528 HydrophobicContact CE3-CG1 3.58Å; W496-I528 HydrophobicContact CZ3-CG1 4.02Å; Y500-I528 WeakPolarHBondContact O-CD1 3.3Å; L501-I528 HydrophobicContact CD2-CB 4.07Å; L501-I528 HydrophobicContact CD2-CG2 3.72Å; L501-I528 HydrophobicContact CG-CG2 4.41Å; V502-I528 HydrophobicContact CG2-CD1 4.49Å; L524-I528 HydrophobicContact CG-CD1 4.14Å; L524-I528 WeakPolarHBondContact O-CD1 3.1Å; L524-I528 VanDerWaalsContact O-CG1 3.31Å; L524-I528 WeakPolarHBondContact O-CG1 3.44Å; L524-I528 PolarHBondContact O-N 2.73Å; N525-I528 PolarHBondContact O-N 2.74Å; N525-I528 VanDerWaalsContact O-N 3.14Å; I528-R530 PolarHBondContact O-N 3.09Å; I528-K531 PolarHBondContact O-N 3.14Å; I528-R532 HydrophobicContact CG2-CG 4.47Å; I528-R532 WeakPolarHBondContact O-CB 3.47Å; I528-R532 WeakPolarHBondContact O-CG 3.46Å; I528-R532 PolarHBondContact O-N 2.92Å
529	E	86.7	Confident	84.8	Confident	75 Å²	75	42.2 Å²	42.2	35%	0.35	20%	0.203	S	C	.	.	H	α-helix	trans	-60.2	-45	176.4	-72.2	177.3	172.2	0	0	111.5	L501 N525 R532 A533	L501-E529 HydrophobicContact CD2-CG 3.71Å; N525-E529 WeakPolarHBondContact O-CG 3.48Å; N525-E529 PolarHBondContact O-N 3.46Å; E529-R532 PolarHBondContact O-N 3.38Å; E529-A533 WeakPolarHBondContact O-CB 3.34Å; E529-A533 PolarHBondContact O-N 3.39Å
530	R	83.3	Confident	84.1	Confident	62 Å²	62	47.1 Å²	47.1	23%	0.234	23%	0.233	C	C	.	.	H	α-helix	trans	-68	-38.5	178.1	-74	-179.3	171.3	171.9	-4.9	112.5	C526 C527 I528 A533 R534 E632 P633 F745 D747	C526-R530 WeakPolarHBondContact O-CB 3.44Å; C526-R530 WeakPolarHBondContact O-CG 3.32Å; C526-R530 PolarHBondContact O-N 3.42Å; C527-R530 PolarHBondContact O-N 3.29Å; I528-R530 PolarHBondContact O-N 3.09Å; R530-A533 PolarHBondContact O-N 3.25Å; R530-R534 WeakPolarHBondContact O-CB 3.39Å; R530-R534 PolarHBondContact O-N 3.47Å; R530-E632 IonicContact NH2-OE2 3.05Å; R530-E632 PolarHBondContact NH2-OE2 3.37Å; R530-E632 VanDerWaalsContact NH2-OE2 3.12Å; R530-P633 PolarHBondContact NH2-O 3.29Å; R530-F745 VanDerWaalsContact CD-CD1 3.49Å; R530-F745 VanDerWaalsContact NH1-CB 3.34Å; R530-F745 VanDerWaalsContact NH1-CE1 3.35Å; R530-D747 HydrophobicContact CB-CB 4.21Å
531	K	84.5	Confident	83	Confident	30 Å²	30	51.7 Å²	51.7	13%	0.13	25%	0.254	C	S	.	.	H	α-helix	trans	-63	-44.8	172.9	-179.9	173.3	174	-156.2	0	111.5	W496 N499 C527 I528 R534 D535	W496-K531 HydrophobicContact CE3-CD 4.4Å; W496-K531 HydrophobicContact CH2-CB 4.32Å; W496-K531 HydrophobicContact CH2-CD 3.64Å; W496-K531 HydrophobicContact CZ2-CD 4Å; W496-K531 HydrophobicContact CZ3-CB 4.33Å; W496-K531 HydrophobicContact CZ3-CD 3.85Å; W496-K531 PolarHBondContact O-NZ 3.41Å; N499-K531 WeakPolarHBondContact OD1-CD 3.3Å; N499-K531 WeakPolarHBondContact OD1-CE 3.34Å; N499-K531 WeakPolarHBondContact OD1-CG 3.34Å; N499-K531 PolarHBondContact OD1-NZ 3.48Å; C527-K531 WeakPolarHBondContact O-CB 3.42Å; C527-K531 PolarHBondContact O-N 2.55Å; I528-K531 PolarHBondContact O-N 3.14Å; K531-R534 PolarHBondContact O-N 2.82Å; K531-D535 PolarHBondContact O-N 3.48Å
532	R	85.8	Confident	81.9	Confident	86 Å²	86	57.7 Å²	57.7	33%	0.325	28%	0.282	S	S	.	.	H	α-helix	trans	-59.1	-51	174.3	-78.2	178	172.9	-165.7	-1.5	111.8	N499 I528 E529 R534 D535 E536	N499-R532 HydrophobicContact CB-CG 4.07Å; N499-R532 PolarHBondContact O-NE 3.42Å; N499-R532 PolarHBondContact O-NH2 3.36Å; I528-R532 HydrophobicContact CG2-CG 4.47Å; I528-R532 WeakPolarHBondContact O-CB 3.47Å; I528-R532 WeakPolarHBondContact O-CG 3.46Å; I528-R532 PolarHBondContact O-N 2.92Å; E529-R532 PolarHBondContact O-N 3.38Å; R532-R534 VanDerWaalsContact C-N 3.26Å; R532-R534 PolarHBondContact O-N 2.86Å; R532-D535 PolarHBondContact O-N 2.9Å; R532-E536 WeakPolarHBondContact O-CB 3.48Å; R532-E536 WeakPolarHBondContact O-CG 3.47Å; R532-E536 PolarHBondContact O-N 3.33Å
533	A	82.8	Confident	81	Confident	57 Å²	57	58.9 Å²	58.9	47%	0.471	30%	0.295	S	S	.	.	H	α-helix	trans	-59.3	-38.1	178.9	0	0	0	0	0	112.1	E529 R530 A537	E529-A533 WeakPolarHBondContact O-CB 3.34Å; E529-A533 PolarHBondContact O-N 3.39Å; R530-A533 PolarHBondContact O-N 3.25Å; A533-A537 WeakPolarHBondContact O-CB 3.27Å; A533-A537 PolarHBondContact O-N 3.47Å
534	R	80	Confident	79.6	Confident	45 Å²	45	63 Å²	63	17%	0.17	32%	0.317	C	S	.	.	H	α-helix	trans	-66.1	-45.9	174.8	175.1	173.4	56.5	78.8	-13	112.4	R530 K531 R532 E536 A537 R538 D747	R530-R534 WeakPolarHBondContact O-CB 3.39Å; R530-R534 PolarHBondContact O-N 3.47Å; K531-R534 PolarHBondContact O-N 2.82Å; R532-R534 VanDerWaalsContact C-N 3.26Å; R532-R534 PolarHBondContact O-N 2.86Å; R534-E536 VanDerWaalsContact C-N 3.31Å; R534-A537 PolarHBondContact O-N 3.1Å; R534-R538 WeakPolarHBondContact O-CG 3.04Å; R534-R538 PolarHBondContact O-N 3.4Å; R534-D747 IonicContact CZ-OD2 3.15Å; R534-D747 IonicContact NE-OD2 2.88Å; R534-D747 PolarHBondContact NE-OD2 3.23Å; R534-D747 IonicContact NH2-OD2 3.63Å; R534-D747 PolarHBondContact NH2-OD2 3.4Å
535	D	81	Confident	78.2	Confident	38 Å²	38	70.2 Å²	70.2	20%	0.203	35%	0.345	C	S	.	.	H	α-helix	trans	-66.7	-35.8	179.5	-70.7	-12.6	0	0	0	111.1	N499 K531 R532 K539	N499-D535 PolarHBondContact ND2-OD2 2.97Å; K531-D535 PolarHBondContact O-N 3.48Å; R532-D535 PolarHBondContact O-N 2.9Å; D535-K539 WeakPolarHBondContact O-CB 3.39Å; D535-K539 VanDerWaalsContact O-CG 3.25Å; D535-K539 WeakPolarHBondContact O-CG 3.26Å; D535-K539 PolarHBondContact O-N 3.25Å
536	E	81.9	Confident	76.6	Confident	127 Å²	127	75.7 Å²	75.7	59%	0.593	37%	0.37	S	S	*	.	H	α-helix	trans	-64.2	-46.7	170.6	-73.1	-176	174.7	0	0	112	R532 R534 R538 K539 V540	R532-E536 WeakPolarHBondContact O-CB 3.48Å; R532-E536 WeakPolarHBondContact O-CG 3.47Å; R532-E536 PolarHBondContact O-N 3.33Å; R534-E536 VanDerWaalsContact C-N 3.31Å; E536-R538 VanDerWaalsContact C-N 3.31Å; E536-R538 PolarHBondContact O-N 2.7Å; E536-K539 PolarHBondContact O-N 3.42Å; E536-V540 VanDerWaalsContact O-CG2 3.32Å; E536-V540 WeakPolarHBondContact O-CG2 3.39Å; E536-V540 PolarHBondContact O-N 3.41Å
537	A	77.4	Confident	75.1	Confident	59 Å²	59	83.9 Å²	83.9	49%	0.488	40%	0.4	S	S	.	.	H	α-helix	trans	-60.6	-39.8	176.9	0	0	0	0	0	112.2	A533 R534 V540 Q541	A533-A537 WeakPolarHBondContact O-CB 3.27Å; A533-A537 PolarHBondContact O-N 3.47Å; R534-A537 PolarHBondContact O-N 3.1Å; A537-V540 PolarHBondContact O-N 2.83Å; A537-Q541 WeakPolarHBondContact O-CB 3.47Å; A537-Q541 PolarHBondContact O-N 3.01Å
538	R	76.8	Confident	73.4	Confident	128 Å²	128	90 Å²	90	48%	0.483	43%	0.428	S	S	.	.	H	α-helix	trans	-63.1	-47.3	173.7	-75.2	177.5	175.2	-171.9	-4.3	111.6	R534 E536 V540 Q541 E542	R534-R538 WeakPolarHBondContact O-CG 3.04Å; R534-R538 PolarHBondContact O-N 3.4Å; E536-R538 VanDerWaalsContact C-N 3.31Å; E536-R538 PolarHBondContact O-N 2.7Å; R538-V540 VanDerWaalsContact C-N 3.33Å; R538-V540 PolarHBondContact O-N 3.49Å; R538-Q541 PolarHBondContact O-N 3.2Å; R538-Q541 VanDerWaalsContact O-N 3.15Å; R538-E542 PolarHBondContact O-N 2.94Å
539	K	77	Confident	71.8	Confident	148 Å²	148	99.7 Å²	99.7	64%	0.643	47%	0.465	S	S	*	.	H	α-helix	trans	-60.2	-40	176.8	-75.2	170.9	-176.7	174	0	112.4	D535 E536 G543	D535-K539 WeakPolarHBondContact O-CB 3.39Å; D535-K539 VanDerWaalsContact O-CG 3.25Å; D535-K539 WeakPolarHBondContact O-CG 3.26Å; D535-K539 PolarHBondContact O-N 3.25Å; E536-K539 PolarHBondContact O-N 3.42Å; K539-G543 PolarHBondContact O-N 3.15Å
540	V	73.4	Confident	70.3	Confident	104 Å²	104	103.9 Å²	103.9	63%	0.63	48%	0.482	S	S	*	.	H	α-helix	trans	-65.5	-41.4	175.7	172.3	0	0	0	0	110.9	E536 A537 R538 G543 N544	E536-V540 VanDerWaalsContact O-CG2 3.32Å; E536-V540 WeakPolarHBondContact O-CG2 3.39Å; E536-V540 PolarHBondContact O-N 3.41Å; A537-V540 PolarHBondContact O-N 2.83Å; R538-V540 VanDerWaalsContact C-N 3.33Å; R538-V540 PolarHBondContact O-N 3.49Å; V540-G543 PolarHBondContact O-N 3.34Å; V540-N544 WeakPolarHBondContact O-CB 3.21Å; V540-N544 PolarHBondContact O-N 2.98Å
541	Q	65.1	Low	68.8	Low	107 Å²	107	107.3 Å²	107.3	50%	0.5	51%	0.509	S	S	.	.	H	α-helix	trans	-69.8	-39.7	-179.8	-163.3	171.7	22.8	0	0	112.8	A537 R538 N544 R545	A537-Q541 WeakPolarHBondContact O-CB 3.47Å; A537-Q541 PolarHBondContact O-N 3.01Å; R538-Q541 PolarHBondContact O-N 3.2Å; R538-Q541 VanDerWaalsContact O-N 3.15Å; Q541-N544 PolarHBondContact O-N 2.95Å; Q541-R545 WeakPolarHBondContact O-CG 3.46Å; Q541-R545 PolarHBondContact O-N 2.88Å
542	E	68.9	Low	67	Low	126 Å²	126	110.7 Å²	110.7	59%	0.589	54%	0.537	S	S	*	.	H	α-helix	trans	-67.3	-42.7	172.6	-74.2	178.6	171.9	0	0	111.7	R538 N544 R545 E546	R538-E542 PolarHBondContact O-N 2.94Å; E542-N544 VanDerWaalsContact C-N 3.28Å; E542-N544 PolarHBondContact O-N 3.02Å; E542-R545 PolarHBondContact O-N 3.32Å; E542-E546 PolarHBondContact O-N 3.21Å
543	G	68.4	Low	64.8	Low	28 Å²	28	109.4 Å²	109.4	29%	0.289	55%	0.55	S	S	.	*	H	α-helix	trans	-61.2	-34.6	174.2	0	0	0	0	0	113.1	K539 V540 R547	K539-G543 PolarHBondContact O-N 3.15Å; V540-G543 PolarHBondContact O-N 3.34Å; G543-R547 WeakPolarHBondContact O-CG 3.48Å; G543-R547 PolarHBondContact O-N 3.15Å
544	N	60.4	Low	62.4	Low	89 Å²	89	110.2 Å²	110.2	48%	0.476	56%	0.564	S	S	.	*	H	α-helix	trans	-73.1	-40.1	174.4	-124.6	21.9	0	0	0	112.2	V540 Q541 E542 E546 R547 E548	V540-N544 WeakPolarHBondContact O-CB 3.21Å; V540-N544 PolarHBondContact O-N 2.98Å; Q541-N544 PolarHBondContact O-N 2.95Å; E542-N544 VanDerWaalsContact C-N 3.28Å; E542-N544 PolarHBondContact O-N 3.02Å; N544-E546 VanDerWaalsContact C-N 3.33Å; N544-E546 PolarHBondContact O-N 2.92Å; N544-R547 PolarHBondContact O-N 2.85Å; N544-E548 WeakPolarHBondContact O-CG 3.4Å; N544-E548 PolarHBondContact O-N 3.14Å
545	R	58.8	Low	60.2	Low	151 Å²	151	119.8 Å²	119.8	57%	0.57	60%	0.601	S	S	*	*	H	α-helix	trans	-63.6	-36.4	173.6	-76.9	175.7	172.1	174.2	-1.6	112.4	Q541 E542 R549	Q541-R545 WeakPolarHBondContact O-CG 3.46Å; Q541-R545 PolarHBondContact O-N 2.88Å; E542-R545 PolarHBondContact O-N 3.32Å; R545-R549 WeakPolarHBondContact O-CB 3.16Å; R545-R549 PolarHBondContact O-N 2.82Å
546	E	56.5	Low	57.7	Low	121 Å²	121	122.8 Å²	122.8	57%	0.565	63%	0.631	S	S	*	*	H	α-helix	trans	-69.1	-37.2	172.6	-81	-164.5	155.8	0	0	112.7	E542 N544 R549 K550	E542-E546 PolarHBondContact O-N 3.21Å; N544-E546 VanDerWaalsContact C-N 3.33Å; N544-E546 PolarHBondContact O-N 2.92Å; E546-R549 PolarHBondContact O-N 3.4Å; E546-K550 WeakPolarHBondContact O-CB 3.45Å; E546-K550 WeakPolarHBondContact O-CG 3.04Å; E546-K550 PolarHBondContact O-N 3.4Å
547	R	56.2	Low	55.2	Low	181 Å²	181	122.7 Å²	122.7	68%	0.683	64%	0.644	S	S	*	*	H	α-helix	trans	-66.4	-41.2	173.4	-77.2	174.6	178.6	-177.2	0.3	111.7	G543 N544 K550 V551	G543-R547 WeakPolarHBondContact O-CG 3.48Å; G543-R547 PolarHBondContact O-N 3.15Å; N544-R547 PolarHBondContact O-N 2.85Å; R547-K550 PolarHBondContact O-N 2.95Å; R547-V551 WeakPolarHBondContact O-CG2 3.48Å; R547-V551 PolarHBondContact O-N 3.49Å; R547-V551 VanDerWaalsContact O-N 3.08Å
548	E	51.6	Low	53.1	Low	128 Å²	128	124.4 Å²	124.4	60%	0.598	66%	0.658	S	S	*	*	H	α-helix	trans	-66.1	-36.4	174.6	-74.8	178.2	167.2	0	0	112.6	N544 V551 S552	N544-E548 WeakPolarHBondContact O-CG 3.4Å; N544-E548 PolarHBondContact O-N 3.14Å; E548-V551 PolarHBondContact O-N 2.94Å; E548-S552 PolarHBondContact O-N 2.91Å; E548-S552 PolarHBondContact O-OG 3.18Å
549	R	51.4	Low	50.7	Low	203 Å²	203	124 Å²	124	77%	0.766	67%	0.674	S	S	*	*	H	α-helix	trans	-67.8	-33.3	171.1	-85.8	179.2	170.5	166.2	-2.5	113.2	R545 E546 S552 G553	R545-R549 WeakPolarHBondContact O-CB 3.16Å; R545-R549 PolarHBondContact O-N 2.82Å; E546-R549 PolarHBondContact O-N 3.4Å; R549-S552 PolarHBondContact O-OG 3.48Å; R549-G553 PolarHBondContact O-N 3.01Å
550	K	54.4	Low	48.4	Very low	164 Å²	164	123.6 Å²	123.6	71%	0.713	69%	0.685	S	S	*	*	H	α-helix	trans	-74.6	-24.7	175.8	-78.1	175.6	179.7	168.4	0	113.6	E546 R547	E546-K550 WeakPolarHBondContact O-CB 3.45Å; E546-K550 WeakPolarHBondContact O-CG 3.04Å; E546-K550 PolarHBondContact O-N 3.4Å; R547-K550 PolarHBondContact O-N 2.95Å
551	V	51.9	Low	46.2	Very low	133 Å²	133	125.3 Å²	125.3	81%	0.806	70%	0.696	S	S	*	*	H	α-helix	trans	-82.5	-21.6	176.6	175.4	0	0	0	0	112.3	R547 E548	R547-V551 WeakPolarHBondContact O-CG2 3.48Å; R547-V551 PolarHBondContact O-N 3.49Å; R547-V551 VanDerWaalsContact O-N 3.08Å; E548-V551 PolarHBondContact O-N 2.94Å
552	S	47.5	Very low	44.6	Very low	101 Å²	101	132 Å²	132	71%	0.706	72%	0.717	S	S	*	*	H	α-helix	trans	-97.8	-4.5	179.6	48.6	0	0	0	0	115.2	E548 R549	E548-S552 PolarHBondContact O-N 2.91Å; E548-S552 PolarHBondContact O-OG 3.18Å; R549-S552 PolarHBondContact O-OG 3.48Å
553	G	38.8	Very low	42.6	Very low	59 Å²	59	135.3 Å²	135.3	61%	0.608	73%	0.732	S	S	*	*			trans	-112.2	82.3	-178.4	0	0	0	0	0	113.9	R549	R549-G553 PolarHBondContact O-N 3.01Å
554	G	33.7	Very low	40.6	Very low	75 Å²	75	139.7 Å²	139.7	77%	0.773	75%	0.753	S	S	*	*			trans	-82.2	117.4	172.1	0	0	0	0	0	113.5
555	R	33.4	Very low	38.9	Very low	246 Å²	246	141.9 Å²	141.9	93%	0.928	77%	0.772	S	S	*	*			trans	67.6	111.4	158.5	-68.5	179.7	169.3	174.7	-2.9	119.4
556	A	28.5	Very low	37.3	Very low	101 Å²	101	143.1 Å²	143.1	84%	0.835	78%	0.784	S	S	*	*				-173.9	129.4	110	0	0	0	0	0	114.1
557	S	30	Very low	36.5	Very low	124 Å²	124	141.3 Å²	141.3	87%	0.867	80%	0.799	S	S	*	*			trans	54.4	123.6	152	-142.4	0	0	0	0	123.2
558	A	31.6	Very low	35.1	Very low	95 Å²	95	142.3 Å²	142.3	79%	0.785	81%	0.808	S	S	*	*			trans	-75.1	145.7	169.3	0	0	0	0	0	112.8
559	S	27.5	Very low	33.8	Very low	119 Å²	119	140.9 Å²	140.9	83%	0.832	81%	0.812	S	S	*	*			trans	-147.7	124.1	142.4	63.8	0	0	0	0	109.3
560	T	28.9	Very low	32.9	Very low	140 Å²	140	141.2 Å²	141.2	86%	0.859	81%	0.813	S	S	*	*			trans	-87.8	123.7	179.5	12.4	0	0	0	0	109.7
561	T	27.4	Very low	31.7	Very low	141 Å²	141	139.4 Å²	139.4	87%	0.865	81%	0.812	S	S	*	*			trans	-135.1	123.9	152.1	33.8	0	0	0	0	108.9
562	R	31	Very low	30.5	Very low	248 Å²	248	138.3 Å²	138.3	94%	0.936	81%	0.81	S	S	*	*			trans	-79.4	124.4	175.2	-87.6	172.4	158.2	165.1	-7	108.3
563	E	26.5	Very low	29.6	Very low	194 Å²	194	144.6 Å²	144.6	91%	0.907	82%	0.818	S	S	*	*			trans	-140.3	144.1	151.5	-70.8	-165.3	166.7	0	0	111
564	T	25.8	Very low	29.4	Very low	120 Å²	120	147.5 Å²	147.5	74%	0.736	83%	0.829	S	S	*	*			trans	-62.2	154.2	-171.7	41.4	0	0	0	0	115.2	Q566	T564-Q566 PolarHBondContact O-N 2.81Å; T564-Q566 VanDerWaalsContact O-N 3.09Å
565	P	26.3	Very low	29.1	Very low	135 Å²	135	151.5 Å²	151.5	88%	0.877	83%	0.833	S	S	*	*			trans	-80.5	94.9	177.6	32	-29.5	0	0	0	110.6
566	Q	25.4	Very low	28.8	Very low	177 Å²	177	143.4 Å²	143.4	83%	0.827	81%	0.814	S	S	*	*			trans	-80.5	140.2	158.7	-88.7	-177.5	-19.2	0	0	109.8	T564 K568	T564-Q566 PolarHBondContact O-N 2.81Å; T564-Q566 VanDerWaalsContact O-N 3.09Å; Q566-K568 PolarHBondContact O-N 2.92Å
567	G	39.1	Very low	28.9	Very low	84 Å²	84	148 Å²	148	87%	0.866	82%	0.818	S	S	*	*			trans	-49.8	127.9	-171.7	0	0	0	0	0	113.9	S569	G567-S569 PolarHBondContact O-N 3.3Å
568	K	27	Very low	28.9	Very low	201 Å²	201	148.3 Å²	148.3	87%	0.874	81%	0.81	S	S	*	*			trans	-85.2	109.7	169.6	-75.2	-176.8	176.7	-179.2	0	109.2	Q566	Q566-K568 PolarHBondContact O-N 2.92Å
569	S	24.2	Very low	29	Very low	98 Å²	98	153 Å²	153	69%	0.685	82%	0.816	S	S	*	*			trans	-40.1	136	160.4	178.1	0	0	0	0	112	G567 D571	G567-S569 PolarHBondContact O-N 3.3Å; S569-D571 VanDerWaalsContact C-N 3.3Å; S569-D571 PolarHBondContact O-N 2.79Å
570	W	32.2	Very low	29.1	Very low	210 Å²	210	154.5 Å²	154.5	80%	0.795	81%	0.808	S	S	*	*	S	Bend	trans	-88.6	28.3	-173.3	-124.4	65.8	0	0	0	113.9
571	D	28.4	Very low	28.9	Very low	127 Å²	127	156.8 Å²	156.8	68%	0.679	81%	0.806	S	S	*	*			trans	-102.1	81.9	176.9	-77.9	-18.6	0	0	0	110.2	S569	S569-D571 VanDerWaalsContact C-N 3.3Å; S569-D571 PolarHBondContact O-N 2.79Å
572	S	26.4	Very low	29	Very low	110 Å²	110	156.1 Å²	156.1	77%	0.769	79%	0.793	S	S	*	*			trans	-165.3	59	158.4	-169	0	0	0	0	110.9
573	W	29.2	Very low	28.7	Very low	233 Å²	233	149.3 Å²	149.3	88%	0.883	78%	0.783	S	S	*	*			trans	-124.9	52.2	163.7	-73.8	93.6	0	0	0	109.8
574	S	35.7	Very low	28.9	Very low	120 Å²	120	147 Å²	147	84%	0.839	78%	0.776	S	S	*	*			trans	-134.7	85.3	167.9	-175.5	0	0	0	0	108
575	D	25.8	Very low	29.1	Very low	158 Å²	158	146.5 Å²	146.5	85%	0.845	78%	0.777	S	S	*	*			trans	-173.5	115.4	163.1	-147.3	21.4	0	0	0	104.3
576	S	28.2	Very low	29.2	Very low	77 Å²	77	147.5 Å²	147.5	54%	0.538	78%	0.775	S	S	.	*			cis	-167.3	141.4	9.4	44.1	0	0	0	0	105.8	D578	S576-D578 PolarHBondContact O-N 2.93Å
577	E	30.1	Very low	29.7	Very low	196 Å²	196	148.8 Å²	148.8	92%	0.916	78%	0.781	S	S	*	*	S	Bend	trans	-73.3	42.8	168.6	-60.9	-148.2	150.2	0	0	112.5
578	D	31.3	Very low	29.1	Very low	131 Å²	131	148.3 Å²	148.3	70%	0.701	78%	0.776	S	S	*	*			trans	-130.9	57.6	-172.8	-74.9	-39.8	0	0	0	112.3	S576	S576-D578 PolarHBondContact O-N 2.93Å
579	E	32.9	Very low	29.4	Very low	195 Å²	195	148.1 Å²	148.1	91%	0.911	78%	0.778	S	S	*	*			trans	-129.6	43.1	151.8	-78.1	-167.7	164.5	0	0	110.3
580	F	28.7	Very low	29.4	Very low	149 Å²	149	152.6 Å²	152.6	65%	0.654	79%	0.791	S	S	*	*			trans	-91.9	80.2	156.9	-168.2	-95.6	0	0	0	108.1	E582	F580-E582 HydrophobicContact CD1-CB 4.29Å; F580-E582 HydrophobicContact CD1-CG 4.31Å; F580-E582 HydrophobicContact CE1-CB 3.77Å; F580-E582 VanDerWaalsContact CE1-CD 3.41Å; F580-E582 HydrophobicContact CE1-CG 3.52Å; F580-E582 VanDerWaalsContact CE1-OE2 3.31Å; F580-E582 WeakPolarHBondContact CE1-OE2 3.4Å; F580-E582 HydrophobicContact CE2-CG 4.17Å; F580-E582 HydrophobicContact CZ-CB 4.25Å; F580-E582 HydrophobicContact CZ-CG 3.46Å; F580-E582 VanDerWaalsContact CZ-CG 3.46Å; F580-E582 WeakPolarHBondContact CZ-OE1 3.17Å; F580-E582 WeakPolarHBondContact CZ-OE2 3.28Å
581	F	25.6	Very low	29.2	Very low	188 Å²	188	151.2 Å²	151.2	83%	0.825	79%	0.793	S	S	*	*			trans	-97.4	78.4	160.9	-104	-85.8	0	0	0	108.9	C583	F581-C583 PolarHBondContact O-N 2.78Å
582	E	29.7	Very low	29.3	Very low	127 Å²	127	150.3 Å²	150.3	59%	0.593	80%	0.797	S	S	*	*			trans	-61.8	102	143.1	-85	-174.3	167.9	0	0	107.7	F580 L584	F580-E582 HydrophobicContact CD1-CB 4.29Å; F580-E582 HydrophobicContact CD1-CG 4.31Å; F580-E582 HydrophobicContact CE1-CB 3.77Å; F580-E582 VanDerWaalsContact CE1-CD 3.41Å; F580-E582 HydrophobicContact CE1-CG 3.52Å; F580-E582 VanDerWaalsContact CE1-OE2 3.31Å; F580-E582 WeakPolarHBondContact CE1-OE2 3.4Å; F580-E582 HydrophobicContact CE2-CG 4.17Å; F580-E582 HydrophobicContact CZ-CB 4.25Å; F580-E582 HydrophobicContact CZ-CG 3.46Å; F580-E582 VanDerWaalsContact CZ-CG 3.46Å; F580-E582 WeakPolarHBondContact CZ-OE1 3.17Å; F580-E582 WeakPolarHBondContact CZ-OE2 3.28Å; E582-L584 PolarHBondContact O-N 3.45Å
583	C	24	Very low	29.2	Very low	106 Å²	106	150.8 Å²	150.8	72%	0.716	80%	0.801	S	S	*	*			trans	-77	80.4	156.5	-80.7	0	0	0	0	108.4	F581 S585	F581-C583 PolarHBondContact O-N 2.78Å; C583-S585 VanDerWaalsContact C-N 3.28Å; C583-S585 PolarHBondContact O-N 3.16Å
584	L	32.1	Very low	29.3	Very low	145 Å²	145	148.2 Å²	148.2	76%	0.759	80%	0.798	S	S	*	*			trans	-71.8	93.4	144.5	-69.6	174.1	0	0	0	106.4	E582	E582-L584 PolarHBondContact O-N 3.45Å
585	S	28.2	Very low	28.9	Very low	109 Å²	109	148.3 Å²	148.3	76%	0.762	80%	0.798	S	S	*	*			trans	-90.7	109.1	157.6	57.7	0	0	0	0	107.6	C583	C583-S585 VanDerWaalsContact C-N 3.28Å; C583-S585 PolarHBondContact O-N 3.16Å
586	D	29.9	Very low	29	Very low	156 Å²	156	149.2 Å²	149.2	83%	0.834	80%	0.798	S	S	*	*			trans	-43.1	148	171.5	-80.4	-41.6	0	0	0	114.3	G588	D586-G588 PolarHBondContact O-N 2.83Å
587	Q	36	Very low	29.2	Very low	204 Å²	204	150.6 Å²	150.6	95%	0.953	81%	0.814	S	S	*	*			trans	-58.8	126.3	159.5	-75.6	169.4	-21	0	0	110.3
588	G	25.9	Very low	29	Very low	75 Å²	75	144.9 Å²	144.9	77%	0.773	81%	0.807	S	S	*	*			trans	-170.7	107.9	170.8	0	0	0	0	0	110.3	D586	D586-G588 PolarHBondContact O-N 2.83Å
589	E	32.8	Very low	29.3	Very low	196 Å²	196	148.7 Å²	148.7	92%	0.916	82%	0.818	S	S	*	*			trans	-42.6	139.6	-179.2	-59.5	166.5	159.2	0	0	115.2
590	M	24.2	Very low	29.1	Very low	192 Å²	192	146.8 Å²	146.8	95%	0.946	81%	0.814	S	S	*	*			trans	-153	106	142.1	-143	158.3	-173.1	0	0	111.5
591	E	27.9	Very low	29.3	Very low	181 Å²	181	145.2 Å²	145.2	85%	0.846	82%	0.821	S	S	*	*			trans	-64.5	142.1	165.2	-73.4	-176.3	144.9	0	0	111.6
592	S	31.9	Very low	29.9	Very low	108 Å²	108	141.5 Å²	141.5	76%	0.755	82%	0.818	S	S	*	*			trans	18.3	121.8	155.3	62.8	0	0	0	0	120.5
593	S	24	Very low	30.7	Very low	121 Å²	121	144.7 Å²	144.7	85%	0.846	83%	0.83	S	S	*	*				-155.6	142.4	122.9	52.2	0	0	0	0	112
594	H	31.1	Very low	32.3	Very low	178 Å²	178	145.1 Å²	145.1	82%	0.824	83%	0.825	S	S	*	*			trans	-62.1	139.4	-171.9	-70.6	-95.1	0	0	0	114.8
595	S	26.2	Very low	33.9	Very low	122 Å²	122	147.6 Å²	147.6	85%	0.853	83%	0.83	S	S	*	*			trans	-142.6	99.5	139.5	60.2	0	0	0	0	109.2
596	E	29.6	Very low	36.1	Very low	177 Å²	177	143.9 Å²	143.9	83%	0.827	81%	0.806	S	S	*	*			trans	-66.5	156.7	167.3	-75.5	-172.6	145.5	0	0	111.6
597	A	30.6	Very low	38.3	Very low	107 Å²	107	138.6 Å²	138.6	88%	0.884	78%	0.778	S	S	*	*			trans	87.9	82.4	161.9	0	0	0	0	0	117.7
598	G	26	Very low	40.2	Very low	75 Å²	75	129.9 Å²	129.9	77%	0.773	74%	0.743	S	S	*	*			trans	-164.9	71.6	156	0	0	0	0	0	110.6	D600	G598-D600 PolarHBondContact O-N 3.31Å
599	K	38.6	Very low	43	Very low	212 Å²	212	130.6 Å²	130.6	92%	0.922	72%	0.722	S	S	*	*			trans	-59.9	99.8	169	-97.4	177.6	172.9	173.4	0	108.8
600	D	28.2	Very low	45.3	Very low	155 Å²	155	126.4 Å²	126.4	83%	0.829	71%	0.705	S	S	*	*			trans	-127.8	95.6	149.4	-95.4	-28.8	0	0	0	108	G598 S602	G598-D600 PolarHBondContact O-N 3.31Å; D600-S602 PolarHBondContact O-N 3.49Å
601	S	33	Very low	48	Very low	115 Å²	115	122.5 Å²	122.5	80%	0.804	68%	0.684	S	S	*	*			trans	-64.9	82.7	164.3	48	0	0	0	0	108.5	K603	S601-K603 VanDerWaalsContact C-N 3.32Å; S601-K603 PolarHBondContact O-N 3.07Å
602	S	38.6	Very low	50.5	Low	110 Å²	110	116.6 Å²	116.6	77%	0.769	66%	0.661	S	S	*	*			trans	-63.9	98.3	165.3	62.4	0	0	0	0	107.4	D600 L604	D600-S602 PolarHBondContact O-N 3.49Å; S602-L604 PolarHBondContact O-N 3Å; S602-L604 VanDerWaalsContact O-N 3.1Å
603	K	45.3	Very low	52.7	Low	194 Å²	194	113.8 Å²	113.8	84%	0.843	64%	0.635	S	S	*	*			trans	-43.1	120	170.6	-68.3	177	175.9	-177.1	0	108.5	S601 K605	S601-K603 VanDerWaalsContact C-N 3.32Å; S601-K603 PolarHBondContact O-N 3.07Å; K603-K605 PolarHBondContact O-N 3.33Å
604	L	57.6	Low	55.1	Low	116 Å²	116	114.2 Å²	114.2	61%	0.607	63%	0.628	S	S	*	*			trans	-48.1	107.3	169	-82	148.3	0	0	0	107.5	S602 A606 P681	S602-L604 PolarHBondContact O-N 3Å; S602-L604 VanDerWaalsContact O-N 3.1Å; L604-A606 PolarHBondContact O-N 3.49Å; L604-A606 VanDerWaalsContact O-N 3.17Å; L604-P681 HydrophobicContact CB-CB 3.95Å; L604-P681 HydrophobicContact CB-CG 4.33Å; L604-P681 WeakPolarHBondContact O-CG 3.47Å
605	K	66.6	Low	56.9	Low	196 Å²	196	112 Å²	112	85%	0.852	62%	0.622	S	S	*	*			trans	-72	114	-175.5	-170.5	176.7	-178.3	179.1	0	107.5	K603 D607	K603-K605 PolarHBondContact O-N 3.33Å; K605-D607 PolarHBondContact O-N 2.72Å
606	A	74.4	Confident	59.3	Low	32 Å²	32	108.4 Å²	108.4	26%	0.264	59%	0.592	S	S	.	*			trans	-61.2	133.8	178	0	0	0	0	0	111.2	L604 R609 P681	L604-A606 PolarHBondContact O-N 3.49Å; L604-A606 VanDerWaalsContact O-N 3.17Å; A606-R609 VanDerWaalsContact CB-NE 3.28Å; A606-P681 HydrophobicContact CB-CG 3.75Å
607	D	75.1	Confident	61.8	Low	45 Å²	45	103.1 Å²	103.1	24%	0.241	57%	0.572	C	S	.	*			trans	-140.6	144.9	-173.7	-165.7	12.9	0	0	0	109.9	K605 A678 A679 P737 R739	K605-D607 PolarHBondContact O-N 2.72Å; D607-A678 PolarHBondContact N-O 2.88Å; D607-A678 CarbonylContact O-C 2.95Å; D607-A678 VanDerWaalsContact O-C 3.29Å; D607-A679 WeakPolarHBondContact O-CA 3.43Å; D607-A679 PolarHBondContact O-N 3.46Å; D607-P737 HydrophobicContact CB-CB 4.38Å; D607-P737 HydrophobicContact CB-CG 4.43Å; D607-P737 WeakPolarHBondContact OD2-CG 3.43Å; D607-R739 IonicContact OD1-CZ 2.7Å; D607-R739 IonicContact OD1-NE 2.63Å; D607-R739 IonicContact OD1-NH2 3.21Å; D607-R739 PolarHBondContact OD1-NH2 2.87Å; D607-R739 VanDerWaalsContact OD1-NH2 3.07Å; D607-R739 IonicContact OD2-CZ 3.68Å; D607-R739 IonicContact OD2-NE 2.87Å; D607-R739 PolarHBondContact OD2-NE 2.65Å; D607-R739 IonicContact OD2-NH2 2.7Å; D607-R739 PolarHBondContact OD2-NH2 3.11Å
608	G	77.7	Confident	64.2	Low	21 Å²	21	98.2 Å²	98.2	22%	0.216	53%	0.531	C	S	.	.			trans	76	37	-179.1	0	0	0	0	0	116	P628 V629	G608-P628 CarbonylContact O-C 3.53Å; G608-P628 WeakPolarHBondContact O-CA 3.47Å; G608-V629 PolarHBondContact O-N 3.29Å
609	R	84.9	Confident	66.6	Low	90 Å²	90	98.1 Å²	98.1	34%	0.34	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	133.7	174.9	-65.1	177.4	168.9	179.5	-3	111.7	A606 Y626 A679	A606-R609 VanDerWaalsContact CB-NE 3.28Å; R609-Y626 HydrophobicContact CB-CD1 4.07Å; R609-Y626 HydrophobicContact CB-CG 4.25Å; R609-Y626 HydrophobicContact CG-CD1 4.19Å; R609-Y626 HydrophobicContact CG-CG 3.92Å; R609-A679 HydrophobicContact CG-CB 4.14Å; R609-A679 PolarHBondContact NE-O 3.34Å; R609-A679 PolarHBondContact NH2-O 2.78Å
610	L	79.9	Confident	68.2	Low	107 Å²	107	94.9 Å²	94.9	56%	0.56	50%	0.5	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	-73.7	171.1	-74.4	171.9	0	0	0	111.8	V627 V629	L610-V627 HydrophobicContact CB-CB 4.49Å; L610-V627 HydrophobicContact CD1-CG1 4.27Å; L610-V627 PolarHBondContact N-O 3.01Å; L610-V629 HydrophobicContact CD1-CG2 4.37Å; L610-V629 HydrophobicContact CD2-CG2 3.7Å; L610-V629 HydrophobicContact CG-CG2 3.64Å
611	H	80.4	Confident	70.3	Confident	110 Å²	110	89.4 Å²	89.4	51%	0.509	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	156.4	-179.6	53.6	-86.9	0	0	0	110	V627	H611-V627 PolarHBondContact O-N 2.91Å
612	P	81.8	Confident	72	Confident	57 Å²	57	88.8 Å²	88.8	37%	0.37	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	137.7	175.5	27.3	-34	0	0	0	110.6	N614 Y626	P612-N614 PolarHBondContact O-N 2.95Å; P612-Y626 HydrophobicContact CB-CD1 4.37Å; P612-Y626 HydrophobicContact CB-CE1 4.15Å
613	Y	78.4	Confident	73.9	Confident	49 Å²	49	88.5 Å²	88.5	19%	0.192	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	105.6	-177.8	-175.9	-102.7	0	0	0	110.4	N615 M616 L625 V627 W691	Y613-N615 PolarHBondContact O-N 2.86Å; Y613-M616 HydrophobicContact CD1-CE 3.68Å; Y613-M616 HydrophobicContact CD1-CG 4.32Å; Y613-M616 HydrophobicContact CD1-SD 3.99Å; Y613-M616 HydrophobicContact CE1-CE 3.66Å; Y613-M616 HydrophobicContact CE1-SD 3.81Å; Y613-M616 PolarHBondContact O-N 3.49Å; Y613-L625 VanDerWaalsContact CB-CD2 3.47Å; Y613-L625 HydrophobicContact CD1-CD2 3.98Å; Y613-L625 HydrophobicContact CG-CD2 3.9Å; Y613-L625 PolarHBondContact N-O 3.18Å; Y613-V627 HydrophobicContact CD2-CG2 3.77Å; Y613-V627 HydrophobicContact CG-CG2 4.3Å; Y613-W691 AromaticContact CD2-CD1 3.94Å; Y613-W691 AromaticContact CE2-CD1 3.9Å
614	N	73.4	Confident	75.5	Confident	131 Å²	131	82.4 Å²	82.4	70%	0.701	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	44.9	32	172.7	-65.9	-15.3	0	0	0	115.8	P612 M616	P612-N614 PolarHBondContact O-N 2.95Å; N614-M616 HydrophobicContact CB-CG 4.44Å; N614-M616 PolarHBondContact O-N 3.09Å; N614-M616 VanDerWaalsContact O-N 3.09Å
615	N	68.8	Low	76.7	Confident	130 Å²	130	76.9 Å²	76.9	70%	0.695	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	53.3	21.9	-173.7	-64.7	-17.7	0	0	0	115.2	Y613	Y613-N615 PolarHBondContact O-N 2.86Å
616	M	77.6	Confident	77.6	Confident	47 Å²	47	70.3 Å²	70.3	23%	0.232	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	146	174.8	-64.1	-166.8	-9.7	0	0	111	Y613 N614 L624 L625 R690	Y613-M616 HydrophobicContact CD1-CE 3.68Å; Y613-M616 HydrophobicContact CD1-CG 4.32Å; Y613-M616 HydrophobicContact CD1-SD 3.99Å; Y613-M616 HydrophobicContact CE1-CE 3.66Å; Y613-M616 HydrophobicContact CE1-SD 3.81Å; Y613-M616 PolarHBondContact O-N 3.49Å; N614-M616 HydrophobicContact CB-CG 4.44Å; N614-M616 PolarHBondContact O-N 3.09Å; N614-M616 VanDerWaalsContact O-N 3.09Å; M616-L624 WeakPolarHBondContact O-CA 3.39Å; M616-L625 HydrophobicContact CE-CD1 4.16Å; M616-L625 PolarHBondContact O-N 3.24Å; M616-R690 HydrophobicContact CE-CB 4.29Å
617	T	81.3	Confident	78.1	Confident	66 Å²	66	69.6 Å²	69.6	41%	0.405	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	157	170	57.3	0	0	0	0	111.3	E623 L624 R690	T617-E623 VanDerWaalsContact CA-O 3.26Å; T617-E623 WeakPolarHBondContact CA-O 3.32Å; T617-L624 HydrophobicContact CG2-CD2 4.24Å; T617-R690 PolarHBondContact O-NH1 3.42Å; T617-R690 VanDerWaalsContact O-NH1 3.16Å
618	L	80.4	Confident	78.7	Confident	5 Å²	5	67.5 Å²	67.5	3%	0.026	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-61.1	150.4	168	-65.2	172.9	0	0	0	110.5	H620 S621 E623 L625 N680 C683 D687	L618-H620 VanDerWaalsContact C-N 3.32Å; L618-H620 PolarHBondContact O-N 3.49Å; L618-S621 WeakPolarHBondContact CB-OG 3.24Å; L618-S621 WeakPolarHBondContact CD1-OG 3.35Å; L618-E623 HydrophobicContact CD1-CB 4.44Å; L618-E623 PolarHBondContact N-O 2.88Å; L618-L625 HydrophobicContact CD2-CB 4.41Å; L618-L625 HydrophobicContact CD2-CD1 4.24Å; L618-L625 HydrophobicContact CD2-CG 4.3Å; L618-N680 HydrophobicContact CD1-CB 4.48Å; L618-N680 HydrophobicContact CD2-CB 4.24Å; L618-C683 HydrophobicContact CD2-CB 4.08Å; L618-D687 HydrophobicContact CD2-CB 3.96Å
619	L	76.6	Confident	79	Confident	73 Å²	73	69.3 Å²	69.3	38%	0.382	37%	0.368	S	S	.	.	S	Bend	trans	-65.8	-34.4	-176.1	-74.6	163.6	0	0	0	113.2	V684 E686 D687	L619-V684 HydrophobicContact CD1-CG2 4.26Å; L619-E686 HydrophobicContact CD1-CB 3.46Å; L619-E686 VanDerWaalsContact CD1-CB 3.46Å; L619-E686 HydrophobicContact CD1-CG 4.49Å; L619-D687 VanDerWaalsContact CG-OD1 3.24Å; L619-D687 WeakPolarHBondContact CG-OD1 3.38Å; L619-D687 PolarHBondContact N-OD1 3.4Å; L619-D687 PolarHBondContact N-OD2 3.27Å
620	H	72.7	Confident	79	Confident	144 Å²	144	67.8 Å²	67.8	67%	0.667	37%	0.369	S	S	*	.	S	Bend	trans	-108.2	3.4	-174.8	-62	91.3	0	0	0	113.6	L618	L618-H620 VanDerWaalsContact C-N 3.32Å; L618-H620 PolarHBondContact O-N 3.49Å
621	S	72.7	Confident	79.1	Confident	40 Å²	40	64.1 Å²	64.1	28%	0.28	35%	0.349	S	S	.	.	S	Bend	trans	-145.7	150.9	176.5	76.8	0	0	0	0	112	L618 E623	L618-S621 WeakPolarHBondContact CB-OG 3.24Å; L618-S621 WeakPolarHBondContact CD1-OG 3.35Å; S621-E623 PolarHBondContact O-N 3.02Å; S621-E623 VanDerWaalsContact O-N 3.11Å
622	A	68.5	Low	79	Confident	101 Å²	101	65.4 Å²	65.4	84%	0.835	36%	0.355	S	S	*	.	S	Bend	trans	-76.1	11.9	176.5	0	0	0	0	0	113.4
623	E	77.4	Confident	78.9	Confident	105 Å²	105	67 Å²	67	49%	0.491	37%	0.365	S	S	.	.	S	Bend	trans	-82	143.4	177.7	-61.7	-166.4	-179.5	0	0	110.9	T617 L618 S621	T617-E623 VanDerWaalsContact CA-O 3.26Å; T617-E623 WeakPolarHBondContact CA-O 3.32Å; L618-E623 HydrophobicContact CD1-CB 4.44Å; L618-E623 PolarHBondContact N-O 2.88Å; S621-E623 PolarHBondContact O-N 3.02Å; S621-E623 VanDerWaalsContact O-N 3.11Å
624	L	80.3	Confident	79	Confident	66 Å²	66	66.7 Å²	66.7	35%	0.346	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	139.7	176.3	-66.6	172.8	0	0	0	110.6	M616 T617 Y626	M616-L624 WeakPolarHBondContact O-CA 3.39Å; T617-L624 HydrophobicContact CG2-CD2 4.24Å; L624-Y626 HydrophobicContact CB-CE2 4.01Å; L624-Y626 WeakPolarHBondContact O-CD2 3.5Å; L624-Y626 WeakPolarHBondContact O-CE2 3.16Å
625	L	82.9	Confident	79.6	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	126.3	172.3	-169.3	153.8	0	0	0	109	Y613 M616 L618 F676 D687 W691	Y613-L625 VanDerWaalsContact CB-CD2 3.47Å; Y613-L625 HydrophobicContact CD1-CD2 3.98Å; Y613-L625 HydrophobicContact CG-CD2 3.9Å; Y613-L625 PolarHBondContact N-O 3.18Å; M616-L625 HydrophobicContact CE-CD1 4.16Å; M616-L625 PolarHBondContact O-N 3.24Å; L618-L625 HydrophobicContact CD2-CB 4.41Å; L618-L625 HydrophobicContact CD2-CD1 4.24Å; L618-L625 HydrophobicContact CD2-CG 4.3Å; L625-F676 HydrophobicContact CD1-CZ 4.16Å; L625-F676 HydrophobicContact CD2-CE2 4.24Å; L625-F676 HydrophobicContact CG-CE2 4.46Å; L625-F676 HydrophobicContact CG-CZ 4.36Å; L625-D687 HydrophobicContact CD1-CB 4.43Å; L625-W691 HydrophobicContact CD2-CB 4.46Å
626	Y	85.4	Confident	80.3	Confident	58 Å²	58	57.6 Å²	57.6	23%	0.227	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	140.4	177.1	-73	-92.5	0	0	0	111	R609 P612 L624 P628 N680	R609-Y626 HydrophobicContact CB-CD1 4.07Å; R609-Y626 HydrophobicContact CB-CG 4.25Å; R609-Y626 HydrophobicContact CG-CD1 4.19Å; R609-Y626 HydrophobicContact CG-CG 3.92Å; P612-Y626 HydrophobicContact CB-CD1 4.37Å; P612-Y626 HydrophobicContact CB-CE1 4.15Å; L624-Y626 HydrophobicContact CB-CE2 4.01Å; L624-Y626 WeakPolarHBondContact O-CD2 3.5Å; L624-Y626 WeakPolarHBondContact O-CE2 3.16Å; Y626-P628 WeakPolarHBondContact O-CD 3.37Å; Y626-N680 PolarHBondContact N-OD1 2.68Å; Y626-N680 PolarHBondContact O-ND2 2.98Å; Y626-N680 PolarHBondContact O-OD1 3.35Å
627	V	85.1	Confident	80.8	Confident	17 Å²	17	55.4 Å²	55.4	10%	0.103	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	122.1	170	-178.1	0	0	0	0	108.4	L610 H611 Y613 W691	L610-V627 HydrophobicContact CB-CB 4.49Å; L610-V627 HydrophobicContact CD1-CG1 4.27Å; L610-V627 PolarHBondContact N-O 3.01Å; H611-V627 PolarHBondContact O-N 2.91Å; Y613-V627 HydrophobicContact CD2-CG2 3.77Å; Y613-V627 HydrophobicContact CG-CG2 4.3Å; V627-W691 HydrophobicContact CG1-CZ2 4.29Å
628	P	86.4	Confident	81	Confident	1 Å²	1	55 Å²	55	1%	0.006	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	153.3	176.6	31.4	-36.5	0	0	0	111.6	G608 Y626 T630 S675 F676 A679 W691	G608-P628 CarbonylContact O-C 3.53Å; G608-P628 WeakPolarHBondContact O-CA 3.47Å; Y626-P628 WeakPolarHBondContact O-CD 3.37Å; P628-T630 HydrophobicContact CG-CG2 4.2Å; P628-T630 PolarHBondContact O-N 3.41Å; P628-S675 WeakPolarHBondContact CB-O 3.4Å; P628-F676 HydrophobicContact CG-CB 4.14Å; P628-F676 HydrophobicContact CG-CD2 3.99Å; P628-A679 HydrophobicContact CB-CB 3.71Å; P628-W691 HydrophobicContact CG-CE3 4.42Å; P628-W691 HydrophobicContact CG-CH2 3.3Å; P628-W691 HydrophobicContact CG-CZ2 3.58Å; P628-W691 HydrophobicContact CG-CZ3 3.76Å
629	V	84.7	Confident	81.3	Confident	58 Å²	58	57 Å²	57	35%	0.352	32%	0.317	S	S	.	.			trans	-73	114.3	160.9	-179.2	0	0	0	0	107.6	G608 L610 S675 A738	G608-V629 PolarHBondContact O-N 3.29Å; L610-V629 HydrophobicContact CD1-CG2 4.37Å; L610-V629 HydrophobicContact CD2-CG2 3.7Å; L610-V629 HydrophobicContact CG-CG2 3.64Å; V629-S675 WeakPolarHBondContact O-CB 3.44Å; V629-A738 HydrophobicContact CG1-CB 4.38Å; V629-A738 VanDerWaalsContact O-CB 3.25Å; V629-A738 WeakPolarHBondContact O-CB 3.41Å
630	T	85.1	Confident	81.7	Confident	59 Å²	59	54.8 Å²	54.8	36%	0.362	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-99.1	165.6	176.2	52.9	0	0	0	0	111.9	P628 D672 W691	P628-T630 HydrophobicContact CG-CG2 4.2Å; P628-T630 PolarHBondContact O-N 3.41Å; T630-D672 VanDerWaalsContact CB-OD1 3.25Å; T630-D672 WeakPolarHBondContact CB-OD1 3.38Å; T630-D672 HydrophobicContact CG2-CB 4.41Å; T630-D672 WeakPolarHBondContact CG2-OD1 3.48Å; T630-W691 HydrophobicContact CG2-CH2 3.77Å; T630-W691 HydrophobicContact CG2-CZ2 4.37Å
631	Q	82.4	Confident	82.3	Confident	30 Å²	30	52.2 Å²	52.2	14%	0.14	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-83.8	142.8	169.8	-66.2	-169.9	48.2	0	0	109.8	S671 A738 Q741 K742 L744	Q631-S671 PolarHBondContact NE2-OG 3.27Å; Q631-A738 HydrophobicContact CG-CB 4.09Å; Q631-Q741 VanDerWaalsContact NE2-CB 3.27Å; Q631-K742 PolarHBondContact NE2-O 2.98Å; Q631-L744 HydrophobicContact CB-CD1 3.84Å; Q631-L744 HydrophobicContact CB-CG 4.33Å
632	E	77.6	Confident	82.9	Confident	137 Å²	137	55.3 Å²	55.3	64%	0.64	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-70.3	144.3	170	-68.7	179.6	175.9	0	0	110.6	R530	R530-E632 IonicContact NH2-OE2 3.05Å; R530-E632 PolarHBondContact NH2-OE2 3.37Å; R530-E632 VanDerWaalsContact NH2-OE2 3.12Å
633	P	79.6	Confident	83.7	Confident	91 Å²	91	56.6 Å²	56.6	59%	0.591	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-60.3	150.7	172.5	25.9	-33.1	0	0	0	111.1	R530	R530-P633 PolarHBondContact NH2-O 3.29Å
634	A	81.3	Confident	84	Confident	41 Å²	41	56.1 Å²	56.1	34%	0.339	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-67.4	124.4	175.5	0	0	0	0	0	109.5	F745	A634-F745 HydrophobicContact CB-CB 4.12Å; A634-F745 HydrophobicContact CB-CD2 3.94Å
635	P	84.9	Confident	84.2	Confident	18 Å²	18	56 Å²	56	12%	0.117	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-61	148.4	166.1	27.9	-32.3	0	0	0	108.4	P510 M523 F745	P510-P635 HydrophobicContact CG-CB 4.45Å; M523-P635 HydrophobicContact CE-CB 4.13Å; M523-P635 HydrophobicContact CE-CG 4.19Å; M523-P635 VanDerWaalsContact CE-O 3.3Å; M523-P635 WeakPolarHBondContact CE-O 3.36Å; M523-P635 HydrophobicContact SD-CG 4.04Å; P635-F745 HydrophobicContact CG-CD2 4.28Å; P635-F745 HydrophobicContact CG-CE2 3.84Å; P635-F745 HydrophobicContact CG-CZ 4.21Å
636	M	84.1	Confident	84.3	Confident	53 Å²	53	60.3 Å²	60.3	26%	0.261	32%	0.317	S	S	.	.			trans	-133.3	141.4	-177.8	-62.8	-161.1	73.9	0	0	109.9	Q640 Q644	M636-Q640 HydrophobicContact CE-CB 3.62Å; M636-Q644 HydrophobicContact CE-CG 4.07Å; M636-Q644 PolarHBondContact SD-OE1 3.25Å
637	T	87	Confident	84.3	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.322	C	S	.	.			trans	-86.4	162.5	169.2	52.8	0	0	0	0	110.9	P510 Q519 K520 M523 D639 Q640 L641	P510-T637 HydrophobicContact CB-CG2 4.32Å; P510-T637 HydrophobicContact CG-CG2 4.11Å; Q519-T637 HydrophobicContact CB-CG2 4.02Å; K520-T637 HydrophobicContact CD-CG2 4.29Å; K520-T637 PolarHBondContact NZ-OG1 3.11Å; K520-T637 VanDerWaalsContact NZ-OG1 3.09Å; M523-T637 HydrophobicContact CB-CG2 4.07Å; M523-T637 HydrophobicContact CE-CG2 3.86Å; T637-D639 VanDerWaalsContact C-N 3.34Å; T637-D639 VanDerWaalsContact CB-OD1 3.23Å; T637-D639 WeakPolarHBondContact CB-OD1 3.31Å; T637-D639 PolarHBondContact O-N 2.86Å; T637-D639 PolarHBondContact OG1-OD1 3.21Å; T637-Q640 VanDerWaalsContact N-OE1 3.17Å; T637-Q640 WeakPolarHBondContact O-CB 3.36Å; T637-Q640 PolarHBondContact O-N 3.31Å; T637-Q640 VanDerWaalsContact O-N 3.1Å; T637-Q640 WeakPolarHBondContact OG1-CG 3.48Å; T637-L641 PolarHBondContact O-N 3Å
638	E	85.6	Confident	84.2	Confident	57 Å²	57	61 Å²	61	27%	0.266	33%	0.326	S	S	.	.	H	α-helix	trans	-56.5	-43.6	-176.8	-178.5	178.1	-165	0	0	113.4	K453 L512 L516 Q519 Q640 L641 E642	K453-E638 WeakPolarHBondContact CE-OE2 3.27Å; K453-E638 IonicContact NZ-OE1 3.38Å; K453-E638 PolarHBondContact NZ-OE1 3.04Å; K453-E638 IonicContact NZ-OE2 3.12Å; K453-E638 PolarHBondContact NZ-OE2 3.29Å; L512-E638 HydrophobicContact CD2-CB 4.21Å; L516-E638 HydrophobicContact CD1-CB 4.45Å; Q519-E638 PolarHBondContact NE2-OE2 3.41Å; E638-Q640 VanDerWaalsContact C-N 3.3Å; E638-Q640 PolarHBondContact O-N 3.48Å; E638-L641 WeakPolarHBondContact O-CB 3.47Å; E638-L641 PolarHBondContact O-N 3.09Å; E638-L641 VanDerWaalsContact O-N 3.12Å; E638-E642 PolarHBondContact O-N 3.13Å
639	D	86.9	Confident	84.1	Confident	47 Å²	47	64.6 Å²	64.6	25%	0.251	36%	0.355	S	S	.	.	H	α-helix	trans	-63.1	-35.2	176.9	65	-39.1	0	0	0	112.7	L516 K520 T637 E642 E643	L516-D639 HydrophobicContact CD1-CB 3.98Å; L516-D639 HydrophobicContact CD2-CB 4.4Å; K520-D639 WeakPolarHBondContact CE-OD1 3.35Å; K520-D639 VanDerWaalsContact CE-OD2 3.27Å; K520-D639 WeakPolarHBondContact CE-OD2 3.22Å; K520-D639 IonicContact NZ-OD1 2.72Å; K520-D639 PolarHBondContact NZ-OD1 3.21Å; K520-D639 IonicContact NZ-OD2 2.84Å; K520-D639 PolarHBondContact NZ-OD2 2.93Å; T637-D639 VanDerWaalsContact C-N 3.34Å; T637-D639 VanDerWaalsContact CB-OD1 3.23Å; T637-D639 WeakPolarHBondContact CB-OD1 3.31Å; T637-D639 PolarHBondContact O-N 2.86Å; T637-D639 PolarHBondContact OG1-OD1 3.21Å; D639-E642 PolarHBondContact O-N 2.89Å; D639-E643 WeakPolarHBondContact O-CB 3.43Å; D639-E643 PolarHBondContact O-N 3.07Å
640	Q	85	Confident	84.1	Confident	28 Å²	28	69.2 Å²	69.2	13%	0.131	37%	0.371	C	S	.	.	H	α-helix	trans	-70.2	-34.5	174.8	-63.6	179.1	-33.6	0	0	111.6	M636 T637 E638 Q644 E750	M636-Q640 HydrophobicContact CE-CB 3.62Å; T637-Q640 VanDerWaalsContact N-OE1 3.17Å; T637-Q640 WeakPolarHBondContact O-CB 3.36Å; T637-Q640 PolarHBondContact O-N 3.31Å; T637-Q640 VanDerWaalsContact O-N 3.1Å; T637-Q640 WeakPolarHBondContact OG1-CG 3.48Å; E638-Q640 VanDerWaalsContact C-N 3.3Å; E638-Q640 PolarHBondContact O-N 3.48Å; Q640-Q644 WeakPolarHBondContact O-CB 3.45Å; Q640-Q644 VanDerWaalsContact O-CG 3.3Å; Q640-Q644 WeakPolarHBondContact O-CG 3.34Å; Q640-Q644 PolarHBondContact O-N 3.33Å; Q640-E750 PolarHBondContact NE2-OE2 2.76Å
641	L	85.4	Confident	83.9	Confident	89 Å²	89	68.7 Å²	68.7	47%	0.466	37%	0.365	S	S	.	.	H	α-helix	trans	-68.7	-41.9	175	-165.6	80.9	0	0	0	110.8	T637 E638 Q644 S645	T637-L641 PolarHBondContact O-N 3Å; E638-L641 WeakPolarHBondContact O-CB 3.47Å; E638-L641 PolarHBondContact O-N 3.09Å; E638-L641 VanDerWaalsContact O-N 3.12Å; L641-Q644 PolarHBondContact O-N 3.3Å; L641-S645 WeakPolarHBondContact O-CB 3.41Å; L641-S645 PolarHBondContact O-N 3.42Å
642	E	84.9	Confident	83.7	Confident	106 Å²	106	68.7 Å²	68.7	50%	0.495	37%	0.374	S	S	.	.	H	α-helix	trans	-63	-48.5	175.8	-171.9	169	-158.9	0	0	110.9	E638 D639 Q644 S645 E646	E638-E642 PolarHBondContact O-N 3.13Å; D639-E642 PolarHBondContact O-N 2.89Å; E642-Q644 VanDerWaalsContact C-N 3.35Å; E642-Q644 PolarHBondContact O-N 3.36Å; E642-S645 CarbonylContact O-C 3.51Å; E642-S645 WeakPolarHBondContact O-CA 3.42Å; E642-S645 WeakPolarHBondContact O-CB 3.19Å; E642-S645 PolarHBondContact O-N 3.01Å; E642-S645 PolarHBondContact O-OG 3.32Å; E642-E646 PolarHBondContact O-N 3.49Å
643	E	85.2	Confident	83.8	Confident	128 Å²	128	68.4 Å²	68.4	60%	0.598	38%	0.381	S	S	*	.	H	α-helix	trans	-57.8	-45.6	175.3	-173.4	-174.4	-177.6	0	0	111.6	D639 S645 E646 V647	D639-E643 WeakPolarHBondContact O-CB 3.43Å; D639-E643 PolarHBondContact O-N 3.07Å; E643-S645 VanDerWaalsContact C-N 3.33Å; E643-S645 PolarHBondContact O-N 3.43Å; E643-E646 PolarHBondContact O-N 3.46Å; E643-V647 VanDerWaalsContact O-CG2 3.28Å; E643-V647 WeakPolarHBondContact O-CG2 3.36Å; E643-V647 PolarHBondContact O-N 2.94Å
644	Q	83.8	Confident	84	Confident	95 Å²	95	67.1 Å²	67.1	44%	0.444	37%	0.374	S	S	.	.	H	α-helix	trans	-61.2	-42.6	174.9	-78.7	-171.6	-2.3	0	0	111.8	M636 Q640 L641 E642 E646 V647 L648	M636-Q644 HydrophobicContact CE-CG 4.07Å; M636-Q644 PolarHBondContact SD-OE1 3.25Å; Q640-Q644 WeakPolarHBondContact O-CB 3.45Å; Q640-Q644 VanDerWaalsContact O-CG 3.3Å; Q640-Q644 WeakPolarHBondContact O-CG 3.34Å; Q640-Q644 PolarHBondContact O-N 3.33Å; L641-Q644 PolarHBondContact O-N 3.3Å; E642-Q644 VanDerWaalsContact C-N 3.35Å; E642-Q644 PolarHBondContact O-N 3.36Å; Q644-E646 VanDerWaalsContact C-N 3.33Å; Q644-E646 PolarHBondContact O-N 3.1Å; Q644-V647 PolarHBondContact O-N 2.96Å; Q644-L648 WeakPolarHBondContact O-CB 3.35Å; Q644-L648 WeakPolarHBondContact O-CG 3.48Å; Q644-L648 PolarHBondContact O-N 3.47Å
645	S	84.2	Confident	83.8	Confident	64 Å²	64	69.5 Å²	69.5	45%	0.448	39%	0.394	S	S	.	.	H	α-helix	trans	-63.4	-39.4	178	82.6	0	0	0	0	111.9	L641 E642 E643 L648 A649	L641-S645 WeakPolarHBondContact O-CB 3.41Å; L641-S645 PolarHBondContact O-N 3.42Å; E642-S645 CarbonylContact O-C 3.51Å; E642-S645 WeakPolarHBondContact O-CA 3.42Å; E642-S645 WeakPolarHBondContact O-CB 3.19Å; E642-S645 PolarHBondContact O-N 3.01Å; E642-S645 PolarHBondContact O-OG 3.32Å; E643-S645 VanDerWaalsContact C-N 3.33Å; E643-S645 PolarHBondContact O-N 3.43Å; S645-L648 PolarHBondContact O-N 3.18Å; S645-A649 WeakPolarHBondContact O-CB 3.46Å; S645-A649 PolarHBondContact O-N 2.94Å
646	E	85.9	Confident	83.4	Confident	90 Å²	90	76.6 Å²	76.6	42%	0.421	43%	0.426	S	S	.	.	H	α-helix	trans	-66.6	-44.8	176.1	-76.9	-165.9	-171.2	0	0	112	E642 E643 Q644 L648 A649 K650	E642-E646 PolarHBondContact O-N 3.49Å; E643-E646 PolarHBondContact O-N 3.46Å; Q644-E646 VanDerWaalsContact C-N 3.33Å; Q644-E646 PolarHBondContact O-N 3.1Å; E646-L648 VanDerWaalsContact C-N 3.29Å; E646-L648 PolarHBondContact O-N 2.84Å; E646-A649 PolarHBondContact O-N 3.48Å; E646-K650 WeakPolarHBondContact O-CB 3.34Å; E646-K650 VanDerWaalsContact O-CG 3.25Å; E646-K650 WeakPolarHBondContact O-CG 3.48Å; E646-K650 PolarHBondContact O-N 2.9Å; E646-K650 IonicContact OE2-NZ 3.93Å; E646-K650 PolarHBondContact OE2-NZ 3.3Å
647	V	84.9	Confident	83.1	Confident	55 Å²	55	74.3 Å²	74.3	33%	0.333	42%	0.416	S	S	.	.	H	α-helix	trans	-60.7	-44.4	176.7	171.4	0	0	0	0	109.5	E643 Q644 A649 K650 L651 M664	E643-V647 VanDerWaalsContact O-CG2 3.28Å; E643-V647 WeakPolarHBondContact O-CG2 3.36Å; E643-V647 PolarHBondContact O-N 2.94Å; Q644-V647 PolarHBondContact O-N 2.96Å; V647-A649 VanDerWaalsContact C-N 3.33Å; V647-A649 PolarHBondContact O-N 2.92Å; V647-K650 PolarHBondContact O-N 3.33Å; V647-L651 VanDerWaalsContact O-CG 3.31Å; V647-L651 WeakPolarHBondContact O-CG 3.34Å; V647-L651 PolarHBondContact O-N 3.28Å; V647-M664 HydrophobicContact CG1-CE 3.98Å
648	L	83.4	Confident	82.7	Confident	35 Å²	35	77.4 Å²	77.4	18%	0.183	44%	0.435	C	S	.	.	H	α-helix	trans	-64.6	-35.7	175.4	-66.3	170.8	0	0	0	112.1	Q644 S645 E646 R661	Q644-L648 WeakPolarHBondContact O-CB 3.35Å; Q644-L648 WeakPolarHBondContact O-CG 3.48Å; Q644-L648 PolarHBondContact O-N 3.47Å; S645-L648 PolarHBondContact O-N 3.18Å; E646-L648 VanDerWaalsContact C-N 3.29Å; E646-L648 PolarHBondContact O-N 2.84Å; L648-R661 HydrophobicContact CD2-CB 3.86Å; L648-R661 HydrophobicContact CD2-CG 3.58Å; L648-R661 WeakPolarHBondContact O-CD 3.38Å
649	A	84	Confident	82.2	Confident	75 Å²	75	78.8 Å²	78.8	62%	0.62	44%	0.441	S	S	*	.	H	α-helix	trans	-68.9	-41.5	175.9	0	0	0	0	0	112	S645 E646 V647 L651 G652	S645-A649 WeakPolarHBondContact O-CB 3.46Å; S645-A649 PolarHBondContact O-N 2.94Å; E646-A649 PolarHBondContact O-N 3.48Å; V647-A649 VanDerWaalsContact C-N 3.33Å; V647-A649 PolarHBondContact O-N 2.92Å; A649-L651 VanDerWaalsContact C-N 3.25Å; A649-L651 PolarHBondContact O-N 3.17Å; A649-G652 PolarHBondContact O-N 3.32Å
650	K	85	Confident	81.7	Confident	156 Å²	156	80.2 Å²	80.2	68%	0.678	45%	0.448	S	S	*	.	H	α-helix	trans	-63	-29.3	177.6	-74	165.1	-172.5	156.7	0	112.6	E646 V647 G652	E646-K650 WeakPolarHBondContact O-CB 3.34Å; E646-K650 VanDerWaalsContact O-CG 3.25Å; E646-K650 WeakPolarHBondContact O-CG 3.48Å; E646-K650 PolarHBondContact O-N 2.9Å; E646-K650 IonicContact OE2-NZ 3.93Å; E646-K650 PolarHBondContact OE2-NZ 3.3Å; V647-K650 PolarHBondContact O-N 3.33Å; K650-G652 PolarHBondContact O-N 2.89Å
651	L	81.2	Confident	81.3	Confident	47 Å²	47	82.4 Å²	82.4	25%	0.246	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-14	177	-71.9	172.5	0	0	0	114.2	V647 A649 L660 R661 M664	V647-L651 VanDerWaalsContact O-CG 3.31Å; V647-L651 WeakPolarHBondContact O-CG 3.34Å; V647-L651 PolarHBondContact O-N 3.28Å; A649-L651 VanDerWaalsContact C-N 3.25Å; A649-L651 PolarHBondContact O-N 3.17Å; L651-L660 HydrophobicContact CD1-CD2 4.41Å; L651-L660 HydrophobicContact CD1-CG 4.48Å; L651-L660 HydrophobicContact CD2-CD2 3.69Å; L651-R661 HydrophobicContact CB-CG 3.99Å; L651-R661 HydrophobicContact CD1-CG 3.78Å; L651-M664 HydrophobicContact CD1-SD 3.79Å
652	G	77.4	Confident	80.7	Confident	31 Å²	31	79.5 Å²	79.5	32%	0.32	44%	0.444	S	S	.	.			trans	66.7	-171	174.8	0	0	0	0	0	115.3	A649 K650 R661	A649-G652 PolarHBondContact O-N 3.32Å; K650-G652 PolarHBondContact O-N 2.89Å; G652-R661 PolarHBondContact O-NE 3.39Å
653	T	79.6	Confident	80.3	Confident	130 Å²	130	82.6 Å²	82.6	80%	0.798	45%	0.451	S	S	*	.	S	Bend	trans	-104.6	12.9	-177.6	53.8	0	0	0	0	113.8
654	S	83.6	Confident	79.8	Confident	64 Å²	64	81.4 Å²	81.4	45%	0.448	45%	0.447	S	S	.	.	S	Bend	trans	-60.6	158.1	175	65.3	0	0	0	0	111	E656 G657 T658	S654-E656 VanDerWaalsContact C-N 3.26Å; S654-E656 PolarHBondContact O-N 2.72Å; S654-G657 PolarHBondContact O-N 2.9Å; S654-G657 PolarHBondContact OG-N 2.99Å; S654-T658 WeakPolarHBondContact O-CB 3.49Å; S654-T658 PolarHBondContact O-N 3.34Å; S654-T658 PolarHBondContact O-OG1 2.95Å
655	A	77.1	Confident	79.5	Confident	91 Å²	91	83.2 Å²	83.2	75%	0.752	46%	0.456	S	S	*	.	H	α-helix	trans	-59.1	-40.7	176.7	0	0	0	0	0	111.4	T658 H659	A655-T658 PolarHBondContact O-N 3.02Å; A655-H659 PolarHBondContact O-N 3.44Å; A655-H659 VanDerWaalsContact O-N 3.07Å
656	E	77.3	Confident	79.3	Confident	167 Å²	167	80.9 Å²	80.9	78%	0.78	44%	0.439	S	S	*	.	H	α-helix	trans	-66.8	-43.3	174.5	-64.5	179.7	173.7	0	0	112.2	S654 T658 H659 L660	S654-E656 VanDerWaalsContact C-N 3.26Å; S654-E656 PolarHBondContact O-N 2.72Å; E656-T658 VanDerWaalsContact C-N 3.33Å; E656-T658 PolarHBondContact O-N 3.35Å; E656-H659 PolarHBondContact O-N 2.96Å; E656-L660 WeakPolarHBondContact O-CB 3.39Å; E656-L660 PolarHBondContact O-N 3.29Å
657	G	78.1	Confident	79.1	Confident	5 Å²	5	79.1 Å²	79.1	5%	0.052	44%	0.44	C	S	.	.	H	α-helix	trans	-65	-35.2	176.5	0	0	0	0	0	112.6	S654 R661	S654-G657 PolarHBondContact O-N 2.9Å; S654-G657 PolarHBondContact OG-N 2.99Å; G657-R661 WeakPolarHBondContact O-CB 3.29Å; G657-R661 WeakPolarHBondContact O-CG 3.29Å; G657-R661 PolarHBondContact O-N 3.27Å
658	T	77.2	Confident	79.1	Confident	65 Å²	65	78.5 Å²	78.5	40%	0.399	44%	0.437	S	S	.	.	H	α-helix	trans	-69.4	-41.8	175.5	-58	0	0	0	0	111.7	S654 A655 E656 R661 A662	S654-T658 WeakPolarHBondContact O-CB 3.49Å; S654-T658 PolarHBondContact O-N 3.34Å; S654-T658 PolarHBondContact O-OG1 2.95Å; A655-T658 PolarHBondContact O-N 3.02Å; E656-T658 VanDerWaalsContact C-N 3.33Å; E656-T658 PolarHBondContact O-N 3.35Å; T658-R661 PolarHBondContact OG1-NH2 3.07Å; T658-A662 WeakPolarHBondContact O-CB 3.28Å; T658-A662 PolarHBondContact O-N 3.43Å; T658-A662 VanDerWaalsContact O-N 3.15Å
659	H	76	Confident	79.2	Confident	86 Å²	86	77.8 Å²	77.8	40%	0.398	43%	0.434	S	S	.	.	H	α-helix	trans	-63.1	-43.9	174.2	-166.8	-93.6	0	0	0	111.5	A655 E656 A662 R663 E728	A655-H659 PolarHBondContact O-N 3.44Å; A655-H659 VanDerWaalsContact O-N 3.07Å; E656-H659 PolarHBondContact O-N 2.96Å; H659-A662 PolarHBondContact O-N 3.29Å; H659-R663 WeakPolarHBondContact O-CB 3.45Å; H659-R663 PolarHBondContact O-N 3.43Å; H659-E728 IonicContact CE1-OE2 3.19Å; H659-E728 IonicContact NE2-OE2 3.89Å; H659-E728 PolarHBondContact NE2-OE2 3.39Å
660	L	75.9	Confident	79.4	Confident	77 Å²	77	76.4 Å²	76.4	40%	0.403	42%	0.416	S	S	.	.	H	α-helix	trans	-67.5	-43.5	179.4	-170.5	61.5	0	0	0	112.8	L651 E656 A662 R663 M664	L651-L660 HydrophobicContact CD1-CD2 4.41Å; L651-L660 HydrophobicContact CD1-CG 4.48Å; L651-L660 HydrophobicContact CD2-CD2 3.69Å; E656-L660 WeakPolarHBondContact O-CB 3.39Å; E656-L660 PolarHBondContact O-N 3.29Å; L660-A662 VanDerWaalsContact C-N 3.33Å; L660-A662 PolarHBondContact O-N 2.9Å; L660-R663 PolarHBondContact O-N 3.16Å; L660-M664 HydrophobicContact CG-SD 4.47Å; L660-M664 WeakPolarHBondContact O-CG 3.46Å; L660-M664 PolarHBondContact O-N 3.49Å
661	R	77.9	Confident	79.5	Confident	74 Å²	74	69.3 Å²	69.3	28%	0.279	39%	0.385	S	S	.	.	H	α-helix	trans	-57.3	-47.3	175.2	-77.3	-171.9	-65.6	161.8	-0.4	111.6	L648 L651 G652 G657 T658 R663 M664 Q665	L648-R661 HydrophobicContact CD2-CB 3.86Å; L648-R661 HydrophobicContact CD2-CG 3.58Å; L648-R661 WeakPolarHBondContact O-CD 3.38Å; L651-R661 HydrophobicContact CB-CG 3.99Å; L651-R661 HydrophobicContact CD1-CG 3.78Å; G652-R661 PolarHBondContact O-NE 3.39Å; G657-R661 WeakPolarHBondContact O-CB 3.29Å; G657-R661 WeakPolarHBondContact O-CG 3.29Å; G657-R661 PolarHBondContact O-N 3.27Å; T658-R661 PolarHBondContact OG1-NH2 3.07Å; R661-R663 VanDerWaalsContact C-N 3.3Å; R661-R663 PolarHBondContact O-N 3.16Å; R661-M664 PolarHBondContact O-N 2.83Å; R661-Q665 WeakPolarHBondContact O-CG 3.33Å; R661-Q665 PolarHBondContact O-N 3.17Å
662	A	72.9	Confident	79.9	Confident	28 Å²	28	67.5 Å²	67.5	23%	0.231	38%	0.376	C	S	.	.	H	α-helix	trans	-72.2	-27.2	-178.2	0	0	0	0	0	112.1	T658 H659 L660 Q665 S666 M725	T658-A662 WeakPolarHBondContact O-CB 3.28Å; T658-A662 PolarHBondContact O-N 3.43Å; T658-A662 VanDerWaalsContact O-N 3.15Å; H659-A662 PolarHBondContact O-N 3.29Å; L660-A662 VanDerWaalsContact C-N 3.33Å; L660-A662 PolarHBondContact O-N 2.9Å; A662-Q665 PolarHBondContact O-N 3.39Å; A662-S666 WeakPolarHBondContact O-CB 3.49Å; A662-S666 PolarHBondContact O-N 3.43Å; A662-S666 VanDerWaalsContact O-N 3.12Å; A662-M725 HydrophobicContact CB-CE 3.33Å; A662-M725 HydrophobicContact CB-SD 3.11Å; A662-M725 WeakPolarHBondContact CB-SD 3.46Å; A662-M725 WeakPolarHBondContact O-CE 3.44Å
663	R	75.9	Confident	80.4	Confident	171 Å²	171	66 Å²	66	65%	0.645	36%	0.361	S	S	*	.	H	α-helix	trans	-69.9	-37.4	169.6	-173.9	178.8	179.7	178.8	0.7	112.4	H659 L660 R661 Q665 S666	H659-R663 WeakPolarHBondContact O-CB 3.45Å; H659-R663 PolarHBondContact O-N 3.43Å; L660-R663 PolarHBondContact O-N 3.16Å; R661-R663 VanDerWaalsContact C-N 3.3Å; R661-R663 PolarHBondContact O-N 3.16Å; R663-Q665 VanDerWaalsContact C-N 3.27Å; R663-Q665 PolarHBondContact O-N 2.97Å; R663-S666 PolarHBondContact O-N 3.01Å; R663-S666 PolarHBondContact O-OG 3.24Å
664	M	74.9	Confident	80.9	Confident	103 Å²	103	61.6 Å²	61.6	51%	0.507	33%	0.331	S	S	.	.	H	α-helix	trans	-66.8	-30.7	174.5	-69.9	178	75.6	0	0	111.9	V647 L651 L660 R661	V647-M664 HydrophobicContact CG1-CE 3.98Å; L651-M664 HydrophobicContact CD1-SD 3.79Å; L660-M664 HydrophobicContact CG-SD 4.47Å; L660-M664 WeakPolarHBondContact O-CG 3.46Å; L660-M664 PolarHBondContact O-N 3.49Å; R661-M664 PolarHBondContact O-N 2.83Å
665	Q	76.6	Confident	81.1	Confident	134 Å²	134	58.7 Å²	58.7	63%	0.626	31%	0.311	S	S	*	.	H	α-helix	trans	-87.4	-8.5	178.3	-68.1	178	-19.3	0	0	114.2	R661 A662 R663	R661-Q665 WeakPolarHBondContact O-CG 3.33Å; R661-Q665 PolarHBondContact O-N 3.17Å; A662-Q665 PolarHBondContact O-N 3.39Å; R663-Q665 VanDerWaalsContact C-N 3.27Å; R663-Q665 PolarHBondContact O-N 2.97Å
666	S	80.8	Confident	81.7	Confident	15 Å²	15	54.4 Å²	54.4	11%	0.105	28%	0.275	C	S	.	.			trans	-89	3.2	-175.3	67.8	0	0	0	0	115.1	A662 R663 C668 L669 L670	A662-S666 WeakPolarHBondContact O-CB 3.49Å; A662-S666 PolarHBondContact O-N 3.43Å; A662-S666 VanDerWaalsContact O-N 3.12Å; R663-S666 PolarHBondContact O-N 3.01Å; R663-S666 PolarHBondContact O-OG 3.24Å; S666-C668 PolarHBondContact O-N 3.2Å; S666-L669 WeakPolarHBondContact O-CB 3.36Å; S666-L669 PolarHBondContact O-N 3.43Å; S666-L670 WeakPolarHBondContact O-CG 3.48Å; S666-L670 PolarHBondContact O-N 3.31Å
667	A	80.9	Confident	82.3	Confident	52 Å²	52	48 Å²	48	43%	0.43	25%	0.245	S	C	.	.	H	α-helix	trans	-59.5	-41.5	-175.8	0	0	0	0	0	113.7	S671 L744	A667-S671 PolarHBondContact O-N 2.94Å; A667-S671 VanDerWaalsContact O-N 3.13Å; A667-L744 HydrophobicContact CB-CD2 4.24Å
668	C	85.1	Confident	82.7	Confident	42 Å²	42	48 Å²	48	28%	0.284	24%	0.244	S	C	.	.	H	α-helix	trans	-65.3	-48.3	174.7	-168.1	0	0	0	0	110.9	S666 L670 S671 D672	S666-C668 PolarHBondContact O-N 3.2Å; C668-L670 VanDerWaalsContact C-N 3.3Å; C668-L670 PolarHBondContact O-N 3.49Å; C668-S671 PolarHBondContact O-N 3.35Å; C668-S671 VanDerWaalsContact O-N 3.11Å; C668-D672 VanDerWaalsContact O-CG 3.28Å; C668-D672 PolarHBondContact O-N 3.09Å; C668-D672 PolarHBondContact SG-OD2 3.12Å
669	L	86.8	Confident	83.1	Confident	20 Å²	20	44.9 Å²	44.9	11%	0.105	23%	0.225	C	C	.	.	H	α-helix	trans	-57.1	-43.5	179.1	-176.3	66.9	0	0	0	111.9	S666 D672 M673 F688 Y692 W726	S666-L669 WeakPolarHBondContact O-CB 3.36Å; S666-L669 PolarHBondContact O-N 3.43Å; L669-D672 PolarHBondContact O-N 3.26Å; L669-M673 HydrophobicContact CD1-CE 3.9Å; L669-M673 HydrophobicContact CD2-CE 4.09Å; L669-M673 HydrophobicContact CG-CE 3.83Å; L669-M673 HydrophobicContact CG-SD 4.25Å; L669-M673 WeakPolarHBondContact O-CB 3.17Å; L669-M673 VanDerWaalsContact O-CG 3.22Å; L669-M673 WeakPolarHBondContact O-CG 3.34Å; L669-M673 PolarHBondContact O-N 3.18Å; L669-F688 HydrophobicContact CD1-CE1 4.09Å; L669-F688 HydrophobicContact CD1-CZ 4.1Å; L669-Y692 HydrophobicContact CD1-CD1 4.18Å; L669-Y692 HydrophobicContact CD1-CE1 3.62Å; L669-W726 HydrophobicContact CD1-CD2 4.44Å; L669-W726 HydrophobicContact CD1-CE3 4.36Å; L669-W726 HydrophobicContact CD1-CH2 4.16Å; L669-W726 HydrophobicContact CD1-CZ2 4.19Å; L669-W726 HydrophobicContact CD1-CZ3 4.23Å; L669-W726 HydrophobicContact CD2-CD2 4.09Å; L669-W726 HydrophobicContact CD2-CG 4.2Å; L669-W726 HydrophobicContact CD2-CZ2 4.48Å
670	L	87	Confident	83.7	Confident	47 Å²	47	40.9 Å²	40.9	25%	0.246	21%	0.207	C	C	.	.	H	α-helix	trans	-62.1	-48.5	175.7	-77.1	169.5	0	0	0	111.4	S666 C668 D672 M673 E674 A729	S666-L670 WeakPolarHBondContact O-CG 3.48Å; S666-L670 PolarHBondContact O-N 3.31Å; C668-L670 VanDerWaalsContact C-N 3.3Å; C668-L670 PolarHBondContact O-N 3.49Å; L670-D672 VanDerWaalsContact C-N 3.29Å; L670-D672 PolarHBondContact O-N 2.71Å; L670-M673 PolarHBondContact O-N 2.85Å; L670-E674 VanDerWaalsContact O-CG 3.31Å; L670-E674 WeakPolarHBondContact O-CG 3.29Å; L670-E674 PolarHBondContact O-N 2.8Å; L670-A729 HydrophobicContact CD2-CB 3.61Å; L670-A729 VanDerWaalsContact CD2-O 3.32Å; L670-A729 WeakPolarHBondContact CD2-O 3.46Å; L670-A729 HydrophobicContact CG-CB 4.24Å
671	S	88.1	Confident	84.1	Confident	6 Å²	6	38.5 Å²	38.5	4%	0.042	20%	0.196	C	C	.	.	H	α-helix	trans	-60.1	-37.9	177.6	177.5	0	0	0	0	112.5	Q631 A667 C668 E674 S675 Q741	Q631-S671 PolarHBondContact NE2-OG 3.27Å; A667-S671 PolarHBondContact O-N 2.94Å; A667-S671 VanDerWaalsContact O-N 3.13Å; C668-S671 PolarHBondContact O-N 3.35Å; C668-S671 VanDerWaalsContact O-N 3.11Å; S671-E674 PolarHBondContact O-N 3.41Å; S671-S675 WeakPolarHBondContact O-CB 3.38Å; S671-S675 PolarHBondContact O-N 3.01Å; S671-S675 PolarHBondContact O-OG 2.94Å; S671-Q741 PolarHBondContact O-NE2 3.44Å; S671-Q741 VanDerWaalsContact O-NE2 3.12Å; S671-Q741 PolarHBondContact O-OE1 3.1Å; S671-Q741 PolarHBondContact OG-OE1 3.2Å
672	D	87.9	Confident	84.2	Confident	9 Å²	9	37.7 Å²	37.7	5%	0.048	21%	0.211	C	C	.	.	H	α-helix	trans	-70.3	-40.9	177.5	-67	-31.3	0	0	0	111.9	T630 C668 L669 L670 S675 F676 F688 Y692	T630-D672 VanDerWaalsContact CB-OD1 3.25Å; T630-D672 WeakPolarHBondContact CB-OD1 3.38Å; T630-D672 HydrophobicContact CG2-CB 4.41Å; T630-D672 WeakPolarHBondContact CG2-OD1 3.48Å; C668-D672 VanDerWaalsContact O-CG 3.28Å; C668-D672 PolarHBondContact O-N 3.09Å; C668-D672 PolarHBondContact SG-OD2 3.12Å; L669-D672 PolarHBondContact O-N 3.26Å; L670-D672 VanDerWaalsContact C-N 3.29Å; L670-D672 PolarHBondContact O-N 2.71Å; D672-S675 PolarHBondContact O-N 3.14Å; D672-F676 VanDerWaalsContact O-CB 3.32Å; D672-F676 WeakPolarHBondContact O-CB 3.27Å; D672-F676 PolarHBondContact O-N 2.92Å; D672-F688 HydrophobicContact CB-CE2 4.43Å; D672-F688 HydrophobicContact CB-CZ 4.47Å; D672-Y692 HydrophobicContact CB-CD2 4.35Å; D672-Y692 HydrophobicContact CB-CE2 3.83Å; D672-Y692 VanDerWaalsContact OD2-CE2 3.31Å; D672-Y692 WeakPolarHBondContact OD2-CE2 2.98Å; D672-Y692 PolarHBondContact OD2-OH 3.16Å
673	M	89.4	Confident	84.8	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.2	-41.6	173.6	-72.2	176.8	171.2	0	0	112	L669 L670 F676 K677 L685 F688 W726 A729 W730 A733	L669-M673 HydrophobicContact CD1-CE 3.9Å; L669-M673 HydrophobicContact CD2-CE 4.09Å; L669-M673 HydrophobicContact CG-CE 3.83Å; L669-M673 HydrophobicContact CG-SD 4.25Å; L669-M673 WeakPolarHBondContact O-CB 3.17Å; L669-M673 VanDerWaalsContact O-CG 3.22Å; L669-M673 WeakPolarHBondContact O-CG 3.34Å; L669-M673 PolarHBondContact O-N 3.18Å; L670-M673 PolarHBondContact O-N 2.85Å; M673-F676 PolarHBondContact O-N 3.33Å; M673-K677 WeakPolarHBondContact O-CG 3.38Å; M673-K677 PolarHBondContact O-N 2.76Å; M673-L685 HydrophobicContact CE-CD1 4.33Å; M673-F688 HydrophobicContact CB-CE2 4.3Å; M673-F688 HydrophobicContact CB-CZ 4.43Å; M673-F688 HydrophobicContact CE-CD1 4.02Å; M673-F688 HydrophobicContact CE-CE1 3.56Å; M673-F688 HydrophobicContact CE-CZ 4.19Å; M673-F688 HydrophobicContact CG-CD1 4.2Å; M673-F688 HydrophobicContact CG-CD2 4.23Å; M673-F688 HydrophobicContact CG-CE1 3.69Å; M673-F688 HydrophobicContact CG-CE2 3.69Å; M673-F688 HydrophobicContact CG-CG 4.46Å; M673-F688 HydrophobicContact CG-CZ 3.41Å; M673-F688 VanDerWaalsContact CG-CZ 3.41Å; M673-W726 HydrophobicContact CE-CB 4.4Å; M673-W726 HydrophobicContact CE-CD2 4.46Å; M673-W726 HydrophobicContact CE-CE3 4.12Å; M673-A729 HydrophobicContact CE-CB 4.4Å; M673-A729 HydrophobicContact SD-CB 3.86Å; M673-W730 HydrophobicContact CB-CE3 4.04Å; M673-W730 HydrophobicContact CB-CZ3 4.28Å; M673-W730 HydrophobicContact CE-CB 4.36Å; M673-W730 HydrophobicContact CE-CE3 4.45Å; M673-W730 HydrophobicContact CG-CE3 3.81Å; M673-W730 HydrophobicContact CG-CZ3 4.24Å; M673-W730 HydrophobicContact SD-CB 4.06Å; M673-W730 HydrophobicContact SD-CE3 4.06Å; M673-W730 PolarHBondContact SD-N 3.24Å; M673-A733 HydrophobicContact CB-CB 3.78Å
674	E	89.2	Confident	85.3	Confident	38 Å²	38	30.9 Å²	30.9	18%	0.178	19%	0.186	C	C	.	.	H	α-helix	trans	-62.9	-43.9	175.6	-70.2	-169.4	149.8	0	0	111.8	L670 S671 K677 A678 A733 R734 I736 Q741	L670-E674 VanDerWaalsContact O-CG 3.31Å; L670-E674 WeakPolarHBondContact O-CG 3.29Å; L670-E674 PolarHBondContact O-N 2.8Å; S671-E674 PolarHBondContact O-N 3.41Å; E674-K677 PolarHBondContact O-N 2.84Å; E674-A678 PolarHBondContact O-N 3.4Å; E674-A678 VanDerWaalsContact O-N 3.14Å; E674-A733 HydrophobicContact CG-CB 3.92Å; E674-R734 VanDerWaalsContact CA-O 3.22Å; E674-R734 WeakPolarHBondContact CA-O 3.32Å; E674-R734 VanDerWaalsContact CB-O 3.3Å; E674-R734 WeakPolarHBondContact CB-O 3.5Å; E674-R734 VanDerWaalsContact CG-O 3.3Å; E674-R734 WeakPolarHBondContact CG-O 3.42Å; E674-R734 PolarHBondContact OE1-N 2.9Å; E674-I736 CarbonylContact C-O 3.55Å; E674-I736 VanDerWaalsContact C-O 3.31Å; E674-I736 VanDerWaalsContact O-O 3.09Å; E674-Q741 VanDerWaalsContact CB-NE2 3.28Å
675	S	88.7	Confident	85.8	Confident	3 Å²	3	26.6 Å²	26.6	2%	0.021	17%	0.165	C	C	.	.	H	α-helix	trans	-64	-42.1	178	-57.9	0	0	0	0	111.3	P628 V629 S671 D672 A678 A679 Q741	P628-S675 WeakPolarHBondContact CB-O 3.4Å; V629-S675 WeakPolarHBondContact O-CB 3.44Å; S671-S675 WeakPolarHBondContact O-CB 3.38Å; S671-S675 PolarHBondContact O-N 3.01Å; S671-S675 PolarHBondContact O-OG 2.94Å; D672-S675 PolarHBondContact O-N 3.14Å; S675-A678 PolarHBondContact O-N 3.2Å; S675-A679 PolarHBondContact O-N 2.99Å; S675-Q741 VanDerWaalsContact N-NE2 3.13Å; S675-Q741 PolarHBondContact OG-NE2 3.08Å
676	F	88.9	Confident	86.2	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-65.1	-44.5	179.1	-173.6	-96	0	0	0	112.5	L625 P628 D672 M673 A678 A679 N680 C683 D687 F688 W691 W730	L625-F676 HydrophobicContact CD1-CZ 4.16Å; L625-F676 HydrophobicContact CD2-CE2 4.24Å; L625-F676 HydrophobicContact CG-CE2 4.46Å; L625-F676 HydrophobicContact CG-CZ 4.36Å; P628-F676 HydrophobicContact CG-CB 4.14Å; P628-F676 HydrophobicContact CG-CD2 3.99Å; D672-F676 VanDerWaalsContact O-CB 3.32Å; D672-F676 WeakPolarHBondContact O-CB 3.27Å; D672-F676 PolarHBondContact O-N 2.92Å; M673-F676 PolarHBondContact O-N 3.33Å; F676-A678 VanDerWaalsContact C-N 3.28Å; F676-A678 PolarHBondContact O-N 3.01Å; F676-A679 PolarHBondContact O-N 2.81Å; F676-N680 WeakPolarHBondContact CE2-ND2 3.34Å; F676-N680 WeakPolarHBondContact O-CB 3.31Å; F676-N680 PolarHBondContact O-N 3.3Å; F676-N680 PolarHBondContact O-ND2 3.34Å; F676-C683 HydrophobicContact CD1-CB 4.28Å; F676-C683 HydrophobicContact CE1-CB 3.7Å; F676-D687 HydrophobicContact CE1-CB 4.21Å; F676-D687 HydrophobicContact CZ-CB 4.19Å; F676-D687 WeakPolarHBondContact CZ-O 3.38Å; F676-F688 HydrophobicContact CB-CD2 3.7Å; F676-F688 HydrophobicContact CB-CE2 4.09Å; F676-F688 HydrophobicContact CD1-CB 3.88Å; F676-F688 AromaticContact CD1-CD2 3.8Å; F676-F688 HydrophobicContact CD1-CD2 3.8Å; F676-F688 HydrophobicContact CD1-CG 4.35Å; F676-F688 HydrophobicContact CD2-CD2 4.14Å; F676-F688 HydrophobicContact CE1-CB 3.79Å; F676-F688 HydrophobicContact CE1-CD2 4.43Å; F676-F688 HydrophobicContact CG-CB 4.49Å; F676-F688 AromaticContact CG-CD2 3.63Å; F676-F688 HydrophobicContact CG-CD2 3.63Å; F676-F688 HydrophobicContact CG-CE2 4.43Å; F676-F688 HydrophobicContact CZ-CB 4.35Å; F676-W691 HydrophobicContact CB-CZ3 4.16Å; F676-W691 AromaticContact CD2-CD2 3.88Å; F676-W691 HydrophobicContact CD2-CD2 3.88Å; F676-W691 AromaticContact CD2-CE3 3.28Å; F676-W691 HydrophobicContact CD2-CE3 3.28Å; F676-W691 HydrophobicContact CD2-CG 4.48Å; F676-W691 AromaticContact CD2-CZ3 3.7Å; F676-W691 HydrophobicContact CD2-CZ3 3.7Å; F676-W691 HydrophobicContact CE2-CB 3.96Å; F676-W691 AromaticContact CE2-CD2 3.94Å; F676-W691 HydrophobicContact CE2-CD2 3.94Å; F676-W691 AromaticContact CE2-CE3 3.68Å; F676-W691 HydrophobicContact CE2-CE3 3.68Å; F676-W691 HydrophobicContact CE2-CG 4.06Å; F676-W691 HydrophobicContact CG-CE3 4.13Å; F676-W691 HydrophobicContact CG-CZ3 4.28Å; F676-W730 AromaticContact CD1-CH2 3.92Å; F676-W730 HydrophobicContact CD1-CH2 3.92Å; F676-W730 HydrophobicContact CD1-CZ3 4.2Å; F676-W730 HydrophobicContact CE1-CH2 4.29Å
677	K	89.3	Confident	86.4	Confident	33 Å²	33	22.5 Å²	22.5	14%	0.143	14%	0.144	C	C	.	.	H	α-helix	trans	-61.2	-36.3	175	-73.6	-176.8	-179.7	-172.5	0	112.3	M673 E674 N680 W730 A733 V735	M673-K677 WeakPolarHBondContact O-CG 3.38Å; M673-K677 PolarHBondContact O-N 2.76Å; E674-K677 PolarHBondContact O-N 2.84Å; K677-N680 CarbonylContact O-C 3.52Å; K677-W730 VanDerWaalsContact CE-CE2 3.48Å; K677-W730 HydrophobicContact CG-CH2 3.83Å; K677-W730 HydrophobicContact CG-CZ2 4.18Å; K677-W730 HydrophobicContact CG-CZ3 4.19Å; K677-W730 PolarHBondContact NZ-O 2.98Å; K677-A733 HydrophobicContact CD-CB 4.48Å; K677-A733 PolarHBondContact NZ-O 3Å; K677-V735 HydrophobicContact CB-CG2 4.2Å
678	A	86.9	Confident	86.6	Confident	5 Å²	5	20 Å²	20	4%	0.041	12%	0.123	C	C	.	.	H	α-helix	trans	-70.5	-37.5	177.4	0	0	0	0	0	113.1	D607 E674 S675 F676 V735 P737	D607-A678 PolarHBondContact N-O 2.88Å; D607-A678 CarbonylContact O-C 2.95Å; D607-A678 VanDerWaalsContact O-C 3.29Å; E674-A678 PolarHBondContact O-N 3.4Å; E674-A678 VanDerWaalsContact O-N 3.14Å; S675-A678 PolarHBondContact O-N 3.2Å; F676-A678 VanDerWaalsContact C-N 3.28Å; F676-A678 PolarHBondContact O-N 3.01Å; A678-V735 HydrophobicContact CB-CG1 4.23Å; A678-P737 HydrophobicContact CB-CB 4.12Å
679	A	86.4	Confident	86.7	Confident	0 Å²	0	18 Å²	18	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-74.8	-33	177.3	0	0	0	0	0	112.7	D607 R609 P628 S675 F676 P681	D607-A679 WeakPolarHBondContact O-CA 3.43Å; D607-A679 PolarHBondContact O-N 3.46Å; R609-A679 HydrophobicContact CG-CB 4.14Å; R609-A679 PolarHBondContact NE-O 3.34Å; R609-A679 PolarHBondContact NH2-O 2.78Å; P628-A679 HydrophobicContact CB-CB 3.71Å; S675-A679 PolarHBondContact O-N 2.99Å; F676-A679 PolarHBondContact O-N 2.81Å; A679-P681 WeakPolarHBondContact O-CD 3.43Å
680	N	87.9	Confident	86.6	Confident	1 Å²	1	18.8 Å²	18.8	1%	0.005	11%	0.111	C	C	.	.	S	Bend	trans	-123.4	82.8	-174.8	-59.9	-60.7	0	0	0	111.8	L618 Y626 F676 K677 G682 C683	L618-N680 HydrophobicContact CD1-CB 4.48Å; L618-N680 HydrophobicContact CD2-CB 4.24Å; Y626-N680 PolarHBondContact N-OD1 2.68Å; Y626-N680 PolarHBondContact O-ND2 2.98Å; Y626-N680 PolarHBondContact O-OD1 3.35Å; F676-N680 WeakPolarHBondContact CE2-ND2 3.34Å; F676-N680 WeakPolarHBondContact O-CB 3.31Å; F676-N680 PolarHBondContact O-N 3.3Å; F676-N680 PolarHBondContact O-ND2 3.34Å; K677-N680 CarbonylContact O-C 3.52Å; N680-G682 PolarHBondContact O-N 3.07Å; N680-C683 HydrophobicContact CB-CB 4.01Å; N680-C683 WeakPolarHBondContact O-CB 3.04Å; N680-C683 PolarHBondContact O-N 3.4Å; N680-C683 PolarHBondContact O-SG 2.63Å
681	P	83.9	Confident	86.5	Confident	28 Å²	28	18.4 Å²	18.4	18%	0.182	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	130	174.8	-23.1	33.9	0	0	0	111.8	L604 A606 A679	L604-P681 HydrophobicContact CB-CB 3.95Å; L604-P681 HydrophobicContact CB-CG 4.33Å; L604-P681 WeakPolarHBondContact O-CG 3.47Å; A606-P681 HydrophobicContact CB-CG 3.75Å; A679-P681 WeakPolarHBondContact O-CD 3.43Å
682	G	80.4	Confident	86.3	Confident	57 Å²	57	22.3 Å²	22.3	59%	0.588	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.8	11.4	-179.6	0	0	0	0	0	115.2	N680	N680-G682 PolarHBondContact O-N 3.07Å
683	C	84.9	Confident	86.2	Confident	19 Å²	19	23 Å²	23	13%	0.128	13%	0.127	C	C	.	.			trans	-69.8	150.3	174.3	65.1	0	0	0	0	113.2	L618 F676 N680 D687	L618-C683 HydrophobicContact CD2-CB 4.08Å; F676-C683 HydrophobicContact CD1-CB 4.28Å; F676-C683 HydrophobicContact CE1-CB 3.7Å; N680-C683 HydrophobicContact CB-CB 4.01Å; N680-C683 WeakPolarHBondContact O-CB 3.04Å; N680-C683 PolarHBondContact O-N 3.4Å; N680-C683 PolarHBondContact O-SG 2.63Å; C683-D687 HydrophobicContact CB-CB 4.28Å
684	V	87.4	Confident	85.7	Confident	36 Å²	36	26.6 Å²	26.6	22%	0.218	15%	0.15	C	C	.	.			trans	-108.6	169.4	170.6	-64.5	0	0	0	0	111.3	L619 E686 D687 F688 W730	L619-V684 HydrophobicContact CD1-CG2 4.26Å; V684-E686 VanDerWaalsContact CB-OE2 3.28Å; V684-E686 WeakPolarHBondContact CB-OE2 3.44Å; V684-E686 HydrophobicContact CG2-CB 4.11Å; V684-E686 WeakPolarHBondContact CG2-OE2 3.24Å; V684-E686 PolarHBondContact O-N 2.79Å; V684-D687 HydrophobicContact CG2-CB 4.46Å; V684-D687 WeakPolarHBondContact CG2-OD2 3.41Å; V684-D687 PolarHBondContact N-OD2 3.31Å; V684-D687 WeakPolarHBondContact O-CB 3.12Å; V684-D687 PolarHBondContact O-N 3.46Å; V684-F688 PolarHBondContact O-N 3.17Å; V684-W730 VanDerWaalsContact C-CZ2 3.41Å
685	L	84.9	Confident	85.2	Confident	13 Å²	13	36.1 Å²	36.1	7%	0.068	18%	0.184	C	C	.	.	H	α-helix	trans	-58.6	-35.5	-178.5	176.4	59.8	0	0	0	111.4	M673 D687 F688 V689 L715 V727 W730	M673-L685 HydrophobicContact CE-CD1 4.33Å; L685-D687 VanDerWaalsContact C-N 3.3Å; L685-D687 PolarHBondContact O-N 2.74Å; L685-F688 HydrophobicContact CD1-CD1 4.29Å; L685-F688 WeakPolarHBondContact O-CB 3.5Å; L685-F688 PolarHBondContact O-N 3.08Å; L685-F688 VanDerWaalsContact O-N 3.12Å; L685-V689 HydrophobicContact CD1-CG2 4.23Å; L685-V689 HydrophobicContact CG-CG2 4.32Å; L685-V689 WeakPolarHBondContact O-CG2 3.41Å; L685-V689 PolarHBondContact O-N 2.75Å; L685-L715 HydrophobicContact CD2-CD1 4.49Å; L685-V727 HydrophobicContact CD2-CG2 3.83Å; L685-W730 HydrophobicContact CB-CD2 4.09Å; L685-W730 HydrophobicContact CB-CG 4.07Å; L685-W730 HydrophobicContact CD1-CB 3.89Å; L685-W730 HydrophobicContact CD1-CD2 3.83Å; L685-W730 HydrophobicContact CD1-CE3 3.94Å; L685-W730 HydrophobicContact CD1-CG 3.84Å; L685-W730 HydrophobicContact CG-CG 4.4Å
686	E	85.3	Confident	84.8	Confident	63 Å²	63	37.4 Å²	37.4	29%	0.294	19%	0.191	S	C	.	.	H	α-helix	trans	-61.6	-37.4	176.3	-61.8	80.8	-179.1	0	0	111.9	L619 V684 F688 V689 R690 Y697 L715	L619-E686 HydrophobicContact CD1-CB 3.46Å; L619-E686 VanDerWaalsContact CD1-CB 3.46Å; L619-E686 HydrophobicContact CD1-CG 4.49Å; V684-E686 VanDerWaalsContact CB-OE2 3.28Å; V684-E686 WeakPolarHBondContact CB-OE2 3.44Å; V684-E686 HydrophobicContact CG2-CB 4.11Å; V684-E686 WeakPolarHBondContact CG2-OE2 3.24Å; V684-E686 PolarHBondContact O-N 2.79Å; E686-F688 VanDerWaalsContact C-N 3.32Å; E686-V689 PolarHBondContact O-N 3.21Å; E686-R690 WeakPolarHBondContact O-CB 3.29Å; E686-R690 WeakPolarHBondContact O-CD 3.47Å; E686-R690 WeakPolarHBondContact O-CG 3.44Å; E686-R690 PolarHBondContact O-N 3.45Å; E686-Y697 HydrophobicContact CB-CE2 4.12Å; E686-L715 HydrophobicContact CG-CD1 4.19Å; E686-L715 HydrophobicContact CG-CD2 4.07Å; E686-L715 HydrophobicContact CG-CG 3.93Å
687	D	85	Confident	84.4	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-66.9	-36	174.8	-69.9	-46.4	0	0	0	111.5	L618 L619 L625 F676 C683 V684 L685 R690	L618-D687 HydrophobicContact CD2-CB 3.96Å; L619-D687 VanDerWaalsContact CG-OD1 3.24Å; L619-D687 WeakPolarHBondContact CG-OD1 3.38Å; L619-D687 PolarHBondContact N-OD1 3.4Å; L619-D687 PolarHBondContact N-OD2 3.27Å; L625-D687 HydrophobicContact CD1-CB 4.43Å; F676-D687 HydrophobicContact CE1-CB 4.21Å; F676-D687 HydrophobicContact CZ-CB 4.19Å; F676-D687 WeakPolarHBondContact CZ-O 3.38Å; C683-D687 HydrophobicContact CB-CB 4.28Å; V684-D687 HydrophobicContact CG2-CB 4.46Å; V684-D687 WeakPolarHBondContact CG2-OD2 3.41Å; V684-D687 PolarHBondContact N-OD2 3.31Å; V684-D687 WeakPolarHBondContact O-CB 3.12Å; V684-D687 PolarHBondContact O-N 3.46Å; L685-D687 VanDerWaalsContact C-N 3.3Å; L685-D687 PolarHBondContact O-N 2.74Å; D687-R690 IonicContact OD1-NH1 2.67Å; D687-R690 PolarHBondContact OD1-NH1 2.93Å
688	F	86.1	Confident	83.9	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-68.6	-44.3	174.7	175.9	-96.8	0	0	0	111.8	L669 D672 M673 F676 V684 L685 E686 R690 W691 Y692 W726 W730	L669-F688 HydrophobicContact CD1-CE1 4.09Å; L669-F688 HydrophobicContact CD1-CZ 4.1Å; D672-F688 HydrophobicContact CB-CE2 4.43Å; D672-F688 HydrophobicContact CB-CZ 4.47Å; M673-F688 HydrophobicContact CB-CE2 4.3Å; M673-F688 HydrophobicContact CB-CZ 4.43Å; M673-F688 HydrophobicContact CE-CD1 4.02Å; M673-F688 HydrophobicContact CE-CE1 3.56Å; M673-F688 HydrophobicContact CE-CZ 4.19Å; M673-F688 HydrophobicContact CG-CD1 4.2Å; M673-F688 HydrophobicContact CG-CD2 4.23Å; M673-F688 HydrophobicContact CG-CE1 3.69Å; M673-F688 HydrophobicContact CG-CE2 3.69Å; M673-F688 HydrophobicContact CG-CG 4.46Å; M673-F688 HydrophobicContact CG-CZ 3.41Å; M673-F688 VanDerWaalsContact CG-CZ 3.41Å; F676-F688 HydrophobicContact CB-CD2 3.7Å; F676-F688 HydrophobicContact CB-CE2 4.09Å; F676-F688 HydrophobicContact CD1-CB 3.88Å; F676-F688 AromaticContact CD1-CD2 3.8Å; F676-F688 HydrophobicContact CD1-CD2 3.8Å; F676-F688 HydrophobicContact CD1-CG 4.35Å; F676-F688 HydrophobicContact CD2-CD2 4.14Å; F676-F688 HydrophobicContact CE1-CB 3.79Å; F676-F688 HydrophobicContact CE1-CD2 4.43Å; F676-F688 HydrophobicContact CG-CB 4.49Å; F676-F688 AromaticContact CG-CD2 3.63Å; F676-F688 HydrophobicContact CG-CD2 3.63Å; F676-F688 HydrophobicContact CG-CE2 4.43Å; F676-F688 HydrophobicContact CZ-CB 4.35Å; V684-F688 PolarHBondContact O-N 3.17Å; L685-F688 HydrophobicContact CD1-CD1 4.29Å; L685-F688 WeakPolarHBondContact O-CB 3.5Å; L685-F688 PolarHBondContact O-N 3.08Å; L685-F688 VanDerWaalsContact O-N 3.12Å; E686-F688 VanDerWaalsContact C-N 3.32Å; F688-R690 VanDerWaalsContact C-N 3.34Å; F688-R690 PolarHBondContact O-N 2.97Å; F688-W691 AromaticContact CD2-CE3 3.95Å; F688-W691 HydrophobicContact CD2-CE3 3.95Å; F688-W691 HydrophobicContact CD2-CZ3 4.02Å; F688-W691 HydrophobicContact CE2-CE3 4.01Å; F688-W691 AromaticContact CE2-CZ3 3.67Å; F688-W691 HydrophobicContact CE2-CZ3 3.67Å; F688-W691 PolarHBondContact O-N 3.04Å; F688-W691 VanDerWaalsContact O-N 3.11Å; F688-Y692 AromaticContact CE1-CD1 3.97Å; F688-Y692 HydrophobicContact CE1-CD1 3.97Å; F688-Y692 AromaticContact CE1-CG 3.85Å; F688-Y692 HydrophobicContact CE1-CG 3.85Å; F688-Y692 HydrophobicContact CE2-CD2 4.17Å; F688-Y692 HydrophobicContact CE2-CG 4.19Å; F688-Y692 AromaticContact CZ-CD1 3.95Å; F688-Y692 HydrophobicContact CZ-CD1 3.95Å; F688-Y692 AromaticContact CZ-CD2 3.76Å; F688-Y692 HydrophobicContact CZ-CD2 3.76Å; F688-Y692 HydrophobicContact CZ-CE2 4.35Å; F688-Y692 AromaticContact CZ-CG 3.53Å; F688-Y692 HydrophobicContact CZ-CG 3.53Å; F688-Y692 WeakPolarHBondContact O-CB 3.4Å; F688-Y692 PolarHBondContact O-N 3.42Å; F688-W726 HydrophobicContact CE1-CE3 4.26Å; F688-W726 AromaticContact CE1-CZ3 3.97Å; F688-W726 HydrophobicContact CE1-CZ3 3.97Å; F688-W730 HydrophobicContact CB-CE3 4.16Å; F688-W730 HydrophobicContact CB-CH2 3.77Å; F688-W730 HydrophobicContact CB-CZ3 3.4Å; F688-W730 VanDerWaalsContact CB-CZ3 3.4Å; F688-W730 HydrophobicContact CD1-CE3 4.47Å; F688-W730 HydrophobicContact CD1-CZ3 4.34Å; F688-W730 AromaticContact CD2-CZ3 3.88Å; F688-W730 HydrophobicContact CD2-CZ3 3.88Å; F688-W730 HydrophobicContact CG-CE3 4.19Å; F688-W730 HydrophobicContact CG-CH2 4.45Å; F688-W730 AromaticContact CG-CZ3 3.63Å; F688-W730 HydrophobicContact CG-CZ3 3.63Å
689	V	85.8	Confident	83.4	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63.8	-39.6	178.9	175.3	0	0	0	0	111.1	L685 E686 W691 Y692 S693 D696 L715 M719 W726	L685-V689 HydrophobicContact CD1-CG2 4.23Å; L685-V689 HydrophobicContact CG-CG2 4.32Å; L685-V689 WeakPolarHBondContact O-CG2 3.41Å; L685-V689 PolarHBondContact O-N 2.75Å; E686-V689 PolarHBondContact O-N 3.21Å; V689-W691 PolarHBondContact O-N 3.24Å; V689-W691 VanDerWaalsContact O-N 3.16Å; V689-Y692 PolarHBondContact O-N 3.43Å; V689-S693 CarbonylContact O-C 3.52Å; V689-S693 WeakPolarHBondContact O-CA 3.46Å; V689-S693 PolarHBondContact O-N 3.48Å; V689-D696 HydrophobicContact CG1-CB 3.85Å; V689-L715 HydrophobicContact CB-CD2 4.01Å; V689-L715 HydrophobicContact CG1-CD2 4.05Å; V689-L715 HydrophobicContact CG2-CD2 3.92Å; V689-M719 HydrophobicContact CB-SD 4.37Å; V689-M719 HydrophobicContact CG1-SD 3.77Å; V689-M719 HydrophobicContact CG2-CE 3.54Å; V689-M719 HydrophobicContact CG2-SD 3.62Å; V689-W726 HydrophobicContact CG2-CE3 4.46Å
690	R	85.1	Confident	82.5	Confident	36 Å²	36	51.2 Å²	51.2	14%	0.136	26%	0.259	C	S	.	.	H	α-helix	trans	-57.6	-28	174.2	-73.8	167	76.6	-150.7	5.1	113.7	M616 T617 E686 D687 F688 Y697	M616-R690 HydrophobicContact CE-CB 4.29Å; T617-R690 PolarHBondContact O-NH1 3.42Å; T617-R690 VanDerWaalsContact O-NH1 3.16Å; E686-R690 WeakPolarHBondContact O-CB 3.29Å; E686-R690 WeakPolarHBondContact O-CD 3.47Å; E686-R690 WeakPolarHBondContact O-CG 3.44Å; E686-R690 PolarHBondContact O-N 3.45Å; D687-R690 IonicContact OD1-NH1 2.67Å; D687-R690 PolarHBondContact OD1-NH1 2.93Å; F688-R690 VanDerWaalsContact C-N 3.34Å; F688-R690 PolarHBondContact O-N 2.97Å; R690-Y697 HydrophobicContact CG-CD1 3.6Å; R690-Y697 HydrophobicContact CG-CD2 3.72Å; R690-Y697 HydrophobicContact CG-CE1 3.76Å; R690-Y697 HydrophobicContact CG-CE2 3.91Å; R690-Y697 HydrophobicContact CG-CG 3.56Å
691	W	85.8	Confident	81.2	Confident	40 Å²	40	58.4 Å²	58.4	15%	0.152	29%	0.292	C	S	.	.	H	α-helix	trans	-93.5	-48.6	177.4	168.1	64.3	0	0	0	112.6	Y613 L625 V627 P628 T630 F676 F688 V689	Y613-W691 AromaticContact CD2-CD1 3.94Å; Y613-W691 AromaticContact CE2-CD1 3.9Å; L625-W691 HydrophobicContact CD2-CB 4.46Å; V627-W691 HydrophobicContact CG1-CZ2 4.29Å; P628-W691 HydrophobicContact CG-CE3 4.42Å; P628-W691 HydrophobicContact CG-CH2 3.3Å; P628-W691 HydrophobicContact CG-CZ2 3.58Å; P628-W691 HydrophobicContact CG-CZ3 3.76Å; T630-W691 HydrophobicContact CG2-CH2 3.77Å; T630-W691 HydrophobicContact CG2-CZ2 4.37Å; F676-W691 HydrophobicContact CB-CZ3 4.16Å; F676-W691 AromaticContact CD2-CD2 3.88Å; F676-W691 HydrophobicContact CD2-CD2 3.88Å; F676-W691 AromaticContact CD2-CE3 3.28Å; F676-W691 HydrophobicContact CD2-CE3 3.28Å; F676-W691 HydrophobicContact CD2-CG 4.48Å; F676-W691 AromaticContact CD2-CZ3 3.7Å; F676-W691 HydrophobicContact CD2-CZ3 3.7Å; F676-W691 HydrophobicContact CE2-CB 3.96Å; F676-W691 AromaticContact CE2-CD2 3.94Å; F676-W691 HydrophobicContact CE2-CD2 3.94Å; F676-W691 AromaticContact CE2-CE3 3.68Å; F676-W691 HydrophobicContact CE2-CE3 3.68Å; F676-W691 HydrophobicContact CE2-CG 4.06Å; F676-W691 HydrophobicContact CG-CE3 4.13Å; F676-W691 HydrophobicContact CG-CZ3 4.28Å; F688-W691 AromaticContact CD2-CE3 3.95Å; F688-W691 HydrophobicContact CD2-CE3 3.95Å; F688-W691 HydrophobicContact CD2-CZ3 4.02Å; F688-W691 HydrophobicContact CE2-CE3 4.01Å; F688-W691 AromaticContact CE2-CZ3 3.67Å; F688-W691 HydrophobicContact CE2-CZ3 3.67Å; F688-W691 PolarHBondContact O-N 3.04Å; F688-W691 VanDerWaalsContact O-N 3.11Å; V689-W691 PolarHBondContact O-N 3.24Å; V689-W691 VanDerWaalsContact O-N 3.16Å
692	Y	83.4	Confident	80	Confident	87 Å²	87	60.1 Å²	60.1	34%	0.341	30%	0.302	S	S	.	.	H	α-helix	trans	-88.4	-32.9	-168.9	-166.9	-91.7	0	0	0	113.6	L669 D672 F688 V689 W726	L669-Y692 HydrophobicContact CD1-CD1 4.18Å; L669-Y692 HydrophobicContact CD1-CE1 3.62Å; D672-Y692 HydrophobicContact CB-CD2 4.35Å; D672-Y692 HydrophobicContact CB-CE2 3.83Å; D672-Y692 VanDerWaalsContact OD2-CE2 3.31Å; D672-Y692 WeakPolarHBondContact OD2-CE2 2.98Å; D672-Y692 PolarHBondContact OD2-OH 3.16Å; F688-Y692 AromaticContact CE1-CD1 3.97Å; F688-Y692 HydrophobicContact CE1-CD1 3.97Å; F688-Y692 AromaticContact CE1-CG 3.85Å; F688-Y692 HydrophobicContact CE1-CG 3.85Å; F688-Y692 HydrophobicContact CE2-CD2 4.17Å; F688-Y692 HydrophobicContact CE2-CG 4.19Å; F688-Y692 AromaticContact CZ-CD1 3.95Å; F688-Y692 HydrophobicContact CZ-CD1 3.95Å; F688-Y692 AromaticContact CZ-CD2 3.76Å; F688-Y692 HydrophobicContact CZ-CD2 3.76Å; F688-Y692 HydrophobicContact CZ-CE2 4.35Å; F688-Y692 AromaticContact CZ-CG 3.53Å; F688-Y692 HydrophobicContact CZ-CG 3.53Å; F688-Y692 WeakPolarHBondContact O-CB 3.4Å; F688-Y692 PolarHBondContact O-N 3.42Å; V689-Y692 PolarHBondContact O-N 3.43Å; Y692-W726 AromaticContact CD1-CH2 3.67Å; Y692-W726 HydrophobicContact CD1-CH2 3.67Å; Y692-W726 AromaticContact CD1-CZ3 3.93Å; Y692-W726 HydrophobicContact CD1-CZ3 3.93Å; Y692-W726 AromaticContact CE1-CH2 3.9Å; Y692-W726 HydrophobicContact CE1-CH2 3.9Å; Y692-W726 HydrophobicContact CE1-CZ3 4.48Å
693	S	84.6	Confident	78.9	Confident	25 Å²	25	61.9 Å²	61.9	18%	0.175	30%	0.302	C	S	.	.			trans	-140.8	76.1	173	-168.5	0	0	0	0	111.4	V689 R695 D696	V689-S693 CarbonylContact O-C 3.52Å; V689-S693 WeakPolarHBondContact O-CA 3.46Å; V689-S693 PolarHBondContact O-N 3.48Å; S693-R695 PolarHBondContact O-N 2.99Å; S693-D696 WeakPolarHBondContact CB-OD2 3.24Å; S693-D696 PolarHBondContact O-N 3.23Å; S693-D696 PolarHBondContact OG-OD2 3.14Å
694	P	79.7	Confident	77.6	Confident	74 Å²	74	65 Å²	65	48%	0.481	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-59	-20.9	-176.9	-23.6	32.4	0	0	0	114.2	D696	P694-D696 VanDerWaalsContact C-N 3.29Å; P694-D696 PolarHBondContact O-N 3.41Å
695	R	78	Confident	76.2	Confident	238 Å²	238	73.2 Å²	73.2	90%	0.898	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-72.3	-20.8	176.4	-64.6	-176.6	178.7	-170.9	0	113.4	S693	S693-R695 PolarHBondContact O-N 2.99Å
696	D	80.6	Confident	74.9	Confident	31 Å²	31	82 Å²	82	17%	0.166	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-94.8	3.8	-179	-72.5	-55.4	0	0	0	113.2	V689 S693 P694 S716 M719	V689-D696 HydrophobicContact CG1-CB 3.85Å; S693-D696 WeakPolarHBondContact CB-OD2 3.24Å; S693-D696 PolarHBondContact O-N 3.23Å; S693-D696 PolarHBondContact OG-OD2 3.14Å; P694-D696 VanDerWaalsContact C-N 3.29Å; P694-D696 PolarHBondContact O-N 3.41Å; D696-S716 WeakPolarHBondContact O-CB 3.4Å; D696-S716 PolarHBondContact O-N 3.36Å; D696-S716 PolarHBondContact OD1-OG 3.08Å; D696-M719 HydrophobicContact CB-CG 4.25Å; D696-M719 HydrophobicContact CB-SD 3.78Å
697	Y	81.6	Confident	73.5	Confident	26 Å²	26	82 Å²	82	10%	0.102	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	114.5	172.1	-167.8	-104.5	0	0	0	109.5	E686 R690 E699 G713 L715	E686-Y697 HydrophobicContact CB-CE2 4.12Å; R690-Y697 HydrophobicContact CG-CD1 3.6Å; R690-Y697 HydrophobicContact CG-CD2 3.72Å; R690-Y697 HydrophobicContact CG-CE1 3.76Å; R690-Y697 HydrophobicContact CG-CE2 3.91Å; R690-Y697 HydrophobicContact CG-CG 3.56Å; Y697-E699 HydrophobicContact CD1-CG 3.86Å; Y697-E699 HydrophobicContact CE1-CG 3.73Å; Y697-G713 VanDerWaalsContact OH-CA 3.32Å; Y697-G713 WeakPolarHBondContact OH-CA 3.14Å; Y697-G713 PolarHBondContact OH-O 3.26Å; Y697-L715 HydrophobicContact CD2-CD2 4.49Å
698	V	79.1	Confident	71.7	Confident	67 Å²	67	84.7 Å²	84.7	41%	0.406	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	119.7	-177.5	-177.1	0	0	0	0	108.8	E700 G713 E714	V698-E700 HydrophobicContact CG1-CG 4.25Å; V698-G713 CarbonylContact O-C 3.53Å; V698-G713 VanDerWaalsContact O-CA 3.3Å; V698-G713 WeakPolarHBondContact O-CA 3.27Å; V698-E714 PolarHBondContact N-O 2.93Å; V698-E714 PolarHBondContact O-N 3.2Å
699	E	75.4	Confident	70.1	Confident	118 Å²	118	89.5 Å²	89.5	55%	0.551	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	113.2	176.1	-67.8	-177.9	174.8	0	0	109.5	Y697 I711	Y697-E699 HydrophobicContact CD1-CG 3.86Å; Y697-E699 HydrophobicContact CE1-CG 3.73Å; E699-I711 HydrophobicContact CB-CG2 3.78Å; E699-I711 HydrophobicContact CG-CG2 4.14Å
700	E	67.3	Low	68.8	Low	117 Å²	117	92.4 Å²	92.4	55%	0.547	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	128.8	174.1	-69	-172.9	174.5	0	0	109.9	V698 V702 R712	V698-E700 HydrophobicContact CG1-CG 4.25Å; E700-V702 HydrophobicContact CB-CG2 4.47Å; E700-V702 PolarHBondContact O-N 3.14Å; E700-R712 PolarHBondContact N-O 3.33Å; E700-R712 PolarHBondContact O-N 3.04Å
701	E	60.7	Low	67.8	Low	151 Å²	151	95.5 Å²	95.5	71%	0.706	49%	0.491	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78	101.4	172.5	-70.2	-175.5	177.4	0	0	109.3	I711	E701-I711 HydrophobicContact CG-CG1 4.24Å
702	V	58.6	Low	66.6	Low	64 Å²	64	101.1 Å²	101.1	39%	0.388	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	130.3	175.3	-168.7	0	0	0	0	108.2	E700 D704 V710 R712	E700-V702 HydrophobicContact CB-CG2 4.47Å; E700-V702 PolarHBondContact O-N 3.14Å; V702-D704 PolarHBondContact O-N 3.19Å; V702-V710 PolarHBondContact N-O 2.99Å; V702-V710 PolarHBondContact O-N 3.44Å; V702-V710 VanDerWaalsContact O-O 3.04Å; V702-R712 HydrophobicContact CG2-CB 4.06Å
703	V	57.3	Low	66.1	Low	95 Å²	95	98 Å²	98	58%	0.576	51%	0.507	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.2	115.8	172.8	-171.8	0	0	0	0	107.6
704	D	57.5	Low	65.8	Low	83 Å²	83	100.9 Å²	100.9	44%	0.444	52%	0.517	S	S	.	.			trans	-60.2	158.6	173.6	-93.1	-8.7	0	0	0	110.8	V702 K706 G707 S708 V710	V702-D704 PolarHBondContact O-N 3.19Å; D704-K706 PolarHBondContact O-N 3.35Å; D704-G707 PolarHBondContact O-N 2.97Å; D704-S708 PolarHBondContact N-O 3.03Å; D704-V710 HydrophobicContact CB-CG2 4.34Å; D704-V710 VanDerWaalsContact OD2-CG2 3.24Å; D704-V710 WeakPolarHBondContact OD2-CG2 3.37Å
705	E	59.2	Low	65.9	Low	210 Å²	210	98.3 Å²	98.3	98%	0.981	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-6.7	174.5	-63.7	-176	160.8	0	0	114.1
706	K	56	Low	66.1	Low	198 Å²	198	87.8 Å²	87.8	86%	0.861	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	9.5	174.8	-65.9	-178.1	-179	175.7	0	114.5	D704 S708	D704-K706 PolarHBondContact O-N 3.35Å; K706-S708 PolarHBondContact O-N 3.34Å
707	G	55.9	Low	65.9	Low	62 Å²	62	90.5 Å²	90.5	64%	0.639	49%	0.489	S	S	*	.	S	Bend	trans	76.7	12.8	173.9	0	0	0	0	0	115.8	D704	D704-G707 PolarHBondContact O-N 2.97Å
708	S	49.1	Very low	65.7	Low	56 Å²	56	98 Å²	98	39%	0.392	52%	0.517	S	S	.	.			trans	-94.8	130.5	171.7	47.1	0	0	0	0	110.8	D704 K706 V710	D704-S708 PolarHBondContact N-O 3.03Å; K706-S708 PolarHBondContact O-N 3.34Å; S708-V710 PolarHBondContact O-N 3.04Å
709	T	51.8	Low	65.5	Low	102 Å²	102	95.3 Å²	95.3	63%	0.626	50%	0.5	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.8	107.9	173	48.1	0	0	0	0	109.1
710	V	59.1	Low	65.6	Low	60 Å²	60	95.3 Å²	95.3	36%	0.364	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	121.5	173.1	-175.7	0	0	0	0	107.7	V702 D704 S708 R712	V702-V710 PolarHBondContact N-O 2.99Å; V702-V710 PolarHBondContact O-N 3.44Å; V702-V710 VanDerWaalsContact O-O 3.04Å; D704-V710 HydrophobicContact CB-CG2 4.34Å; D704-V710 VanDerWaalsContact OD2-CG2 3.24Å; D704-V710 WeakPolarHBondContact OD2-CG2 3.37Å; S708-V710 PolarHBondContact O-N 3.04Å; V710-R712 PolarHBondContact O-N 2.59Å
711	I	62.6	Low	66.1	Low	101 Å²	101	94.3 Å²	94.3	52%	0.518	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	109.2	174.7	-57.4	171	0	0	0	106.7	E699 E701	E699-I711 HydrophobicContact CB-CG2 3.78Å; E699-I711 HydrophobicContact CG-CG2 4.14Å; E701-I711 HydrophobicContact CG-CG1 4.24Å
712	R	62.3	Low	66.5	Low	159 Å²	159	93.2 Å²	93.2	60%	0.6	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	110.6	176.9	-158	-178.7	-168.6	-161.3	2.3	108.2	E700 V702 V710	E700-R712 PolarHBondContact N-O 3.33Å; E700-R712 PolarHBondContact O-N 3.04Å; V702-R712 HydrophobicContact CG2-CB 4.06Å; V710-R712 PolarHBondContact O-N 2.59Å
713	G	72.2	Confident	67.1	Low	22 Å²	22	93 Å²	93	23%	0.227	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	132.1	178.6	0	0	0	0	0	112.5	Y697 V698	Y697-G713 VanDerWaalsContact OH-CA 3.32Å; Y697-G713 WeakPolarHBondContact OH-CA 3.14Å; Y697-G713 PolarHBondContact OH-O 3.26Å; V698-G713 CarbonylContact O-C 3.53Å; V698-G713 VanDerWaalsContact O-CA 3.3Å; V698-G713 WeakPolarHBondContact O-CA 3.27Å
714	E	78.3	Confident	68.2	Low	84 Å²	84	89.8 Å²	89.8	39%	0.393	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	153.8	176.7	-63.8	-164.2	177.8	0	0	111.8	V698 K720	V698-E714 PolarHBondContact N-O 2.93Å; V698-E714 PolarHBondContact O-N 3.2Å; E714-K720 IonicContact OE2-NZ 3.55Å; E714-K720 PolarHBondContact OE2-NZ 3.03Å
715	L	82.4	Confident	69.1	Low	21 Å²	21	88.1 Å²	88.1	11%	0.11	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	145.2	173.2	-65.4	175.5	0	0	0	111.4	L685 E686 V689 Y697 M719 K720	L685-L715 HydrophobicContact CD2-CD1 4.49Å; E686-L715 HydrophobicContact CG-CD1 4.19Å; E686-L715 HydrophobicContact CG-CD2 4.07Å; E686-L715 HydrophobicContact CG-CG 3.93Å; V689-L715 HydrophobicContact CB-CD2 4.01Å; V689-L715 HydrophobicContact CG1-CD2 4.05Å; V689-L715 HydrophobicContact CG2-CD2 3.92Å; Y697-L715 HydrophobicContact CD2-CD2 4.49Å; L715-M719 HydrophobicContact CB-CB 4.06Å; L715-M719 HydrophobicContact CD2-SD 4.04Å; L715-K720 HydrophobicContact CB-CG 4.44Å; L715-K720 WeakPolarHBondContact O-CE 3.5Å; L715-K720 PolarHBondContact O-NZ 3.35Å
716	S	81.8	Confident	70.2	Confident	16 Å²	16	81 Å²	81	11%	0.112	45%	0.446	C	S	.	.			trans	-59.8	157.2	178.6	77.5	0	0	0	0	113	D696 R718 M719 K720	D696-S716 WeakPolarHBondContact O-CB 3.4Å; D696-S716 PolarHBondContact O-N 3.36Å; D696-S716 PolarHBondContact OD1-OG 3.08Å; S716-R718 PolarHBondContact O-N 2.96Å; S716-R718 VanDerWaalsContact O-N 3.12Å; S716-M719 PolarHBondContact O-N 3.42Å; S716-K720 PolarHBondContact O-N 2.97Å
717	A	76	Confident	71.6	Confident	88 Å²	88	74.1 Å²	74.1	73%	0.727	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-29	179.3	0	0	0	0	0	113.3
718	R	76.8	Confident	72.9	Confident	184 Å²	184	75 Å²	75	69%	0.694	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-34.3	174.5	-178.9	-176.6	176.2	-169.3	0.4	112.3	S716 I721	S716-R718 PolarHBondContact O-N 2.96Å; S716-R718 VanDerWaalsContact O-N 3.12Å; R718-I721 HydrophobicContact CG-CD1 4.5Å; R718-I721 WeakPolarHBondContact O-CD1 3.35Å; R718-I721 WeakPolarHBondContact O-CG1 3.5Å
719	M	74.8	Confident	74.6	Confident	11 Å²	11	72.7 Å²	72.7	5%	0.054	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-18.9	-179.5	-68.9	-153.6	74.8	0	0	113.5	V689 D696 L715 S716 N724 W726	V689-M719 HydrophobicContact CB-SD 4.37Å; V689-M719 HydrophobicContact CG1-SD 3.77Å; V689-M719 HydrophobicContact CG2-CE 3.54Å; V689-M719 HydrophobicContact CG2-SD 3.62Å; D696-M719 HydrophobicContact CB-CG 4.25Å; D696-M719 HydrophobicContact CB-SD 3.78Å; L715-M719 HydrophobicContact CB-CB 4.06Å; L715-M719 HydrophobicContact CD2-SD 4.04Å; S716-M719 PolarHBondContact O-N 3.42Å; M719-N724 WeakPolarHBondContact CA-ND2 3.37Å; M719-N724 PolarHBondContact O-ND2 3.49Å; M719-W726 HydrophobicContact CE-CB 3.82Å; M719-W726 HydrophobicContact CE-CD2 3.93Å; M719-W726 HydrophobicContact CE-CE3 3.63Å; M719-W726 HydrophobicContact CE-CG 4.04Å; M719-W726 HydrophobicContact CE-CZ3 4.44Å
720	K	77.3	Confident	76.3	Confident	117 Å²	117	68.9 Å²	68.9	51%	0.509	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	4.7	177.8	-68.1	175.3	174.8	169.1	0	114	E714 L715 S716	E714-K720 IonicContact OE2-NZ 3.55Å; E714-K720 PolarHBondContact OE2-NZ 3.03Å; L715-K720 HydrophobicContact CB-CG 4.44Å; L715-K720 WeakPolarHBondContact O-CE 3.5Å; L715-K720 PolarHBondContact O-NZ 3.35Å; S716-K720 PolarHBondContact O-N 2.97Å
721	I	78.9	Confident	77.6	Confident	97 Å²	97	71.7 Å²	71.7	50%	0.497	38%	0.38	S	S	.	.	S	Bend	trans	-65.5	134.7	178.1	-62.6	174.1	0	0	0	109.6	R718 G723 N724	R718-I721 HydrophobicContact CG-CD1 4.5Å; R718-I721 WeakPolarHBondContact O-CD1 3.35Å; R718-I721 WeakPolarHBondContact O-CG1 3.5Å; I721-G723 PolarHBondContact O-N 3.33Å; I721-N724 WeakPolarHBondContact O-CB 3.31Å; I721-N724 PolarHBondContact O-N 2.88Å
722	P	69.6	Low	78.6	Confident	127 Å²	127	71.7 Å²	71.7	83%	0.825	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	130.3	176.1	26	-33.9	0	0	0	110.8
723	G	69.9	Low	79.8	Confident	59 Å²	59	64.4 Å²	64.4	61%	0.608	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	25.2	-173.7	0	0	0	0	0	114	I721 M725	I721-G723 PolarHBondContact O-N 3.33Å; G723-M725 PolarHBondContact O-N 3.46Å
724	N	80.9	Confident	80.5	Confident	28 Å²	28	71.9 Å²	71.9	15%	0.15	38%	0.38	C	S	.	.			trans	-67.1	121.9	176	-179	14.4	0	0	0	111.1	M719 I721 W726 V727 E728	M719-N724 WeakPolarHBondContact CA-ND2 3.37Å; M719-N724 PolarHBondContact O-ND2 3.49Å; I721-N724 WeakPolarHBondContact O-CB 3.31Å; I721-N724 PolarHBondContact O-N 2.88Å; N724-W726 PolarHBondContact O-N 2.82Å; N724-W726 VanDerWaalsContact O-N 3.15Å; N724-W726 PolarHBondContact OD1-N 2.99Å; N724-V727 HydrophobicContact CB-CG2 4.23Å; N724-V727 WeakPolarHBondContact O-CB 3.43Å; N724-V727 PolarHBondContact O-N 3.06Å; N724-E728 PolarHBondContact O-N 3.45Å
725	M	76.1	Confident	80.9	Confident	49 Å²	49	71.8 Å²	71.8	24%	0.241	39%	0.385	C	S	.	.	H	α-helix	trans	-62.1	-23.5	-178.4	-64.8	-173.6	64.6	0	0	114.6	A662 G723 V727 A729	A662-M725 HydrophobicContact CB-CE 3.33Å; A662-M725 HydrophobicContact CB-SD 3.11Å; A662-M725 WeakPolarHBondContact CB-SD 3.46Å; A662-M725 WeakPolarHBondContact O-CE 3.44Å; G723-M725 PolarHBondContact O-N 3.46Å; M725-V727 VanDerWaalsContact C-N 3.31Å; M725-A729 WeakPolarHBondContact O-CB 3.31Å; M725-A729 PolarHBondContact O-N 2.81Å
726	W	83.6	Confident	81.1	Confident	59 Å²	59	72.9 Å²	72.9	22%	0.223	39%	0.391	C	S	.	.	H	α-helix	trans	-69	-35	175.4	-75.8	53.3	0	0	0	111.5	L669 M673 F688 V689 Y692 M719 N724 W730	L669-W726 HydrophobicContact CD1-CD2 4.44Å; L669-W726 HydrophobicContact CD1-CE3 4.36Å; L669-W726 HydrophobicContact CD1-CH2 4.16Å; L669-W726 HydrophobicContact CD1-CZ2 4.19Å; L669-W726 HydrophobicContact CD1-CZ3 4.23Å; L669-W726 HydrophobicContact CD2-CD2 4.09Å; L669-W726 HydrophobicContact CD2-CG 4.2Å; L669-W726 HydrophobicContact CD2-CZ2 4.48Å; M673-W726 HydrophobicContact CE-CB 4.4Å; M673-W726 HydrophobicContact CE-CD2 4.46Å; M673-W726 HydrophobicContact CE-CE3 4.12Å; F688-W726 HydrophobicContact CE1-CE3 4.26Å; F688-W726 AromaticContact CE1-CZ3 3.97Å; F688-W726 HydrophobicContact CE1-CZ3 3.97Å; V689-W726 HydrophobicContact CG2-CE3 4.46Å; Y692-W726 AromaticContact CD1-CH2 3.67Å; Y692-W726 HydrophobicContact CD1-CH2 3.67Å; Y692-W726 AromaticContact CD1-CZ3 3.93Å; Y692-W726 HydrophobicContact CD1-CZ3 3.93Å; Y692-W726 AromaticContact CE1-CH2 3.9Å; Y692-W726 HydrophobicContact CE1-CH2 3.9Å; Y692-W726 HydrophobicContact CE1-CZ3 4.48Å; M719-W726 HydrophobicContact CE-CB 3.82Å; M719-W726 HydrophobicContact CE-CD2 3.93Å; M719-W726 HydrophobicContact CE-CE3 3.63Å; M719-W726 HydrophobicContact CE-CG 4.04Å; M719-W726 HydrophobicContact CE-CZ3 4.44Å; N724-W726 PolarHBondContact O-N 2.82Å; N724-W726 VanDerWaalsContact O-N 3.15Å; N724-W726 PolarHBondContact OD1-N 2.99Å; W726-W730 WeakPolarHBondContact O-CB 3.24Å; W726-W730 PolarHBondContact O-N 3.39Å
727	V	84.8	Confident	81.3	Confident	55 Å²	55	72.6 Å²	72.6	33%	0.333	39%	0.388	S	S	.	.	H	α-helix	trans	-71.3	-46.8	174.7	-175.9	0	0	0	0	109.2	L685 N724 M725 A729 W730 D731	L685-V727 HydrophobicContact CD2-CG2 3.83Å; N724-V727 HydrophobicContact CB-CG2 4.23Å; N724-V727 WeakPolarHBondContact O-CB 3.43Å; N724-V727 PolarHBondContact O-N 3.06Å; M725-V727 VanDerWaalsContact C-N 3.31Å; V727-A729 VanDerWaalsContact C-N 3.35Å; V727-A729 PolarHBondContact O-N 3.2Å; V727-W730 PolarHBondContact O-N 2.95Å; V727-D731 WeakPolarHBondContact O-CB 3.06Å; V727-D731 VanDerWaalsContact O-CG 3.31Å; V727-D731 PolarHBondContact O-N 2.8Å
728	E	83.2	Confident	81.6	Confident	80 Å²	80	69.2 Å²	69.2	37%	0.374	36%	0.36	S	S	.	.	H	α-helix	trans	-59.7	-43	176.1	-63.3	-178.6	178.1	0	0	112.5	H659 N724 T732	H659-E728 IonicContact CE1-OE2 3.19Å; H659-E728 IonicContact NE2-OE2 3.89Å; H659-E728 PolarHBondContact NE2-OE2 3.39Å; N724-E728 PolarHBondContact O-N 3.45Å; E728-T732 WeakPolarHBondContact O-CB 3.11Å; E728-T732 PolarHBondContact O-N 3.23Å; E728-T732 PolarHBondContact O-OG1 3.16Å
729	A	84.4	Confident	81.7	Confident	8 Å²	8	68.4 Å²	68.4	7%	0.066	36%	0.357	C	S	.	.	H	α-helix	trans	-66.7	-42.1	177	0	0	0	0	0	111.5	L670 M673 M725 V727 T732 A733	L670-A729 HydrophobicContact CD2-CB 3.61Å; L670-A729 VanDerWaalsContact CD2-O 3.32Å; L670-A729 WeakPolarHBondContact CD2-O 3.46Å; L670-A729 HydrophobicContact CG-CB 4.24Å; M673-A729 HydrophobicContact CE-CB 4.4Å; M673-A729 HydrophobicContact SD-CB 3.86Å; M725-A729 WeakPolarHBondContact O-CB 3.31Å; M725-A729 PolarHBondContact O-N 2.81Å; V727-A729 VanDerWaalsContact C-N 3.35Å; V727-A729 PolarHBondContact O-N 3.2Å; A729-T732 PolarHBondContact O-N 2.71Å; A729-A733 WeakPolarHBondContact O-CB 3.36Å; A729-A733 PolarHBondContact O-N 3.46Å
730	W	87.1	Confident	81.9	Confident	22 Å²	22	76.5 Å²	76.5	8%	0.083	39%	0.387	C	S	.	.	H	α-helix	trans	-63.2	-43.2	176.6	-178.7	-98.3	0	0	0	112	M673 F676 K677 V684 L685 F688 W726 V727 T732 A733	M673-W730 HydrophobicContact CB-CE3 4.04Å; M673-W730 HydrophobicContact CB-CZ3 4.28Å; M673-W730 HydrophobicContact CE-CB 4.36Å; M673-W730 HydrophobicContact CE-CE3 4.45Å; M673-W730 HydrophobicContact CG-CE3 3.81Å; M673-W730 HydrophobicContact CG-CZ3 4.24Å; M673-W730 HydrophobicContact SD-CB 4.06Å; M673-W730 HydrophobicContact SD-CE3 4.06Å; M673-W730 PolarHBondContact SD-N 3.24Å; F676-W730 AromaticContact CD1-CH2 3.92Å; F676-W730 HydrophobicContact CD1-CH2 3.92Å; F676-W730 HydrophobicContact CD1-CZ3 4.2Å; F676-W730 HydrophobicContact CE1-CH2 4.29Å; K677-W730 VanDerWaalsContact CE-CE2 3.48Å; K677-W730 HydrophobicContact CG-CH2 3.83Å; K677-W730 HydrophobicContact CG-CZ2 4.18Å; K677-W730 HydrophobicContact CG-CZ3 4.19Å; K677-W730 PolarHBondContact NZ-O 2.98Å; V684-W730 VanDerWaalsContact C-CZ2 3.41Å; L685-W730 HydrophobicContact CB-CD2 4.09Å; L685-W730 HydrophobicContact CB-CG 4.07Å; L685-W730 HydrophobicContact CD1-CB 3.89Å; L685-W730 HydrophobicContact CD1-CD2 3.83Å; L685-W730 HydrophobicContact CD1-CE3 3.94Å; L685-W730 HydrophobicContact CD1-CG 3.84Å; L685-W730 HydrophobicContact CG-CG 4.4Å; F688-W730 HydrophobicContact CB-CE3 4.16Å; F688-W730 HydrophobicContact CB-CH2 3.77Å; F688-W730 HydrophobicContact CB-CZ3 3.4Å; F688-W730 VanDerWaalsContact CB-CZ3 3.4Å; F688-W730 HydrophobicContact CD1-CE3 4.47Å; F688-W730 HydrophobicContact CD1-CZ3 4.34Å; F688-W730 AromaticContact CD2-CZ3 3.88Å; F688-W730 HydrophobicContact CD2-CZ3 3.88Å; F688-W730 HydrophobicContact CG-CE3 4.19Å; F688-W730 HydrophobicContact CG-CH2 4.45Å; F688-W730 AromaticContact CG-CZ3 3.63Å; F688-W730 HydrophobicContact CG-CZ3 3.63Å; W726-W730 WeakPolarHBondContact O-CB 3.24Å; W726-W730 PolarHBondContact O-N 3.39Å; V727-W730 PolarHBondContact O-N 2.95Å; W730-T732 VanDerWaalsContact C-N 3.28Å; W730-T732 PolarHBondContact O-N 2.94Å; W730-A733 PolarHBondContact O-N 3.24Å
731	D	85.8	Confident	82.1	Confident	119 Å²	119	71.8 Å²	71.8	64%	0.636	37%	0.367	S	S	*	.	H	α-helix	trans	-67.2	-32.3	178.2	-69.5	-20.8	0	0	0	111.8	V727	V727-D731 WeakPolarHBondContact O-CB 3.06Å; V727-D731 VanDerWaalsContact O-CG 3.31Å; V727-D731 PolarHBondContact O-N 2.8Å
732	T	85	Confident	82.2	Confident	100 Å²	100	76.4 Å²	76.4	61%	0.613	38%	0.383	S	S	*	.	H	α-helix	trans	-77.3	-26.8	176.4	-52.9	0	0	0	0	113	E728 A729 W730 R734	E728-T732 WeakPolarHBondContact O-CB 3.11Å; E728-T732 PolarHBondContact O-N 3.23Å; E728-T732 PolarHBondContact O-OG1 3.16Å; A729-T732 PolarHBondContact O-N 2.71Å; W730-T732 VanDerWaalsContact C-N 3.28Å; W730-T732 PolarHBondContact O-N 2.94Å; T732-R734 PolarHBondContact O-N 3.11Å
733	A	86.9	Confident	82.6	Confident	7 Å²	7	76.4 Å²	76.4	6%	0.058	37%	0.367	C	S	.	.			trans	-68.7	127.1	-174.5	0	0	0	0	0	113	M673 E674 K677 A729 W730	M673-A733 HydrophobicContact CB-CB 3.78Å; E674-A733 HydrophobicContact CG-CB 3.92Å; K677-A733 HydrophobicContact CD-CB 4.48Å; K677-A733 PolarHBondContact NZ-O 3Å; A729-A733 WeakPolarHBondContact O-CB 3.36Å; A729-A733 PolarHBondContact O-N 3.46Å; W730-A733 PolarHBondContact O-N 3.24Å
734	R	86.8	Confident	83.1	Confident	179 Å²	179	76.1 Å²	76.1	68%	0.675	35%	0.351	S	S	*	.			trans	-91	160.2	178.8	-62.4	179	-179.4	177.7	-0	112.3	E674 T732 I736	E674-R734 VanDerWaalsContact CA-O 3.22Å; E674-R734 WeakPolarHBondContact CA-O 3.32Å; E674-R734 VanDerWaalsContact CB-O 3.3Å; E674-R734 WeakPolarHBondContact CB-O 3.5Å; E674-R734 VanDerWaalsContact CG-O 3.3Å; E674-R734 WeakPolarHBondContact CG-O 3.42Å; E674-R734 PolarHBondContact OE1-N 2.9Å; T732-R734 PolarHBondContact O-N 3.11Å; R734-I736 HydrophobicContact CB-CD1 3.8Å; R734-I736 HydrophobicContact CB-CG1 3.88Å; R734-I736 PolarHBondContact O-N 2.82Å
735	V	87.6	Confident	83.2	Confident	82 Å²	82	75.7 Å²	75.7	50%	0.497	35%	0.348	S	S	.	.	S	Bend	trans	-80.2	80	177.8	-170.6	0	0	0	0	109.9	K677 A678	K677-V735 HydrophobicContact CB-CG2 4.2Å; A678-V735 HydrophobicContact CB-CG1 4.23Å
736	I	85.6	Confident	83.5	Confident	44 Å²	44	76.3 Å²	76.3	23%	0.226	35%	0.352	C	S	.	.			trans	-130.4	124.9	-175.7	-52.7	176.2	0	0	0	109.5	E674 R734 R740 Q741	E674-I736 CarbonylContact C-O 3.55Å; E674-I736 VanDerWaalsContact C-O 3.31Å; E674-I736 VanDerWaalsContact O-O 3.09Å; R734-I736 HydrophobicContact CB-CD1 3.8Å; R734-I736 HydrophobicContact CB-CG1 3.88Å; R734-I736 PolarHBondContact O-N 2.82Å; I736-R740 HydrophobicContact CG2-CB 3.67Å; I736-Q741 HydrophobicContact CB-CG 4Å; I736-Q741 HydrophobicContact CG2-CB 4.49Å; I736-Q741 HydrophobicContact CG2-CG 3.67Å; I736-Q741 PolarHBondContact O-NE2 2.96Å
737	P	85.3	Confident	83.5	Confident	10 Å²	10	73.9 Å²	73.9	7%	0.065	34%	0.344	C	S	.	.			trans	-73	150.7	175.8	31	-35.8	0	0	0	111.2	D607 A678 R739 R740 Q741	D607-P737 HydrophobicContact CB-CB 4.38Å; D607-P737 HydrophobicContact CB-CG 4.43Å; D607-P737 WeakPolarHBondContact OD2-CG 3.43Å; A678-P737 HydrophobicContact CB-CB 4.12Å; P737-R739 HydrophobicContact CB-CG 4.33Å; P737-R739 HydrophobicContact CG-CG 4.17Å; P737-R739 PolarHBondContact O-N 3.2Å; P737-R740 HydrophobicContact CG-CB 4.32Å; P737-R740 HydrophobicContact CG-CG 4.41Å; P737-R740 PolarHBondContact O-N 2.82Å; P737-Q741 PolarHBondContact O-N 2.89Å
738	A	83	Confident	83.6	Confident	17 Å²	17	74.2 Å²	74.2	14%	0.14	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-46.7	-37.9	-175.5	0	0	0	0	0	115.2	V629 Q631 R740 Q741	V629-A738 HydrophobicContact CG1-CB 4.38Å; V629-A738 VanDerWaalsContact O-CB 3.25Å; V629-A738 WeakPolarHBondContact O-CB 3.41Å; Q631-A738 HydrophobicContact CG-CB 4.09Å; A738-R740 PolarHBondContact O-N 3.24Å; A738-Q741 PolarHBondContact O-N 3.13Å
739	R	77.9	Confident	83.7	Confident	167 Å²	167	76.2 Å²	76.2	63%	0.63	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-62.5	-20.4	177.2	61.9	172.7	-178.6	-176.4	0.3	115.9	D607 P737	D607-R739 IonicContact OD1-CZ 2.7Å; D607-R739 IonicContact OD1-NE 2.63Å; D607-R739 IonicContact OD1-NH2 3.21Å; D607-R739 PolarHBondContact OD1-NH2 2.87Å; D607-R739 VanDerWaalsContact OD1-NH2 3.07Å; D607-R739 IonicContact OD2-CZ 3.68Å; D607-R739 IonicContact OD2-NE 2.87Å; D607-R739 PolarHBondContact OD2-NE 2.65Å; D607-R739 IonicContact OD2-NH2 2.7Å; D607-R739 PolarHBondContact OD2-NH2 3.11Å; P737-R739 HydrophobicContact CB-CG 4.33Å; P737-R739 HydrophobicContact CG-CG 4.17Å; P737-R739 PolarHBondContact O-N 3.2Å
740	R	79.4	Confident	83.8	Confident	181 Å²	181	77.2 Å²	77.2	68%	0.683	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-112	-5.5	-178.1	-75	177.9	-175.5	-179.5	0.5	112.7	I736 P737 A738	I736-R740 HydrophobicContact CG2-CB 3.67Å; P737-R740 HydrophobicContact CG-CB 4.32Å; P737-R740 HydrophobicContact CG-CG 4.41Å; P737-R740 PolarHBondContact O-N 2.82Å; A738-R740 PolarHBondContact O-N 3.24Å
741	Q	83	Confident	83.8	Confident	17 Å²	17	76.1 Å²	76.1	8%	0.079	35%	0.353	C	S	.	.	S	Bend	trans	-75.1	160.8	175.9	-70.6	172.6	2.9	0	0	110.5	Q631 S671 E674 S675 I736 P737 A738 R743	Q631-Q741 VanDerWaalsContact NE2-CB 3.27Å; S671-Q741 PolarHBondContact O-NE2 3.44Å; S671-Q741 VanDerWaalsContact O-NE2 3.12Å; S671-Q741 PolarHBondContact O-OE1 3.1Å; S671-Q741 PolarHBondContact OG-OE1 3.2Å; E674-Q741 VanDerWaalsContact CB-NE2 3.28Å; S675-Q741 VanDerWaalsContact N-NE2 3.13Å; S675-Q741 PolarHBondContact OG-NE2 3.08Å; I736-Q741 HydrophobicContact CB-CG 4Å; I736-Q741 HydrophobicContact CG2-CB 4.49Å; I736-Q741 HydrophobicContact CG2-CG 3.67Å; I736-Q741 PolarHBondContact O-NE2 2.96Å; P737-Q741 PolarHBondContact O-N 2.89Å; A738-Q741 PolarHBondContact O-N 3.13Å; Q741-R743 PolarHBondContact O-N 2.8Å
742	K	79.9	Confident	84	Confident	194 Å²	194	75 Å²	75	84%	0.843	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-61.1	134.8	166.4	-173.7	176.4	179.8	178.4	0	108.4	Q631 L744	Q631-K742 PolarHBondContact NE2-O 2.98Å; K742-L744 PolarHBondContact O-N 3.3Å
743	R	78.8	Confident	84.2	Confident	128 Å²	128	74.7 Å²	74.7	48%	0.483	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-68.2	130.8	-179.8	-59.1	-176	-170.6	166.5	11.6	109.9	Q741 F745 D747	Q741-R743 PolarHBondContact O-N 2.8Å; R743-F745 VanDerWaalsContact C-N 3.27Å; R743-D747 IonicContact NH1-OD1 3.95Å; R743-D747 PolarHBondContact NH1-OD1 3.07Å
744	L	78.9	Confident	84.2	Confident	52 Å²	52	74.6 Å²	74.6	27%	0.272	33%	0.332	S	S	.	.	S	Bend	trans	-69.2	-30	170.8	-68.3	178.2	0	0	0	111.6	Q631 A667 K742	Q631-L744 HydrophobicContact CB-CD1 3.84Å; Q631-L744 HydrophobicContact CB-CG 4.33Å; A667-L744 HydrophobicContact CB-CD2 4.24Å; K742-L744 PolarHBondContact O-N 3.3Å
745	F	83.6	Confident	84.3	Confident	20 Å²	20	66.6 Å²	66.6	9%	0.088	30%	0.303	C	S	.	.	S	Bend	trans	-125.3	121.7	175.6	-178.6	-100	0	0	0	110.7	M523 R530 A634 P635 R743 D747 E750	M523-F745 HydrophobicContact SD-CE2 3.89Å; M523-F745 HydrophobicContact SD-CZ 3.99Å; R530-F745 VanDerWaalsContact CD-CD1 3.49Å; R530-F745 VanDerWaalsContact NH1-CB 3.34Å; R530-F745 VanDerWaalsContact NH1-CE1 3.35Å; A634-F745 HydrophobicContact CB-CB 4.12Å; A634-F745 HydrophobicContact CB-CD2 3.94Å; P635-F745 HydrophobicContact CG-CD2 4.28Å; P635-F745 HydrophobicContact CG-CE2 3.84Å; P635-F745 HydrophobicContact CG-CZ 4.21Å; R743-F745 VanDerWaalsContact C-N 3.27Å; F745-D747 HydrophobicContact CD1-CB 4.38Å; F745-D747 HydrophobicContact CE1-CB 4.05Å; F745-E750 HydrophobicContact CD2-CG 4.21Å; F745-E750 HydrophobicContact CE2-CB 4.07Å; F745-E750 HydrophobicContact CE2-CG 3.8Å; F745-E750 HydrophobicContact CZ-CB 4.16Å; F745-E750 HydrophobicContact CZ-CG 4.35Å
746	D	83	Confident	84.4	Confident	62 Å²	62	67.9 Å²	67.9	33%	0.332	30%	0.303	S	S	.	.			trans	-97.3	100.5	173.8	-172.6	-21.1	0	0	0	109.4	T748 K749 E750	D746-T748 PolarHBondContact O-N 2.74Å; D746-T748 PolarHBondContact OD1-N 3.25Å; D746-T748 PolarHBondContact OD1-OG1 2.99Å; D746-K749 HydrophobicContact CB-CB 4Å; D746-K749 PolarHBondContact O-N 3.34Å; D746-K749 PolarHBondContact OD1-N 3.42Å; D746-K749 VanDerWaalsContact OD1-N 3.16Å; D746-E750 WeakPolarHBondContact O-CB 3.13Å; D746-E750 WeakPolarHBondContact O-CG 3.48Å; D746-E750 PolarHBondContact O-N 3.09Å
747	D	84.3	Confident	84.6	Confident	7 Å²	7	69 Å²	69	4%	0.037	31%	0.305	C	S	.	.	H	α-helix	trans	-56.7	-33	-179.9	52.8	-61.4	0	0	0	112.7	W496 R530 R534 R743 F745 A751	W496-D747 WeakPolarHBondContact CH2-O 3.46Å; R530-D747 HydrophobicContact CB-CB 4.21Å; R534-D747 IonicContact CZ-OD2 3.15Å; R534-D747 IonicContact NE-OD2 2.88Å; R534-D747 PolarHBondContact NE-OD2 3.23Å; R534-D747 IonicContact NH2-OD2 3.63Å; R534-D747 PolarHBondContact NH2-OD2 3.4Å; R743-D747 IonicContact NH1-OD1 3.95Å; R743-D747 PolarHBondContact NH1-OD1 3.07Å; F745-D747 HydrophobicContact CD1-CB 4.38Å; F745-D747 HydrophobicContact CE1-CB 4.05Å; D747-A751 VanDerWaalsContact O-CB 3.24Å; D747-A751 WeakPolarHBondContact O-CB 3.45Å; D747-A751 PolarHBondContact O-N 3.14Å
748	T	85.4	Confident	84.7	Confident	62 Å²	62	68.5 Å²	68.5	38%	0.38	30%	0.302	S	S	.	.	H	α-helix	trans	-80.1	-44.5	-176.6	58.6	0	0	0	0	112.1	W496 D746 E752	W496-T748 HydrophobicContact CZ2-CG2 4.42Å; D746-T748 PolarHBondContact O-N 2.74Å; D746-T748 PolarHBondContact OD1-N 3.25Å; D746-T748 PolarHBondContact OD1-OG1 2.99Å; T748-E752 WeakPolarHBondContact O-CG 3.42Å; T748-E752 PolarHBondContact O-N 2.86Å; T748-E752 VanDerWaalsContact O-N 3.13Å
749	K	86.8	Confident	84.9	Confident	123 Å²	123	71 Å²	71	54%	0.535	32%	0.322	S	S	.	.	H	α-helix	trans	-68.8	-40.6	179.3	-171.7	176.7	-177.7	175.4	0	112	D746 K753	D746-K749 HydrophobicContact CB-CB 4Å; D746-K749 PolarHBondContact O-N 3.34Å; D746-K749 PolarHBondContact OD1-N 3.42Å; D746-K749 VanDerWaalsContact OD1-N 3.16Å; K749-K753 VanDerWaalsContact O-CG 3.27Å; K749-K753 WeakPolarHBondContact O-CG 3.3Å; K749-K753 PolarHBondContact O-N 3.22Å
750	E	86.8	Confident	85.4	Confident	28 Å²	28	69.1 Å²	69.1	13%	0.131	32%	0.322	C	S	.	.	H	α-helix	trans	-70.3	-37.3	178.8	-65.3	-54.9	132	0	0	112.1	Q640 F745 D746 K753 V754	Q640-E750 PolarHBondContact NE2-OE2 2.76Å; F745-E750 HydrophobicContact CD2-CG 4.21Å; F745-E750 HydrophobicContact CE2-CB 4.07Å; F745-E750 HydrophobicContact CE2-CG 3.8Å; F745-E750 HydrophobicContact CZ-CB 4.16Å; F745-E750 HydrophobicContact CZ-CG 4.35Å; D746-E750 WeakPolarHBondContact O-CB 3.13Å; D746-E750 WeakPolarHBondContact O-CG 3.48Å; D746-E750 PolarHBondContact O-N 3.09Å; E750-K753 PolarHBondContact O-N 3.27Å; E750-K753 IonicContact OE1-NZ 2.82Å; E750-K753 PolarHBondContact OE1-NZ 3.31Å; E750-K753 IonicContact OE2-NZ 2.65Å; E750-V754 WeakPolarHBondContact O-CG2 3.47Å; E750-V754 PolarHBondContact O-N 3.46Å
751	A	87.3	Confident	85.7	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-63	-45.1	173.6	0	0	0	0	0	112.5	W496 L524 C527 D747 K753 V754 L755	W496-A751 HydrophobicContact CD2-CB 3.89Å; W496-A751 HydrophobicContact CE3-CB 3.88Å; W496-A751 HydrophobicContact CH2-CB 3.5Å; W496-A751 VanDerWaalsContact CH2-CB 3.5Å; W496-A751 HydrophobicContact CZ2-CB 3.49Å; W496-A751 VanDerWaalsContact CZ2-CB 3.49Å; W496-A751 HydrophobicContact CZ3-CB 3.7Å; L524-A751 HydrophobicContact CD1-CB 4.09Å; C527-A751 HydrophobicContact CB-CB 3.89Å; D747-A751 VanDerWaalsContact O-CB 3.24Å; D747-A751 WeakPolarHBondContact O-CB 3.45Å; D747-A751 PolarHBondContact O-N 3.14Å; A751-K753 PolarHBondContact O-N 3.46Å; A751-V754 PolarHBondContact O-N 3.35Å; A751-L755 WeakPolarHBondContact O-CG 3.27Å; A751-L755 PolarHBondContact O-N 2.81Å
752	E	88.5	Confident	85.9	Confident	94 Å²	94	64.1 Å²	64.1	44%	0.439	31%	0.305	S	S	.	.	H	α-helix	trans	-63.8	-39.5	176.7	-75.2	-65	160.8	0	0	112	T748 V754 L755 H756	T748-E752 WeakPolarHBondContact O-CG 3.42Å; T748-E752 PolarHBondContact O-N 2.86Å; T748-E752 VanDerWaalsContact O-N 3.13Å; E752-V754 VanDerWaalsContact C-N 3.32Å; E752-V754 PolarHBondContact O-N 3Å; E752-L755 PolarHBondContact O-N 2.83Å; E752-H756 WeakPolarHBondContact O-CB 3.36Å; E752-H756 PolarHBondContact O-N 3.36Å
753	K	88.8	Confident	86.1	Confident	95 Å²	95	55 Å²	55	41%	0.413	27%	0.266	S	S	.	.	H	α-helix	trans	-58.7	-44.1	173.1	-76.8	172.6	178.3	179.6	0	111.9	K749 E750 A751 Y757	K749-K753 VanDerWaalsContact O-CG 3.27Å; K749-K753 WeakPolarHBondContact O-CG 3.3Å; K749-K753 PolarHBondContact O-N 3.22Å; E750-K753 PolarHBondContact O-N 3.27Å; E750-K753 IonicContact OE1-NZ 2.82Å; E750-K753 PolarHBondContact OE1-NZ 3.31Å; E750-K753 IonicContact OE2-NZ 2.65Å; A751-K753 PolarHBondContact O-N 3.46Å; K753-Y757 VanDerWaalsContact O-CB 3.28Å; K753-Y757 WeakPolarHBondContact O-CB 3.26Å; K753-Y757 PolarHBondContact O-N 3.26Å
754	V	88.7	Confident	86.4	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.024	24%	0.243	C	C	.	.	H	α-helix	trans	-65	-48.8	178	172.5	0	0	0	0	110.7	K520 M523 L524 E750 A751 E752 H756 Y757 L758	K520-V754 HydrophobicContact CB-CG1 4.2Å; K520-V754 HydrophobicContact CD-CG2 4.27Å; M523-V754 HydrophobicContact CB-CG2 4.34Å; M523-V754 HydrophobicContact CG-CG2 4.01Å; L524-V754 HydrophobicContact CB-CG1 4.39Å; E750-V754 WeakPolarHBondContact O-CG2 3.47Å; E750-V754 PolarHBondContact O-N 3.46Å; A751-V754 PolarHBondContact O-N 3.35Å; E752-V754 VanDerWaalsContact C-N 3.32Å; E752-V754 PolarHBondContact O-N 3Å; V754-H756 VanDerWaalsContact C-N 3.33Å; V754-H756 PolarHBondContact O-N 3.38Å; V754-Y757 WeakPolarHBondContact O-CB 3.26Å; V754-Y757 PolarHBondContact O-N 2.96Å; V754-L758 HydrophobicContact CG1-CD1 4.08Å; V754-L758 HydrophobicContact CG1-CG 4.44Å; V754-L758 VanDerWaalsContact O-CG 3.29Å; V754-L758 WeakPolarHBondContact O-CG 3.47Å; V754-L758 PolarHBondContact O-N 3.25Å
755	L	88.6	Confident	86.7	Confident	11 Å²	11	50.2 Å²	50.2	6%	0.058	25%	0.25	C	S	.	.	H	α-helix	trans	-63.1	-39.2	179.5	-69.8	173.2	0	0	0	112.2	L492 W496 L524 A751 E752 L758 A759	L492-L755 HydrophobicContact CB-CD2 4.23Å; W496-L755 HydrophobicContact CB-CD1 4.28Å; W496-L755 HydrophobicContact CG-CD1 4.17Å; L524-L755 HydrophobicContact CD1-CG 4.43Å; L524-L755 HydrophobicContact CD2-CD2 4.25Å; A751-L755 WeakPolarHBondContact O-CG 3.27Å; A751-L755 PolarHBondContact O-N 2.81Å; E752-L755 PolarHBondContact O-N 2.83Å; L755-L758 PolarHBondContact O-N 3.43Å; L755-A759 WeakPolarHBondContact O-CB 3.1Å; L755-A759 PolarHBondContact O-N 2.83Å
756	H	88.8	Confident	87	Confident	109 Å²	109	49.2 Å²	49.2	51%	0.505	25%	0.246	S	C	.	.	H	α-helix	trans	-63.9	-44.3	175	-173.9	69.4	0	0	0	112.1	E752 V754 L758 A759 M760	E752-H756 WeakPolarHBondContact O-CB 3.36Å; E752-H756 PolarHBondContact O-N 3.36Å; V754-H756 VanDerWaalsContact C-N 3.33Å; V754-H756 PolarHBondContact O-N 3.38Å; H756-L758 VanDerWaalsContact C-N 3.34Å; H756-L758 PolarHBondContact O-N 2.93Å; H756-A759 PolarHBondContact O-N 3.43Å; H756-M760 WeakPolarHBondContact CE1-CE 3.43Å; H756-M760 WeakPolarHBondContact NE2-CE 3.39Å; H756-M760 PolarHBondContact NE2-SD 2.96Å; H756-M760 WeakPolarHBondContact O-CB 2.96Å; H756-M760 WeakPolarHBondContact O-CG 3.26Å; H756-M760 PolarHBondContact O-N 3.35Å
757	Y	89.1	Confident	87.2	Confident	68 Å²	68	46.4 Å²	46.4	27%	0.267	23%	0.231	S	C	.	.	H	α-helix	trans	-58.4	-44.5	173.9	169.9	-98	0	0	0	111.8	K520 K753 V754 M760 M761 H769	K520-Y757 HydrophobicContact CD-CD1 4.39Å; K520-Y757 HydrophobicContact CD-CE1 4.48Å; K520-Y757 HydrophobicContact CG-CD1 4.3Å; K520-Y757 HydrophobicContact CG-CE1 4.06Å; K753-Y757 VanDerWaalsContact O-CB 3.28Å; K753-Y757 WeakPolarHBondContact O-CB 3.26Å; K753-Y757 PolarHBondContact O-N 3.26Å; V754-Y757 WeakPolarHBondContact O-CB 3.26Å; V754-Y757 PolarHBondContact O-N 2.96Å; Y757-M760 PolarHBondContact O-N 2.93Å; Y757-M761 HydrophobicContact CD1-CE 3.96Å; Y757-M761 HydrophobicContact CE1-CE 3.22Å; Y757-M761 HydrophobicContact CE2-CE 4.43Å; Y757-M761 PolarHBondContact O-N 3.11Å; Y757-H769 PolarHBondContact OH-NE2 3.12Å; Y757-H769 VanDerWaalsContact OH-NE2 3.12Å
758	L	88.9	Confident	87.3	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-66.6	-38.9	177.9	-64.7	173.9	0	0	0	112.6	W485 V489 L492 L517 F521 V754 L755 H756 M761	W485-L758 HydrophobicContact CH2-CD2 3.89Å; W485-L758 HydrophobicContact CZ2-CB 4.13Å; W485-L758 HydrophobicContact CZ2-CD2 3.94Å; W485-L758 PolarHBondContact NE1-O 3.25Å; W485-L758 VanDerWaalsContact NE1-O 3.1Å; V489-L758 HydrophobicContact CG2-CB 4.1Å; L492-L758 HydrophobicContact CD1-CD1 3.81Å; L517-L758 HydrophobicContact CD1-CD2 3.56Å; F521-L758 HydrophobicContact CD1-CD1 4.29Å; F521-L758 HydrophobicContact CE1-CD1 3.89Å; F521-L758 HydrophobicContact CE1-CD2 3.95Å; V754-L758 HydrophobicContact CG1-CD1 4.08Å; V754-L758 HydrophobicContact CG1-CG 4.44Å; V754-L758 VanDerWaalsContact O-CG 3.29Å; V754-L758 WeakPolarHBondContact O-CG 3.47Å; V754-L758 PolarHBondContact O-N 3.25Å; L755-L758 PolarHBondContact O-N 3.43Å; H756-L758 VanDerWaalsContact C-N 3.34Å; H756-L758 PolarHBondContact O-N 2.93Å; L758-M761 HydrophobicContact CD2-CE 4.21Å; L758-M761 WeakPolarHBondContact O-CB 3.12Å; L758-M761 PolarHBondContact O-N 3.22Å
759	A	87.8	Confident	87.4	Confident	68 Å²	68	47.1 Å²	47.1	56%	0.562	23%	0.23	S	C	*	.	H	α-helix	trans	-69.8	-32.7	178.8	0	0	0	0	0	113.2	V489 L755 H756 M761	V489-A759 HydrophobicContact CG1-CB 4.33Å; L755-A759 WeakPolarHBondContact O-CB 3.1Å; L755-A759 PolarHBondContact O-N 2.83Å; H756-A759 PolarHBondContact O-N 3.43Å; A759-M761 VanDerWaalsContact C-N 3.35Å
760	M	86.7	Confident	87.5	Confident	129 Å²	129	41.3 Å²	41.3	64%	0.635	21%	0.205	S	C	*	.	H	α-helix	trans	-82.6	-11.1	177.2	-73.9	-170.7	158.7	0	0	113.9	H756 Y757 K762	H756-M760 WeakPolarHBondContact CE1-CE 3.43Å; H756-M760 WeakPolarHBondContact NE2-CE 3.39Å; H756-M760 PolarHBondContact NE2-SD 2.96Å; H756-M760 WeakPolarHBondContact O-CB 2.96Å; H756-M760 WeakPolarHBondContact O-CG 3.26Å; H756-M760 PolarHBondContact O-N 3.35Å; Y757-M760 PolarHBondContact O-N 2.93Å; M760-K762 PolarHBondContact O-N 3.41Å
761	M	85.9	Confident	87.6	Confident	13 Å²	13	40 Å²	40	6%	0.064	20%	0.198	C	C	.	.			trans	-67.3	127.9	-177.3	-169	177.6	-64.5	0	0	111	W485 L517 Y757 L758 A759 D765 L766	W485-M761 HydrophobicContact CZ2-CB 4.46Å; W485-M761 HydrophobicContact CZ2-SD 4.01Å; L517-M761 HydrophobicContact CD1-CE 4.25Å; Y757-M761 HydrophobicContact CD1-CE 3.96Å; Y757-M761 HydrophobicContact CE1-CE 3.22Å; Y757-M761 HydrophobicContact CE2-CE 4.43Å; Y757-M761 PolarHBondContact O-N 3.11Å; L758-M761 HydrophobicContact CD2-CE 4.21Å; L758-M761 WeakPolarHBondContact O-CB 3.12Å; L758-M761 PolarHBondContact O-N 3.22Å; A759-M761 VanDerWaalsContact C-N 3.35Å; M761-D765 HydrophobicContact CG-CB 4.06Å; M761-L766 HydrophobicContact CG-CB 4.23Å; M761-L766 HydrophobicContact SD-CB 3.86Å; M761-L766 HydrophobicContact SD-CD1 3.9Å
762	K	87.3	Confident	87.6	Confident	79 Å²	79	40.1 Å²	40.1	34%	0.343	20%	0.2	S	C	.	.			trans	-75.4	152.3	174.7	-59.4	-179.5	175.1	-169.5	0	110.5	K337 M760 G764 D765 L766	K337-K762 PolarHBondContact O-NZ 2.83Å; M760-K762 PolarHBondContact O-N 3.41Å; K762-G764 PolarHBondContact O-N 3.13Å; K762-D765 HydrophobicContact CB-CB 4.46Å; K762-D765 WeakPolarHBondContact CB-OD2 3.13Å; K762-D765 PolarHBondContact O-N 3.38Å; K762-D765 VanDerWaalsContact O-N 3.07Å; K762-L766 PolarHBondContact O-N 3.42Å
763	P	85.3	Confident	87.5	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.013	18%	0.179	C	C	.	.	H	α-helix	trans	-56.9	-33.8	176.2	-27.6	37	0	0	0	113.9	A340 I343 L478 V481 A482 L766 A767	A340-P763 HydrophobicContact CB-CG 4.21Å; I343-P763 HydrophobicContact CD1-CB 4.48Å; I343-P763 HydrophobicContact CD1-CG 3.81Å; L478-P763 HydrophobicContact CD1-CB 3.94Å; V481-P763 HydrophobicContact CG1-CB 4.47Å; A482-P763 HydrophobicContact CB-CG 3.98Å; P763-L766 WeakPolarHBondContact O-CB 3.47Å; P763-L766 PolarHBondContact O-N 3.43Å; P763-A767 WeakPolarHBondContact O-CB 3.15Å; P763-A767 PolarHBondContact O-N 3.03Å
764	G	84.3	Confident	87.4	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.01	16%	0.159	C	C	.	.	H	α-helix	trans	-66.4	-43.7	174	0	0	0	0	0	113.1	L333 K762 L766 A767 H768	L333-G764 WeakPolarHBondContact O-CA 3.45Å; K762-G764 PolarHBondContact O-N 3.13Å; G764-L766 VanDerWaalsContact C-N 3.31Å; G764-L766 PolarHBondContact O-N 2.86Å; G764-A767 PolarHBondContact O-N 3.44Å; G764-H768 WeakPolarHBondContact O-CB 3.23Å; G764-H768 PolarHBondContact O-N 3.02Å
765	D	86.1	Confident	87.4	Confident	79 Å²	79	31.1 Å²	31.1	42%	0.422	16%	0.159	S	C	.	.	H	α-helix	trans	-66.9	-35.1	176.1	-59.1	-35.1	0	0	0	111.3	M761 K762 H768 H769	M761-D765 HydrophobicContact CG-CB 4.06Å; K762-D765 HydrophobicContact CB-CB 4.46Å; K762-D765 WeakPolarHBondContact CB-OD2 3.13Å; K762-D765 PolarHBondContact O-N 3.38Å; K762-D765 VanDerWaalsContact O-N 3.07Å; D765-H768 VanDerWaalsContact O-CB 3.31Å; D765-H768 WeakPolarHBondContact O-CB 3.49Å; D765-H768 PolarHBondContact O-N 3.41Å; D765-H769 PolarHBondContact O-CD2 2.93Å; D765-H769 PolarHBondContact O-N 3.07Å
766	L	88.4	Confident	87.4	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.8	-49	172.3	174.7	64.9	0	0	0	111.5	L468 W485 L517 M761 K762 P763 G764 H768 H769 L770	L468-L766 HydrophobicContact CD2-CD2 3.51Å; L468-L766 HydrophobicContact CD2-CG 4Å; W485-L766 HydrophobicContact CB-CD2 3.91Å; W485-L766 HydrophobicContact CD2-CD1 4.15Å; W485-L766 HydrophobicContact CD2-CD2 3.37Å; W485-L766 HydrophobicContact CD2-CG 4.34Å; W485-L766 HydrophobicContact CE3-CD1 3.83Å; W485-L766 HydrophobicContact CE3-CD2 3.45Å; W485-L766 VanDerWaalsContact CE3-CD2 3.45Å; W485-L766 HydrophobicContact CE3-CG 4.28Å; W485-L766 HydrophobicContact CG-CD2 3.59Å; W485-L766 HydrophobicContact CH2-CD1 3.59Å; W485-L766 HydrophobicContact CZ2-CD1 3.94Å; W485-L766 HydrophobicContact CZ3-CD1 3.55Å; W485-L766 HydrophobicContact CZ3-CD2 4.1Å; W485-L766 HydrophobicContact CZ3-CG 4.48Å; L517-L766 HydrophobicContact CD2-CD1 3.87Å; M761-L766 HydrophobicContact CG-CB 4.23Å; M761-L766 HydrophobicContact SD-CB 3.86Å; M761-L766 HydrophobicContact SD-CD1 3.9Å; K762-L766 PolarHBondContact O-N 3.42Å; P763-L766 WeakPolarHBondContact O-CB 3.47Å; P763-L766 PolarHBondContact O-N 3.43Å; G764-L766 VanDerWaalsContact C-N 3.31Å; G764-L766 PolarHBondContact O-N 2.86Å; L766-H768 PolarHBondContact O-N 3.5Å; L766-H769 PolarHBondContact O-N 3.35Å; L766-L770 HydrophobicContact CD1-CD1 3.79Å; L766-L770 HydrophobicContact CD1-CG 4.23Å; L766-L770 HydrophobicContact CG-CD1 3.92Å; L766-L770 WeakPolarHBondContact O-CG 3.49Å; L766-L770 PolarHBondContact O-N 3.26Å
767	A	87.8	Confident	87.2	Confident	2 Å²	2	26 Å²	26	2%	0.017	14%	0.135	C	C	.	.	H	α-helix	trans	-58	-40.7	175.6	0	0	0	0	0	110.6	F330 L333 P763 G764 H769 L770 L771	F330-A767 HydrophobicContact CE1-CB 4.01Å; F330-A767 WeakPolarHBondContact CE1-O 3.1Å; F330-A767 HydrophobicContact CE2-CB 4.36Å; F330-A767 HydrophobicContact CZ-CB 3.83Å; L333-A767 HydrophobicContact CB-CB 4.06Å; P763-A767 WeakPolarHBondContact O-CB 3.15Å; P763-A767 PolarHBondContact O-N 3.03Å; G764-A767 PolarHBondContact O-N 3.44Å; A767-H769 PolarHBondContact O-N 3.31Å; A767-L770 CarbonylContact O-C 3.53Å; A767-L770 PolarHBondContact O-N 3.01Å; A767-L771 WeakPolarHBondContact O-CB 3.3Å; A767-L771 PolarHBondContact O-N 2.85Å
768	H	86.9	Confident	87.2	Confident	41 Å²	41	22.8 Å²	22.8	19%	0.19	12%	0.123	C	C	.	.	H	α-helix	trans	-59.8	-45	175.8	-162.7	82.9	0	0	0	113	G764 D765 L766 L770 Y814	G764-H768 WeakPolarHBondContact O-CB 3.23Å; G764-H768 PolarHBondContact O-N 3.02Å; D765-H768 VanDerWaalsContact O-CB 3.31Å; D765-H768 WeakPolarHBondContact O-CB 3.49Å; D765-H768 PolarHBondContact O-N 3.41Å; L766-H768 PolarHBondContact O-N 3.5Å; H768-L770 VanDerWaalsContact C-N 3.3Å; H768-L770 PolarHBondContact O-N 3.12Å; H768-Y814 AromaticContact CD2-CE2 3.96Å; H768-Y814 AromaticContact CE1-CD2 3.11Å; H768-Y814 WeakPolarHBondContact CE1-CD2 3.45Å; H768-Y814 AromaticContact CE1-CE2 3.65Å; H768-Y814 AromaticContact CE1-CG 3.98Å; H768-Y814 AromaticContact NE2-CD2 3.06Å; H768-Y814 WeakPolarHBondContact NE2-CD2 3.28Å; H768-Y814 AromaticContact NE2-CE2 3.24Å; H768-Y814 WeakPolarHBondContact NE2-CE2 3.29Å
769	H	86.8	Confident	87.1	Confident	44 Å²	44	22.9 Å²	22.9	20%	0.204	12%	0.123	C	C	.	.	H	α-helix	trans	-70.2	-24.1	176.6	-74	-51.9	0	0	0	114.1	L517 Y757 D765 L766 A767	L517-H769 HydrophobicContact CB-CB 4.19Å; L517-H769 HydrophobicContact CD2-CB 4.48Å; Y757-H769 PolarHBondContact OH-NE2 3.12Å; Y757-H769 VanDerWaalsContact OH-NE2 3.12Å; D765-H769 PolarHBondContact O-CD2 2.93Å; D765-H769 PolarHBondContact O-N 3.07Å; L766-H769 PolarHBondContact O-N 3.35Å; A767-H769 PolarHBondContact O-N 3.31Å
770	L	89.3	Confident	87	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-92.1	-19.3	179	-69.1	173.4	0	0	0	113.5	F330 T461 L464 A465 L468 L517 L766 A767 H768 P772 C773 L774	F330-L770 HydrophobicContact CZ-CB 4.06Å; T461-L770 HydrophobicContact CG2-CD2 3.85Å; L464-L770 HydrophobicContact CD2-CD1 4.33Å; L464-L770 HydrophobicContact CD2-CD2 4.3Å; L464-L770 HydrophobicContact CG-CD1 4.3Å; A465-L770 HydrophobicContact CB-CB 4.1Å; A465-L770 HydrophobicContact CB-CD2 4.05Å; L468-L770 HydrophobicContact CD2-CD1 3.67Å; L517-L770 HydrophobicContact CD2-CD2 3.63Å; L517-L770 HydrophobicContact CD2-CG 4.01Å; L766-L770 HydrophobicContact CD1-CD1 3.79Å; L766-L770 HydrophobicContact CD1-CG 4.23Å; L766-L770 HydrophobicContact CG-CD1 3.92Å; L766-L770 WeakPolarHBondContact O-CG 3.49Å; L766-L770 PolarHBondContact O-N 3.26Å; A767-L770 CarbonylContact O-C 3.53Å; A767-L770 PolarHBondContact O-N 3.01Å; H768-L770 VanDerWaalsContact C-N 3.3Å; H768-L770 PolarHBondContact O-N 3.12Å; L770-P772 VanDerWaalsContact C-CD 3.43Å; L770-C773 WeakPolarHBondContact O-CA 3.43Å; L770-C773 WeakPolarHBondContact O-CB 3.44Å; L770-C773 PolarHBondContact O-N 3.27Å; L770-L774 PolarHBondContact O-N 3.22Å
771	L	87.6	Confident	87	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-52.7	-41.9	-180	-176.3	69.4	0	0	0	114.1	F330 A767 C773 L774 L775 L819	F330-L771 HydrophobicContact CD1-CD1 4.04Å; F330-L771 HydrophobicContact CE1-CB 4.31Å; F330-L771 HydrophobicContact CE1-CD1 4.25Å; A767-L771 WeakPolarHBondContact O-CB 3.3Å; A767-L771 PolarHBondContact O-N 2.85Å; L771-C773 PolarHBondContact O-N 3.34Å; L771-L774 PolarHBondContact O-N 3.04Å; L771-L774 VanDerWaalsContact O-N 3.16Å; L771-L775 HydrophobicContact CD1-CD1 4.31Å; L771-L775 HydrophobicContact CD1-CG 4.15Å; L771-L775 HydrophobicContact CD2-CD1 4.49Å; L771-L775 HydrophobicContact CG-CD1 4.04Å; L771-L775 HydrophobicContact CG-CG 4.28Å; L771-L775 WeakPolarHBondContact O-CG 3.38Å; L771-L775 PolarHBondContact O-N 3.09Å; L771-L819 HydrophobicContact CD2-CD1 4.23Å; L771-L819 HydrophobicContact CD2-CD2 3.4Å; L771-L819 VanDerWaalsContact CD2-CD2 3.4Å; L771-L819 HydrophobicContact CD2-CG 4.27Å
772	P	87.2	Confident	87	Confident	4 Å²	4	17.2 Å²	17.2	3%	0.026	8%	0.084	C	C	.	.	H	α-helix	trans	-59.9	-34.5	175.4	-21.9	31.9	0	0	0	113.2	K453 L770 H776 L809	K453-P772 WeakPolarHBondContact O-CB 3.4Å; L770-P772 VanDerWaalsContact C-CD 3.43Å; P772-H776 VanDerWaalsContact O-CB 3.3Å; P772-H776 WeakPolarHBondContact O-CB 3.4Å; P772-H776 PolarHBondContact O-N 3.11Å; P772-H776 VanDerWaalsContact O-N 3.12Å; P772-L809 HydrophobicContact CB-CD1 4.16Å; P772-L809 HydrophobicContact CB-CD2 3.93Å; P772-L809 HydrophobicContact CG-CD2 4.01Å
773	C	87.3	Confident	86.9	Confident	1 Å²	1	15.8 Å²	15.8	1%	0.007	8%	0.078	C	C	.	.	H	α-helix	trans	-73.2	-38.3	177.1	-60	0	0	0	0	111	A455 Y462 A465 L770 L771 A777	A455-C773 PolarHBondContact N-SG 2.74Å; A455-C773 VanDerWaalsContact N-SG 3.39Å; Y462-C773 HydrophobicContact CD2-CB 4.47Å; A465-C773 HydrophobicContact CB-CB 3.78Å; L770-C773 WeakPolarHBondContact O-CA 3.43Å; L770-C773 WeakPolarHBondContact O-CB 3.44Å; L770-C773 PolarHBondContact O-N 3.27Å; L771-C773 PolarHBondContact O-N 3.34Å; C773-A777 WeakPolarHBondContact O-CB 3.21Å; C773-A777 PolarHBondContact O-N 3Å
774	L	87.8	Confident	86.9	Confident	0 Å²	0	21 Å²	21	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-66.8	-45.3	177	-175.9	65.4	0	0	0	112	L266 I327 F330 L466 C469 L770 L771 H776 A777 A778	L266-L774 HydrophobicContact CD1-CD1 4.27Å; L266-L774 HydrophobicContact CD2-CD1 3.84Å; I327-L774 HydrophobicContact CG1-CD2 4.49Å; F330-L774 HydrophobicContact CB-CD2 3.66Å; F330-L774 HydrophobicContact CD1-CD2 3.31Å; F330-L774 HydrophobicContact CD2-CD2 4.11Å; F330-L774 HydrophobicContact CE1-CD2 3.9Å; F330-L774 HydrophobicContact CG-CD2 3.41Å; F330-L774 VanDerWaalsContact CG-CD2 3.41Å; F330-L774 HydrophobicContact CZ-CD2 4.5Å; L466-L774 HydrophobicContact CD2-CD1 4.33Å; C469-L774 HydrophobicContact CB-CD1 3.91Å; C469-L774 HydrophobicContact CB-CD2 4.48Å; L770-L774 PolarHBondContact O-N 3.22Å; L771-L774 PolarHBondContact O-N 3.04Å; L771-L774 VanDerWaalsContact O-N 3.16Å; L774-H776 VanDerWaalsContact C-N 3.34Å; L774-H776 PolarHBondContact O-N 3.35Å; L774-A777 WeakPolarHBondContact O-CB 2.92Å; L774-A777 PolarHBondContact O-N 3.09Å; L774-A778 WeakPolarHBondContact O-CB 3.47Å; L774-A778 PolarHBondContact O-N 3.02Å
775	L	88.1	Confident	86.8	Confident	2 Å²	2	22.2 Å²	22.2	1%	0.01	11%	0.107	C	C	.	.	H	α-helix	trans	-65.5	-38.6	177.4	-68.6	176.1	0	0	0	111.7	I327 L771 A778 I779 L809 L819 F822 I823 L826	I327-L775 HydrophobicContact CG2-CD2 4.14Å; L771-L775 HydrophobicContact CD1-CD1 4.31Å; L771-L775 HydrophobicContact CD1-CG 4.15Å; L771-L775 HydrophobicContact CD2-CD1 4.49Å; L771-L775 HydrophobicContact CG-CD1 4.04Å; L771-L775 HydrophobicContact CG-CG 4.28Å; L771-L775 WeakPolarHBondContact O-CG 3.38Å; L771-L775 PolarHBondContact O-N 3.09Å; L775-A778 PolarHBondContact O-N 2.74Å; L775-I779 VanDerWaalsContact O-CG1 3.27Å; L775-I779 WeakPolarHBondContact O-CG1 3.44Å; L775-I779 PolarHBondContact O-N 2.96Å; L775-L809 HydrophobicContact CD1-CD2 4.14Å; L775-L819 HydrophobicContact CD1-CD1 3.84Å; L775-F822 HydrophobicContact CD1-CD1 4.44Å; L775-F822 HydrophobicContact CD1-CE1 4.33Å; L775-F822 HydrophobicContact CD2-CD1 4.48Å; L775-F822 HydrophobicContact CD2-CE1 4.28Å; L775-I823 HydrophobicContact CD2-CG1 4.32Å; L775-L826 HydrophobicContact CD2-CD1 4Å
776	H	87.3	Confident	86.6	Confident	9 Å²	9	19.2 Å²	19.2	4%	0.042	9%	0.091	C	C	.	.	H	α-helix	trans	-60	-46.4	171.2	178.6	-163.9	0	0	0	111.1	Y449 L452 S454 P772 L774 A778 I779 M780	Y449-H776 AromaticContact CD1-NE2 3.99Å; L452-H776 HydrophobicContact CD1-CB 4.15Å; S454-H776 PolarHBondContact OG-ND1 3.11Å; P772-H776 VanDerWaalsContact O-CB 3.3Å; P772-H776 WeakPolarHBondContact O-CB 3.4Å; P772-H776 PolarHBondContact O-N 3.11Å; P772-H776 VanDerWaalsContact O-N 3.12Å; L774-H776 VanDerWaalsContact C-N 3.34Å; L774-H776 PolarHBondContact O-N 3.35Å; H776-A778 VanDerWaalsContact C-N 3.32Å; H776-A778 PolarHBondContact O-N 3.26Å; H776-I779 PolarHBondContact O-N 3.23Å; H776-M780 WeakPolarHBondContact O-CG 3.36Å; H776-M780 PolarHBondContact O-N 3.37Å
777	A	86.3	Confident	86.2	Confident	4 Å²	4	23.3 Å²	23.3	3%	0.033	12%	0.119	C	C	.	.	H	α-helix	trans	-61	-39.7	176.8	0	0	0	0	0	113	L266 Y462 L466 C773 L774 M780 K781	L266-A777 HydrophobicContact CD1-CB 3.69Å; Y462-A777 HydrophobicContact CE1-CB 4.46Å; Y462-A777 HydrophobicContact CE2-CB 3.79Å; Y462-A777 VanDerWaalsContact OH-CA 3.24Å; Y462-A777 WeakPolarHBondContact OH-CA 3.11Å; Y462-A777 WeakPolarHBondContact OH-CB 3.48Å; L466-A777 HydrophobicContact CD2-CB 3.76Å; C773-A777 WeakPolarHBondContact O-CB 3.21Å; C773-A777 PolarHBondContact O-N 3Å; L774-A777 WeakPolarHBondContact O-CB 2.92Å; L774-A777 PolarHBondContact O-N 3.09Å; A777-M780 PolarHBondContact O-N 3.35Å; A777-K781 WeakPolarHBondContact O-CB 3.41Å; A777-K781 PolarHBondContact O-N 2.66Å
778	A	88.3	Confident	85.7	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.3	-45.6	177	0	0	0	0	0	112.2	L266 L323 I327 L774 L775 H776 M780 K781 L782 L826	L266-A778 HydrophobicContact CD1-CB 4.34Å; L323-A778 HydrophobicContact CD1-CB 4.17Å; L323-A778 HydrophobicContact CD2-CB 4.42Å; I327-A778 HydrophobicContact CD1-CB 3.38Å; I327-A778 HydrophobicContact CG1-CB 4.41Å; L774-A778 WeakPolarHBondContact O-CB 3.47Å; L774-A778 PolarHBondContact O-N 3.02Å; L775-A778 PolarHBondContact O-N 2.74Å; H776-A778 VanDerWaalsContact C-N 3.32Å; H776-A778 PolarHBondContact O-N 3.26Å; A778-M780 VanDerWaalsContact C-N 3.33Å; A778-M780 PolarHBondContact O-N 3.15Å; A778-K781 PolarHBondContact O-N 3.48Å; A778-L782 WeakPolarHBondContact O-CG 3.31Å; A778-L782 PolarHBondContact O-N 3.23Å; A778-L826 HydrophobicContact CB-CD1 4.34Å
779	I	87.7	Confident	85	Confident	2 Å²	2	26.8 Å²	26.8	1%	0.01	14%	0.142	C	C	.	.	H	α-helix	trans	-63.3	-41.8	176.8	-64.1	164.6	0	0	0	110.5	Y449 L775 H776 K781 L782 K783 I798 A805 F822 L826	Y449-I779 HydrophobicContact CE1-CG2 3.77Å; L775-I779 VanDerWaalsContact O-CG1 3.27Å; L775-I779 WeakPolarHBondContact O-CG1 3.44Å; L775-I779 PolarHBondContact O-N 2.96Å; H776-I779 PolarHBondContact O-N 3.23Å; I779-K781 VanDerWaalsContact C-N 3.34Å; I779-L782 PolarHBondContact O-N 3.03Å; I779-K783 WeakPolarHBondContact O-CB 3.45Å; I779-K783 PolarHBondContact O-N 3.24Å; I779-I798 HydrophobicContact CG2-CG2 4.11Å; I779-A805 HydrophobicContact CD1-CB 4.08Å; I779-F822 HydrophobicContact CD1-CZ 4.24Å; I779-L826 HydrophobicContact CG1-CD2 4.16Å
780	M	85.3	Confident	84.5	Confident	58 Å²	58	30 Å²	30	29%	0.286	16%	0.161	S	C	.	.	H	α-helix	trans	-65.2	-38.3	176.3	-73.1	-59.7	-63.9	0	0	112.2	Y449 H776 A777 A778 K783 Q784	Y449-M780 HydrophobicContact CD1-SD 4Å; Y449-M780 HydrophobicContact CD2-SD 3.94Å; Y449-M780 HydrophobicContact CE1-SD 3.96Å; Y449-M780 HydrophobicContact CE2-SD 3.91Å; Y449-M780 HydrophobicContact CG-SD 4.01Å; H776-M780 WeakPolarHBondContact O-CG 3.36Å; H776-M780 PolarHBondContact O-N 3.37Å; A777-M780 PolarHBondContact O-N 3.35Å; A778-M780 VanDerWaalsContact C-N 3.33Å; A778-M780 PolarHBondContact O-N 3.15Å; M780-K783 PolarHBondContact O-N 3.11Å; M780-Q784 WeakPolarHBondContact O-CB 3.32Å; M780-Q784 PolarHBondContact O-N 2.66Å
781	K	85.8	Confident	83.9	Confident	32 Å²	32	30.2 Å²	30.2	14%	0.139	16%	0.162	C	C	.	.	H	α-helix	trans	-64.9	-45.8	175.2	-173.8	56.8	172.6	166.4	0	111.1	L266 F268 A777 A778 I779 K783 Q784 E785	L266-K781 HydrophobicContact CB-CG 4.42Å; L266-K781 WeakPolarHBondContact O-CE 3.08Å; F268-K781 HydrophobicContact CB-CG 4.46Å; F268-K781 HydrophobicContact CD2-CG 4.49Å; A777-K781 WeakPolarHBondContact O-CB 3.41Å; A777-K781 PolarHBondContact O-N 2.66Å; A778-K781 PolarHBondContact O-N 3.48Å; I779-K781 VanDerWaalsContact C-N 3.34Å; K781-K783 VanDerWaalsContact C-N 3.33Å; K781-K783 PolarHBondContact O-N 3.49Å; K781-Q784 WeakPolarHBondContact O-CB 3.49Å; K781-Q784 PolarHBondContact O-N 3.13Å; K781-E785 HydrophobicContact CD-CG 4.36Å; K781-E785 WeakPolarHBondContact CE-OE1 3.42Å; K781-E785 IonicContact NZ-OE1 3.72Å; K781-E785 PolarHBondContact NZ-OE1 3.06Å; K781-E785 WeakPolarHBondContact O-CG 3.23Å; K781-E785 PolarHBondContact O-N 3.09Å
782	L	85.8	Confident	83.5	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-59.4	-42.6	174.8	-74	167.6	0	0	0	112	F268 L323 A778 I779 E785 E786 I798 L826 M829 E830 I833	F268-L782 HydrophobicContact CE2-CD2 3.9Å; L323-L782 HydrophobicContact CD2-CD1 4.38Å; L323-L782 HydrophobicContact CD2-CD2 4.09Å; L323-L782 HydrophobicContact CD2-CG 3.89Å; A778-L782 WeakPolarHBondContact O-CG 3.31Å; A778-L782 PolarHBondContact O-N 3.23Å; I779-L782 PolarHBondContact O-N 3.03Å; L782-E785 PolarHBondContact O-N 2.5Å; L782-E786 WeakPolarHBondContact O-CB 3.49Å; L782-E786 PolarHBondContact O-N 2.61Å; L782-I798 HydrophobicContact CB-CD1 4.26Å; L782-L826 HydrophobicContact CD1-CB 4.17Å; L782-L826 HydrophobicContact CD1-CD2 3.8Å; L782-M829 HydrophobicContact CD1-CB 4.27Å; L782-M829 HydrophobicContact CD1-SD 4.47Å; L782-M829 HydrophobicContact CD2-CB 4.17Å; L782-E830 HydrophobicContact CD2-CB 4.19Å; L782-I833 HydrophobicContact CD2-CD1 3.85Å
783	K	86	Confident	83.2	Confident	50 Å²	50	34.8 Å²	34.8	22%	0.217	19%	0.192	C	C	.	.	H	α-helix	trans	-62.6	-42.2	175.4	-178.3	176.8	-177.8	178.4	0	112.3	D445 Y449 I779 M780 K781 S787	D445-K783 VanDerWaalsContact CB-NZ 3.28Å; D445-K783 IonicContact OD2-NZ 3.54Å; D445-K783 PolarHBondContact OD2-NZ 3.49Å; Y449-K783 HydrophobicContact CE2-CD 4.32Å; I779-K783 WeakPolarHBondContact O-CB 3.45Å; I779-K783 PolarHBondContact O-N 3.24Å; M780-K783 PolarHBondContact O-N 3.11Å; K781-K783 VanDerWaalsContact C-N 3.33Å; K781-K783 PolarHBondContact O-N 3.49Å; K783-S787 WeakPolarHBondContact O-CB 3.45Å; K783-S787 PolarHBondContact O-N 3.4Å
784	Q	85.1	Confident	83.1	Confident	111 Å²	111	34.9 Å²	34.9	52%	0.519	19%	0.193	S	C	.	.	H	α-helix	trans	-61.3	-47.2	178	-175.9	-177	6.8	0	0	110.8	M780 K781 S787	M780-Q784 WeakPolarHBondContact O-CB 3.32Å; M780-Q784 PolarHBondContact O-N 2.66Å; K781-Q784 WeakPolarHBondContact O-CB 3.49Å; K781-Q784 PolarHBondContact O-N 3.13Å; Q784-S787 PolarHBondContact O-N 3.27Å; Q784-S787 PolarHBondContact O-OG 2.9Å
785	E	82.6	Confident	82.9	Confident	26 Å²	26	39 Å²	39	12%	0.121	21%	0.212	C	C	.	.	H	α-helix	trans	-71.4	-36.3	-179.5	-60.4	-66.5	154	0	0	112.1	F268 K781 L782 V788 E789 I833 R837	F268-E785 HydrophobicContact CD1-CB 4.35Å; F268-E785 HydrophobicContact CD1-CG 3.67Å; F268-E785 HydrophobicContact CD2-CG 4.05Å; F268-E785 HydrophobicContact CE1-CB 3.9Å; F268-E785 HydrophobicContact CE1-CG 3.75Å; F268-E785 HydrophobicContact CE2-CB 4.27Å; F268-E785 HydrophobicContact CE2-CG 4.11Å; F268-E785 HydrophobicContact CG-CG 3.83Å; F268-E785 HydrophobicContact CZ-CB 3.86Å; F268-E785 HydrophobicContact CZ-CG 3.98Å; K781-E785 HydrophobicContact CD-CG 4.36Å; K781-E785 WeakPolarHBondContact CE-OE1 3.42Å; K781-E785 IonicContact NZ-OE1 3.72Å; K781-E785 PolarHBondContact NZ-OE1 3.06Å; K781-E785 WeakPolarHBondContact O-CG 3.23Å; K781-E785 PolarHBondContact O-N 3.09Å; L782-E785 PolarHBondContact O-N 2.5Å; E785-V788 WeakPolarHBondContact O-CB 3.35Å; E785-V788 PolarHBondContact O-N 3.39Å; E785-E789 PolarHBondContact O-N 2.81Å; E785-I833 HydrophobicContact CB-CG2 4.39Å; E785-R837 IonicContact OE2-CZ 2.96Å; E785-R837 IonicContact OE2-NH1 2.81Å; E785-R837 PolarHBondContact OE2-NH1 3.47Å; E785-R837 IonicContact OE2-NH2 3.42Å; E785-R837 PolarHBondContact OE2-NH2 3.41Å
786	E	82.5	Confident	82.8	Confident	16 Å²	16	45.1 Å²	45.1	8%	0.075	24%	0.239	C	C	.	.	H	α-helix	trans	-66	-36.7	175.6	-174.3	-85	147.6	0	0	111.9	L782 V788 E789 N790 I791 V794 I798 I833	L782-E786 WeakPolarHBondContact O-CB 3.49Å; L782-E786 PolarHBondContact O-N 2.61Å; E786-V788 PolarHBondContact O-N 3.14Å; E786-V788 VanDerWaalsContact O-N 3.12Å; E786-E789 CarbonylContact O-C 3.57Å; E786-E789 PolarHBondContact O-N 3Å; E786-N790 PolarHBondContact O-N 3.38Å; E786-I791 PolarHBondContact OE1-N 3.16Å; E786-V794 HydrophobicContact CB-CG1 4.46Å; E786-V794 HydrophobicContact CG-CB 4.13Å; E786-V794 HydrophobicContact CG-CG1 3.93Å; E786-I798 HydrophobicContact CB-CD1 3.87Å; E786-I798 HydrophobicContact CG-CD1 4.03Å; E786-I833 HydrophobicContact CB-CD1 4.24Å
787	S	78.1	Confident	82.7	Confident	86 Å²	86	46.7 Å²	46.7	60%	0.601	25%	0.251	S	S	*	.	H	α-helix	trans	-61.3	-22.7	176.1	73.3	0	0	0	0	114	K783 Q784	K783-S787 WeakPolarHBondContact O-CB 3.45Å; K783-S787 PolarHBondContact O-N 3.4Å; Q784-S787 PolarHBondContact O-N 3.27Å; Q784-S787 PolarHBondContact O-OG 2.9Å
788	V	77.3	Confident	82.7	Confident	99 Å²	99	46.8 Å²	46.8	60%	0.6	25%	0.251	S	S	*	.	H	α-helix	trans	-81.8	-35.6	174.5	-178.4	0	0	0	0	110.8	E785 E786	E785-V788 WeakPolarHBondContact O-CB 3.35Å; E785-V788 PolarHBondContact O-N 3.39Å; E786-V788 PolarHBondContact O-N 3.14Å; E786-V788 VanDerWaalsContact O-N 3.12Å
789	E	73.1	Confident	82.6	Confident	18 Å²	18	51.6 Å²	51.6	8%	0.084	27%	0.273	C	S	.	.	H	α-helix	trans	-94.7	-19.8	-173.5	-61.1	-64.5	171.4	0	0	114.4	E785 E786 I791 I833 R837 K840	E785-E789 PolarHBondContact O-N 2.81Å; E786-E789 CarbonylContact O-C 3.57Å; E786-E789 PolarHBondContact O-N 3Å; E789-I791 HydrophobicContact CB-CD1 4.01Å; E789-I791 HydrophobicContact CB-CG1 4.05Å; E789-I833 HydrophobicContact CG-CG2 4.05Å; E789-R837 WeakPolarHBondContact OE1-CB 3.45Å; E789-R837 IonicContact OE1-CZ 2.78Å; E789-R837 IonicContact OE1-NE 3.05Å; E789-R837 PolarHBondContact OE1-NE 2.82Å; E789-R837 IonicContact OE1-NH2 3.22Å; E789-K840 PolarHBondContact O-NZ 2.96Å; E789-K840 WeakPolarHBondContact OE2-CD 3.27Å; E789-K840 WeakPolarHBondContact OE2-CE 3.27Å; E789-K840 IonicContact OE2-NZ 3.08Å; E789-K840 PolarHBondContact OE2-NZ 2.89Å
790	N	75.3	Confident	82.5	Confident	112 Å²	112	56.8 Å²	56.8	60%	0.599	30%	0.297	S	S	*	.			trans	52	65.3	176.9	-166.6	13.5	0	0	0	113.5	E786	E786-N790 PolarHBondContact O-N 3.38Å
791	I	77.4	Confident	82.6	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.021	28%	0.284	C	S	.	.			trans	-111.7	107.9	-175.3	-53.2	172.1	0	0	0	109.7	E786 E789 S793 V794 E795 I833 A836	E786-I791 PolarHBondContact OE1-N 3.16Å; E789-I791 HydrophobicContact CB-CD1 4.01Å; E789-I791 HydrophobicContact CB-CG1 4.05Å; I791-S793 VanDerWaalsContact C-N 3.31Å; I791-S793 WeakPolarHBondContact CG2-OG 3.24Å; I791-S793 PolarHBondContact O-N 3.2Å; I791-V794 HydrophobicContact CB-CB 4.21Å; I791-V794 HydrophobicContact CB-CG2 4.09Å; I791-V794 HydrophobicContact CG2-CB 4.27Å; I791-V794 HydrophobicContact CG2-CG2 3.76Å; I791-V794 PolarHBondContact O-N 3Å; I791-V794 VanDerWaalsContact O-N 3.1Å; I791-E795 PolarHBondContact O-N 3.37Å; I791-I833 HydrophobicContact CD1-CG1 4.49Å; I791-A836 HydrophobicContact CD1-CB 3.38Å; I791-A836 HydrophobicContact CG1-CB 4.4Å
792	P	80	Confident	82.5	Confident	54 Å²	54	52.9 Å²	52.9	35%	0.351	28%	0.28	S	S	.	.	H	α-helix	trans	-67.7	-26.4	-168.9	26	-35	0	0	0	114.3	K796	P792-K796 WeakPolarHBondContact O-CG 3.23Å; P792-K796 PolarHBondContact O-N 3.25Å
793	S	81.3	Confident	82.4	Confident	45 Å²	45	55.8 Å²	55.8	32%	0.315	30%	0.301	S	S	.	.	H	α-helix	trans	-71.2	-38.5	175.7	58.6	0	0	0	0	111.8	I791 S797	I791-S793 VanDerWaalsContact C-N 3.31Å; I791-S793 WeakPolarHBondContact CG2-OG 3.24Å; I791-S793 PolarHBondContact O-N 3.2Å; S793-S797 WeakPolarHBondContact O-CB 3.42Å; S793-S797 PolarHBondContact O-N 2.9Å; S793-S797 PolarHBondContact O-OG 3.05Å
794	V	83.6	Confident	82.3	Confident	4 Å²	4	56.6 Å²	56.6	2%	0.024	31%	0.305	C	S	.	.	H	α-helix	trans	-74.1	-41.2	178.1	-177.9	0	0	0	0	110.5	E786 I791 K796 S797 I798 M829 V832 I833	E786-V794 HydrophobicContact CB-CG1 4.46Å; E786-V794 HydrophobicContact CG-CB 4.13Å; E786-V794 HydrophobicContact CG-CG1 3.93Å; I791-V794 HydrophobicContact CB-CB 4.21Å; I791-V794 HydrophobicContact CB-CG2 4.09Å; I791-V794 HydrophobicContact CG2-CB 4.27Å; I791-V794 HydrophobicContact CG2-CG2 3.76Å; I791-V794 PolarHBondContact O-N 3Å; I791-V794 VanDerWaalsContact O-N 3.1Å; V794-K796 VanDerWaalsContact C-N 3.33Å; V794-K796 PolarHBondContact O-N 3.34Å; V794-S797 CarbonylContact O-C 3.29Å; V794-S797 WeakPolarHBondContact O-CA 3.48Å; V794-S797 WeakPolarHBondContact O-CB 2.97Å; V794-S797 PolarHBondContact O-N 2.85Å; V794-I798 HydrophobicContact CG1-CD1 3.91Å; V794-I798 HydrophobicContact CG1-CG1 4.19Å; V794-I798 WeakPolarHBondContact O-CG1 3.34Å; V794-I798 PolarHBondContact O-N 3.13Å; V794-M829 HydrophobicContact CG1-CB 4.31Å; V794-M829 HydrophobicContact CG1-CG 4.48Å; V794-V832 HydrophobicContact CG2-CB 4.24Å; V794-V832 HydrophobicContact CG2-CG1 3.68Å; V794-I833 HydrophobicContact CG1-CD1 4.02Å; V794-I833 HydrophobicContact CG1-CG1 4.09Å; V794-I833 HydrophobicContact CG2-CG1 4.48Å
795	E	84.5	Confident	82.1	Confident	86 Å²	86	51.4 Å²	51.4	40%	0.402	28%	0.281	S	S	.	.	H	α-helix	trans	-54	-48.7	175.7	-167.5	-167.1	173.2	0	0	111.8	I791 S797 I798 Q799	I791-E795 PolarHBondContact O-N 3.37Å; E795-S797 VanDerWaalsContact C-N 3.29Å; E795-S797 PolarHBondContact O-N 3.08Å; E795-I798 PolarHBondContact O-N 2.88Å; E795-Q799 WeakPolarHBondContact O-CG 3.4Å; E795-Q799 PolarHBondContact O-N 3.49Å; E795-Q799 VanDerWaalsContact O-N 3.08Å
796	K	85.9	Confident	81.9	Confident	131 Å²	131	51.8 Å²	51.8	57%	0.57	28%	0.284	S	S	*	.	H	α-helix	trans	-61.6	-39	175.3	-71.4	173.1	-174.2	168.8	0	111.9	P792 V794 Q799 Q800	P792-K796 WeakPolarHBondContact O-CG 3.23Å; P792-K796 PolarHBondContact O-N 3.25Å; V794-K796 VanDerWaalsContact C-N 3.33Å; V794-K796 PolarHBondContact O-N 3.34Å; K796-Q799 PolarHBondContact O-N 2.87Å; K796-Q800 VanDerWaalsContact O-CG 3.29Å; K796-Q800 WeakPolarHBondContact O-CG 3.37Å; K796-Q800 PolarHBondContact O-N 3.21Å
797	S	85.8	Confident	81.8	Confident	42 Å²	42	59 Å²	59	29%	0.294	32%	0.315	S	S	.	.	H	α-helix	trans	-67.8	-38.3	179.2	-58.8	0	0	0	0	111.7	S793 V794 E795 Q800 A801	S793-S797 WeakPolarHBondContact O-CB 3.42Å; S793-S797 PolarHBondContact O-N 2.9Å; S793-S797 PolarHBondContact O-OG 3.05Å; V794-S797 CarbonylContact O-C 3.29Å; V794-S797 WeakPolarHBondContact O-CA 3.48Å; V794-S797 WeakPolarHBondContact O-CB 2.97Å; V794-S797 PolarHBondContact O-N 2.85Å; E795-S797 VanDerWaalsContact C-N 3.29Å; E795-S797 PolarHBondContact O-N 3.08Å; S797-Q800 PolarHBondContact O-N 3.09Å; S797-A801 VanDerWaalsContact O-CB 3.31Å; S797-A801 WeakPolarHBondContact O-CB 3.42Å; S797-A801 PolarHBondContact O-N 2.87Å
798	I	86.4	Confident	81.8	Confident	6 Å²	6	56.7 Å²	56.7	3%	0.031	30%	0.296	C	S	.	.	H	α-helix	trans	-63.8	-45.2	174.6	-69.2	170.1	0	0	0	110.6	I779 L782 E786 V794 E795 Q800 A801 A802 M829	I779-I798 HydrophobicContact CG2-CG2 4.11Å; L782-I798 HydrophobicContact CB-CD1 4.26Å; E786-I798 HydrophobicContact CB-CD1 3.87Å; E786-I798 HydrophobicContact CG-CD1 4.03Å; V794-I798 HydrophobicContact CG1-CD1 3.91Å; V794-I798 HydrophobicContact CG1-CG1 4.19Å; V794-I798 WeakPolarHBondContact O-CG1 3.34Å; V794-I798 PolarHBondContact O-N 3.13Å; E795-I798 PolarHBondContact O-N 2.88Å; I798-Q800 VanDerWaalsContact C-N 3.33Å; I798-Q800 PolarHBondContact O-N 2.98Å; I798-A801 PolarHBondContact O-N 2.92Å; I798-A802 PolarHBondContact O-N 3.49Å; I798-M829 HydrophobicContact CG1-SD 3.98Å
799	Q	85.1	Confident	81.5	Confident	100 Å²	100	52.2 Å²	52.2	47%	0.467	27%	0.268	S	S	.	.	H	α-helix	trans	-61.3	-42.2	176.1	-68.7	175.9	8.1	0	0	111.7	E795 K796 S803	E795-Q799 WeakPolarHBondContact O-CG 3.4Å; E795-Q799 PolarHBondContact O-N 3.49Å; E795-Q799 VanDerWaalsContact O-N 3.08Å; K796-Q799 PolarHBondContact O-N 2.87Å; Q799-S803 PolarHBondContact O-N 2.91Å
800	Q	86.3	Confident	81.4	Confident	112 Å²	112	56.1 Å²	56.1	52%	0.523	29%	0.286	S	S	.	.	H	α-helix	trans	-63.6	-45.2	174.2	-71.9	175.7	17.5	0	0	111.3	K796 S797 I798 A802 S803 Q804	K796-Q800 VanDerWaalsContact O-CG 3.29Å; K796-Q800 WeakPolarHBondContact O-CG 3.37Å; K796-Q800 PolarHBondContact O-N 3.21Å; S797-Q800 PolarHBondContact O-N 3.09Å; I798-Q800 VanDerWaalsContact C-N 3.33Å; I798-Q800 PolarHBondContact O-N 2.98Å; Q800-A802 PolarHBondContact O-N 2.92Å; Q800-S803 PolarHBondContact O-N 3.17Å; Q800-S803 VanDerWaalsContact O-N 3.16Å; Q800-S803 PolarHBondContact O-OG 3.31Å; Q800-Q804 WeakPolarHBondContact O-CG 3.41Å; Q800-Q804 PolarHBondContact O-N 3.37Å
801	A	85.9	Confident	80.9	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.008	27%	0.273	C	S	.	.	H	α-helix	trans	-62	-41.7	179.4	0	0	0	0	0	112.2	S797 I798 S803 Q804 A805 F822 L826 M829	S797-A801 VanDerWaalsContact O-CB 3.31Å; S797-A801 WeakPolarHBondContact O-CB 3.42Å; S797-A801 PolarHBondContact O-N 2.87Å; I798-A801 PolarHBondContact O-N 2.92Å; A801-S803 VanDerWaalsContact C-N 3.31Å; A801-S803 PolarHBondContact O-N 3.32Å; A801-Q804 PolarHBondContact O-N 3.37Å; A801-A805 VanDerWaalsContact O-CB 3.27Å; A801-A805 WeakPolarHBondContact O-CB 3.48Å; A801-A805 PolarHBondContact O-N 3.22Å; A801-F822 HydrophobicContact CB-CE2 3.85Å; A801-F822 HydrophobicContact CB-CZ 4.15Å; A801-F822 WeakPolarHBondContact O-CE2 3.43Å; A801-L826 HydrophobicContact CB-CD2 4.31Å; A801-M829 HydrophobicContact CB-CE 3.92Å
802	A	84.7	Confident	79.9	Confident	7 Å²	7	56.8 Å²	56.8	6%	0.058	31%	0.306	C	S	.	.	H	α-helix	trans	-59.4	-41.9	174.3	0	0	0	0	0	111.9	Y449 I798 Q800 N806	Y449-A802 HydrophobicContact CE1-CB 4.34Å; I798-A802 PolarHBondContact O-N 3.49Å; Q800-A802 PolarHBondContact O-N 2.92Å; A802-N806 PolarHBondContact O-N 3.06Å
803	S	82.8	Confident	79.2	Confident	62 Å²	62	61.2 Å²	61.2	43%	0.434	33%	0.327	S	S	.	.	H	α-helix	trans	-69.1	-35	177.3	80.6	0	0	0	0	113.4	Q799 Q800 A801	Q799-S803 PolarHBondContact O-N 2.91Å; Q800-S803 PolarHBondContact O-N 3.17Å; Q800-S803 VanDerWaalsContact O-N 3.16Å; Q800-S803 PolarHBondContact O-OG 3.31Å; A801-S803 VanDerWaalsContact C-N 3.31Å; A801-S803 PolarHBondContact O-N 3.32Å
804	Q	83.8	Confident	78.5	Confident	66 Å²	66	61 Å²	61	31%	0.308	32%	0.319	S	S	.	.	H	α-helix	trans	-73.4	-42.7	177.2	-71.2	-179.6	14.1	0	0	111.3	Q800 A801 N806 K807 L808 F822	Q800-Q804 WeakPolarHBondContact O-CG 3.41Å; Q800-Q804 PolarHBondContact O-N 3.37Å; A801-Q804 PolarHBondContact O-N 3.37Å; Q804-N806 PolarHBondContact O-N 2.98Å; Q804-K807 PolarHBondContact O-N 3.45Å; Q804-L808 WeakPolarHBondContact O-CG 3.48Å; Q804-L808 PolarHBondContact O-N 2.9Å; Q804-F822 HydrophobicContact CB-CD2 4.42Å; Q804-F822 HydrophobicContact CB-CE2 4.19Å
805	A	81.7	Confident	78.2	Confident	2 Å²	2	64.2 Å²	64.2	2%	0.017	34%	0.336	C	S	.	.	H	α-helix	trans	-55.3	-41.8	174.5	0	0	0	0	0	111	L452 I779 A801 K807 L808 L809 F822	L452-A805 HydrophobicContact CD2-CB 3.63Å; I779-A805 HydrophobicContact CD1-CB 4.08Å; A801-A805 VanDerWaalsContact O-CB 3.27Å; A801-A805 WeakPolarHBondContact O-CB 3.48Å; A801-A805 PolarHBondContact O-N 3.22Å; A805-K807 VanDerWaalsContact C-N 3.33Å; A805-K807 PolarHBondContact O-N 3.08Å; A805-L808 PolarHBondContact O-N 3.45Å; A805-L809 HydrophobicContact CB-CD1 4.22Å; A805-L809 WeakPolarHBondContact O-CB 3.36Å; A805-L809 WeakPolarHBondContact O-CG 3.25Å; A805-L809 PolarHBondContact O-N 2.67Å; A805-F822 HydrophobicContact CB-CE1 4.31Å; A805-F822 HydrophobicContact CB-CE2 4.45Å; A805-F822 HydrophobicContact CB-CZ 3.81Å
806	N	78.7	Confident	78	Confident	35 Å²	35	64.9 Å²	64.9	19%	0.187	34%	0.336	C	S	.	.	H	α-helix	trans	-56.1	-46	175.2	-166.3	10	0	0	0	111.9	Q451 L452 A802 Q804 H810	Q451-N806 PolarHBondContact O-OD1 2.7Å; Q451-N806 VanDerWaalsContact O-OD1 3.09Å; Q451-N806 PolarHBondContact OE1-ND2 2.9Å; Q451-N806 VanDerWaalsContact OE1-ND2 3.13Å; L452-N806 HydrophobicContact CD2-CB 4.4Å; A802-N806 PolarHBondContact O-N 3.06Å; Q804-N806 PolarHBondContact O-N 2.98Å; N806-H810 PolarHBondContact O-CD2 2.74Å; N806-H810 PolarHBondContact O-N 3.16Å; N806-H810 PolarHBondContact OD1-CD2 3.1Å; N806-H810 PolarHBondContact OD1-NE2 3.39Å
807	K	79.6	Confident	77.8	Confident	168 Å²	168	65.6 Å²	65.6	73%	0.73	34%	0.339	S	S	*	.	H	α-helix	trans	-68.1	-38.4	179.2	-65.5	176.2	-176.1	171.8	0	113.2	Q804 A805	Q804-K807 PolarHBondContact O-N 3.45Å; A805-K807 VanDerWaalsContact C-N 3.33Å; A805-K807 PolarHBondContact O-N 3.08Å
808	L	77.6	Confident	77.8	Confident	37 Å²	37	69 Å²	69	19%	0.194	35%	0.348	C	S	.	.	H	α-helix	trans	-73.8	-40	-178.2	-67.4	172.4	0	0	0	111.7	Q804 A805 S811 Y814 K818 F822	Q804-L808 WeakPolarHBondContact O-CG 3.48Å; Q804-L808 PolarHBondContact O-N 2.9Å; A805-L808 PolarHBondContact O-N 3.45Å; L808-S811 PolarHBondContact O-N 2.88Å; L808-S811 PolarHBondContact O-OG 3.4Å; L808-Y814 WeakPolarHBondContact O-CE1 3.46Å; L808-K818 HydrophobicContact CD2-CB 4.08Å; L808-K818 HydrophobicContact CD2-CD 4.43Å; L808-F822 HydrophobicContact CD1-CB 3.99Å; L808-F822 HydrophobicContact CD1-CD2 4.23Å; L808-F822 HydrophobicContact CD1-CG 4.02Å
809	L	72.3	Confident	77.7	Confident	4 Å²	4	69 Å²	69	2%	0.021	35%	0.348	C	S	.	.	H	α-helix	trans	-78.3	-17.9	-173.7	-64	175.3	0	0	0	115	L452 P772 L775 A805 Y814	L452-L809 HydrophobicContact CD2-CD1 3.97Å; P772-L809 HydrophobicContact CB-CD1 4.16Å; P772-L809 HydrophobicContact CB-CD2 3.93Å; P772-L809 HydrophobicContact CG-CD2 4.01Å; L775-L809 HydrophobicContact CD1-CD2 4.14Å; A805-L809 HydrophobicContact CB-CD1 4.22Å; A805-L809 WeakPolarHBondContact O-CB 3.36Å; A805-L809 WeakPolarHBondContact O-CG 3.25Å; A805-L809 PolarHBondContact O-N 2.67Å; L809-Y814 HydrophobicContact CD2-CE1 3.87Å; L809-Y814 PolarHBondContact O-OH 3.03Å
810	H	70.2	Confident	77.7	Confident	100 Å²	100	69 Å²	69	46%	0.463	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-7.7	173.6	-77.3	-63.4	0	0	0	114.1	Q451 N806	Q451-H810 PolarHBondContact O-NE2 3.25Å; Q451-H810 VanDerWaalsContact O-NE2 3.11Å; N806-H810 PolarHBondContact O-CD2 2.74Å; N806-H810 PolarHBondContact O-N 3.16Å; N806-H810 PolarHBondContact OD1-CD2 3.1Å; N806-H810 PolarHBondContact OD1-NE2 3.39Å
811	S	65.2	Low	77.8	Confident	45 Å²	45	67.3 Å²	67.3	32%	0.315	34%	0.343	S	S	.	.			trans	-75	132	178.1	69.3	0	0	0	0	111	L808 N813	L808-S811 PolarHBondContact O-N 2.88Å; L808-S811 PolarHBondContact O-OG 3.4Å; S811-N813 PolarHBondContact O-N 3.02Å; S811-N813 PolarHBondContact OG-O 3.22Å
812	A	57.5	Low	77.9	Confident	86 Å²	86	67.4 Å²	67.4	71%	0.711	34%	0.343	S	S	*	.	S	Bend	trans	-65.3	-21.4	179.7	0	0	0	0	0	113.2
813	N	63.6	Low	78.1	Confident	147 Å²	147	67.3 Å²	67.3	79%	0.786	34%	0.341	S	S	*	.	S	Bend	trans	-129.8	113.8	175.7	-70.6	-37.1	0	0	0	109.4	S811 D815	S811-N813 PolarHBondContact O-N 3.02Å; S811-N813 PolarHBondContact OG-O 3.22Å; N813-D815 PolarHBondContact O-N 3.04Å
814	Y	68.4	Low	78.4	Confident	39 Å²	39	67.9 Å²	67.9	15%	0.153	34%	0.34	C	S	.	.			trans	-71	128.3	176.2	-63.8	-86.2	0	0	0	111	H768 L808 L809 Y816	H768-Y814 AromaticContact CD2-CE2 3.96Å; H768-Y814 AromaticContact CE1-CD2 3.11Å; H768-Y814 WeakPolarHBondContact CE1-CD2 3.45Å; H768-Y814 AromaticContact CE1-CE2 3.65Å; H768-Y814 AromaticContact CE1-CG 3.98Å; H768-Y814 AromaticContact NE2-CD2 3.06Å; H768-Y814 WeakPolarHBondContact NE2-CD2 3.28Å; H768-Y814 AromaticContact NE2-CE2 3.24Å; H768-Y814 WeakPolarHBondContact NE2-CE2 3.29Å; L808-Y814 WeakPolarHBondContact O-CE1 3.46Å; L809-Y814 HydrophobicContact CD2-CE1 3.87Å; L809-Y814 PolarHBondContact O-OH 3.03Å; Y814-Y816 PolarHBondContact O-N 3.12Å
815	D	76.3	Confident	78.7	Confident	72 Å²	72	68.3 Å²	68.3	39%	0.385	34%	0.342	S	S	.	.			trans	-78.4	98.8	166.8	-172.9	-14.6	0	0	0	108	N813 K817 K818 L819	N813-D815 PolarHBondContact O-N 3.04Å; D815-K817 PolarHBondContact O-N 3.41Å; D815-K817 VanDerWaalsContact O-N 3.08Å; D815-K817 PolarHBondContact OD1-N 3.28Å; D815-K818 HydrophobicContact CB-CB 4.16Å; D815-K818 HydrophobicContact CB-CD 4.01Å; D815-K818 HydrophobicContact CB-CG 4.16Å; D815-K818 PolarHBondContact O-N 3.15Å; D815-K818 VanDerWaalsContact OD2-CD 3.3Å; D815-K818 WeakPolarHBondContact OD2-CD 3.5Å; D815-K818 WeakPolarHBondContact OD2-CE 3.39Å; D815-K818 WeakPolarHBondContact OD2-CG 3.36Å; D815-K818 IonicContact OD2-NZ 3.28Å; D815-K818 PolarHBondContact OD2-NZ 3.04Å; D815-L819 PolarHBondContact O-N 3.4Å
816	Y	79.3	Confident	79.1	Confident	101 Å²	101	68.4 Å²	68.4	40%	0.396	34%	0.342	S	S	.	.	H	α-helix	trans	-52.1	-33.2	-175.9	-75.3	-85.8	0	0	0	112.8	F331 C334 Y814 L819 E820	F331-Y816 AromaticContact CE2-CD1 3.68Å; F331-Y816 HydrophobicContact CE2-CD1 3.68Å; F331-Y816 HydrophobicContact CE2-CE1 4.3Å; F331-Y816 AromaticContact CZ-CD1 3.71Å; F331-Y816 HydrophobicContact CZ-CD1 3.71Å; F331-Y816 HydrophobicContact CZ-CG 4.45Å; F331-Y816 WeakPolarHBondContact CZ-O 3.34Å; C334-Y816 HydrophobicContact CB-CE1 4.49Å; Y814-Y816 PolarHBondContact O-N 3.12Å; Y816-L819 PolarHBondContact O-N 3.36Å; Y816-E820 WeakPolarHBondContact O-CB 3.43Å; Y816-E820 PolarHBondContact O-N 3.01Å
817	K	83.7	Confident	79.5	Confident	145 Å²	145	68.3 Å²	68.3	63%	0.63	34%	0.342	S	S	*	.	H	α-helix	trans	-70.4	-44.1	178.9	-171.7	174	-178.7	177.3	0	112.3	D815 L819 E820 D821	D815-K817 PolarHBondContact O-N 3.41Å; D815-K817 VanDerWaalsContact O-N 3.08Å; D815-K817 PolarHBondContact OD1-N 3.28Å; K817-L819 PolarHBondContact O-N 3.21Å; K817-E820 PolarHBondContact O-N 3.3Å; K817-D821 VanDerWaalsContact O-CG 3.27Å; K817-D821 PolarHBondContact O-N 2.87Å
818	K	84.9	Confident	80	Confident	115 Å²	115	64.2 Å²	64.2	50%	0.5	33%	0.332	S	S	.	.	H	α-helix	trans	-66.4	-31.5	176.4	-69.1	179.1	-174.2	136.3	0	112.2	L808 D815 F822	L808-K818 HydrophobicContact CD2-CB 4.08Å; L808-K818 HydrophobicContact CD2-CD 4.43Å; D815-K818 HydrophobicContact CB-CB 4.16Å; D815-K818 HydrophobicContact CB-CD 4.01Å; D815-K818 HydrophobicContact CB-CG 4.16Å; D815-K818 PolarHBondContact O-N 3.15Å; D815-K818 VanDerWaalsContact OD2-CD 3.3Å; D815-K818 WeakPolarHBondContact OD2-CD 3.5Å; D815-K818 WeakPolarHBondContact OD2-CE 3.39Å; D815-K818 WeakPolarHBondContact OD2-CG 3.36Å; D815-K818 IonicContact OD2-NZ 3.28Å; D815-K818 PolarHBondContact OD2-NZ 3.04Å; K818-F822 WeakPolarHBondContact O-CB 3.45Å; K818-F822 PolarHBondContact O-N 2.89Å
819	L	83.3	Confident	80.5	Confident	4 Å²	4	63.2 Å²	63.2	2%	0.021	33%	0.326	C	S	.	.	H	α-helix	trans	-71.7	-40.6	176.7	-173.5	57.2	0	0	0	111.4	F331 L771 L775 D815 Y816 K817 F822 I823	F331-L819 HydrophobicContact CD2-CD2 3.84Å; F331-L819 HydrophobicContact CD2-CG 4.13Å; F331-L819 HydrophobicContact CE2-CB 4.14Å; F331-L819 HydrophobicContact CE2-CD2 3.35Å; F331-L819 HydrophobicContact CE2-CG 3.7Å; F331-L819 HydrophobicContact CZ-CB 4.41Å; F331-L819 HydrophobicContact CZ-CD2 4.35Å; F331-L819 HydrophobicContact CZ-CG 4.39Å; L771-L819 HydrophobicContact CD2-CD1 4.23Å; L771-L819 HydrophobicContact CD2-CD2 3.4Å; L771-L819 VanDerWaalsContact CD2-CD2 3.4Å; L771-L819 HydrophobicContact CD2-CG 4.27Å; L775-L819 HydrophobicContact CD1-CD1 3.84Å; D815-L819 PolarHBondContact O-N 3.4Å; Y816-L819 PolarHBondContact O-N 3.36Å; K817-L819 PolarHBondContact O-N 3.21Å; L819-F822 WeakPolarHBondContact O-CB 3.4Å; L819-F822 PolarHBondContact O-N 2.92Å; L819-I823 HydrophobicContact CG-CD1 4.48Å; L819-I823 VanDerWaalsContact O-CG1 3.29Å; L819-I823 WeakPolarHBondContact O-CG1 3.41Å; L819-I823 PolarHBondContact O-N 3.38Å
820	E	86.6	Confident	81.3	Confident	102 Å²	102	63 Å²	63	48%	0.477	33%	0.325	S	S	.	.	H	α-helix	trans	-62.3	-46.7	171.4	-173.4	177	-169.7	0	0	111.5	F331 Y816 K817 F822 I823 N824	F331-E820 HydrophobicContact CE1-CB 4Å; F331-E820 HydrophobicContact CE1-CG 4.44Å; F331-E820 HydrophobicContact CZ-CB 4.37Å; Y816-E820 WeakPolarHBondContact O-CB 3.43Å; Y816-E820 PolarHBondContact O-N 3.01Å; K817-E820 PolarHBondContact O-N 3.3Å; E820-F822 VanDerWaalsContact C-N 3.25Å; E820-F822 PolarHBondContact O-N 2.98Å; E820-I823 PolarHBondContact O-N 3.47Å; E820-I823 VanDerWaalsContact O-N 3.17Å; E820-N824 VanDerWaalsContact O-CG 3.31Å; E820-N824 PolarHBondContact O-N 2.91Å; E820-N824 PolarHBondContact O-ND2 3.01Å
821	D	87.4	Confident	82.1	Confident	76 Å²	76	59.4 Å²	59.4	41%	0.406	31%	0.31	S	S	.	.	H	α-helix	trans	-58.4	-38.6	174.4	-68.8	-26.9	0	0	0	111.7	K817 N824 Q825	K817-D821 VanDerWaalsContact O-CG 3.27Å; K817-D821 PolarHBondContact O-N 2.87Å; D821-N824 PolarHBondContact O-N 3.46Å; D821-Q825 WeakPolarHBondContact O-CG 3.4Å; D821-Q825 PolarHBondContact O-N 2.92Å; D821-Q825 VanDerWaalsContact O-N 3.11Å
822	F	89.3	Confident	83.1	Confident	3 Å²	3	58.9 Å²	58.9	1%	0.013	31%	0.305	C	S	.	.	H	α-helix	trans	-68.4	-41.4	175.8	-178.8	-104.4	0	0	0	112.5	L775 I779 A801 Q804 A805 L808 K818 L819 E820 N824 Q825 L826	L775-F822 HydrophobicContact CD1-CD1 4.44Å; L775-F822 HydrophobicContact CD1-CE1 4.33Å; L775-F822 HydrophobicContact CD2-CD1 4.48Å; L775-F822 HydrophobicContact CD2-CE1 4.28Å; I779-F822 HydrophobicContact CD1-CZ 4.24Å; A801-F822 HydrophobicContact CB-CE2 3.85Å; A801-F822 HydrophobicContact CB-CZ 4.15Å; A801-F822 WeakPolarHBondContact O-CE2 3.43Å; Q804-F822 HydrophobicContact CB-CD2 4.42Å; Q804-F822 HydrophobicContact CB-CE2 4.19Å; A805-F822 HydrophobicContact CB-CE1 4.31Å; A805-F822 HydrophobicContact CB-CE2 4.45Å; A805-F822 HydrophobicContact CB-CZ 3.81Å; L808-F822 HydrophobicContact CD1-CB 3.99Å; L808-F822 HydrophobicContact CD1-CD2 4.23Å; L808-F822 HydrophobicContact CD1-CG 4.02Å; K818-F822 WeakPolarHBondContact O-CB 3.45Å; K818-F822 PolarHBondContact O-N 2.89Å; L819-F822 WeakPolarHBondContact O-CB 3.4Å; L819-F822 PolarHBondContact O-N 2.92Å; E820-F822 VanDerWaalsContact C-N 3.25Å; E820-F822 PolarHBondContact O-N 2.98Å; F822-N824 VanDerWaalsContact C-N 3.33Å; F822-Q825 WeakPolarHBondContact O-CB 3.48Å; F822-Q825 PolarHBondContact O-N 2.96Å; F822-L826 HydrophobicContact CD1-CD1 4.41Å; F822-L826 HydrophobicContact CE1-CD1 3.9Å; F822-L826 HydrophobicContact CE1-CG 4.29Å; F822-L826 HydrophobicContact CZ-CD1 4.42Å; F822-L826 HydrophobicContact CZ-CD2 4.27Å; F822-L826 HydrophobicContact CZ-CG 4.46Å; F822-L826 PolarHBondContact O-N 3.21Å; F822-L826 VanDerWaalsContact O-N 3.16Å
823	I	88.8	Confident	84.5	Confident	4 Å²	4	54.8 Å²	54.8	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-61.6	-45	174.3	-68.7	164.5	0	0	0	109.7	I327 F331 L775 L819 E820 Q825 L826 V827	I327-I823 HydrophobicContact CB-CG2 4.49Å; I327-I823 HydrophobicContact CG2-CB 4.48Å; I327-I823 HydrophobicContact CG2-CD1 4.01Å; I327-I823 HydrophobicContact CG2-CG1 3.84Å; I327-I823 HydrophobicContact CG2-CG2 3.84Å; F331-I823 HydrophobicContact CB-CD1 3.63Å; F331-I823 HydrophobicContact CD1-CD1 4.02Å; F331-I823 HydrophobicContact CD2-CD1 3.94Å; F331-I823 HydrophobicContact CG-CD1 3.58Å; L775-I823 HydrophobicContact CD2-CG1 4.32Å; L819-I823 HydrophobicContact CG-CD1 4.48Å; L819-I823 VanDerWaalsContact O-CG1 3.29Å; L819-I823 WeakPolarHBondContact O-CG1 3.41Å; L819-I823 PolarHBondContact O-N 3.38Å; E820-I823 PolarHBondContact O-N 3.47Å; E820-I823 VanDerWaalsContact O-N 3.17Å; I823-Q825 PolarHBondContact O-N 3.36Å; I823-L826 WeakPolarHBondContact O-CA 3.38Å; I823-L826 WeakPolarHBondContact O-CB 3.37Å; I823-L826 PolarHBondContact O-N 2.94Å; I823-V827 HydrophobicContact CG2-CG2 4.32Å; I823-V827 WeakPolarHBondContact O-CG2 3.45Å; I823-V827 PolarHBondContact O-N 3.3Å
824	N	88.9	Confident	85.6	Confident	74 Å²	74	48 Å²	48	40%	0.396	24%	0.235	S	C	.	.	H	α-helix	trans	-58.4	-34.9	176.4	-70.8	-32.7	0	0	0	112.5	E820 D821 F822 V827 T828	E820-N824 VanDerWaalsContact O-CG 3.31Å; E820-N824 PolarHBondContact O-N 2.91Å; E820-N824 PolarHBondContact O-ND2 3.01Å; D821-N824 PolarHBondContact O-N 3.46Å; F822-N824 VanDerWaalsContact C-N 3.33Å; N824-V827 PolarHBondContact O-N 3.45Å; N824-T828 PolarHBondContact O-N 2.9Å; N824-T828 PolarHBondContact O-OG1 3Å
825	Q	89.6	Confident	86.4	Confident	76 Å²	76	47.5 Å²	47.5	36%	0.355	23%	0.234	S	C	.	.	H	α-helix	trans	-64.1	-42.5	172	-70.3	171.5	12.3	0	0	112	D821 F822 I823 T828 M829	D821-Q825 WeakPolarHBondContact O-CG 3.4Å; D821-Q825 PolarHBondContact O-N 2.92Å; D821-Q825 VanDerWaalsContact O-N 3.11Å; F822-Q825 WeakPolarHBondContact O-CB 3.48Å; F822-Q825 PolarHBondContact O-N 2.96Å; I823-Q825 PolarHBondContact O-N 3.36Å; Q825-T828 PolarHBondContact O-N 3.39Å; Q825-M829 HydrophobicContact CB-CE 4.36Å; Q825-M829 WeakPolarHBondContact O-CG 3.3Å; Q825-M829 PolarHBondContact O-N 3.39Å
826	L	89.2	Confident	86.8	Confident	4 Å²	4	44.1 Å²	44.1	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-64.2	-40.6	175.4	-60.4	-179.6	0	0	0	111.8	L775 A778 I779 L782 A801 F822 I823 T828 M829 E830	L775-L826 HydrophobicContact CD2-CD1 4Å; A778-L826 HydrophobicContact CB-CD1 4.34Å; I779-L826 HydrophobicContact CG1-CD2 4.16Å; L782-L826 HydrophobicContact CD1-CB 4.17Å; L782-L826 HydrophobicContact CD1-CD2 3.8Å; A801-L826 HydrophobicContact CB-CD2 4.31Å; F822-L826 HydrophobicContact CD1-CD1 4.41Å; F822-L826 HydrophobicContact CE1-CD1 3.9Å; F822-L826 HydrophobicContact CE1-CG 4.29Å; F822-L826 HydrophobicContact CZ-CD1 4.42Å; F822-L826 HydrophobicContact CZ-CD2 4.27Å; F822-L826 HydrophobicContact CZ-CG 4.46Å; F822-L826 PolarHBondContact O-N 3.21Å; F822-L826 VanDerWaalsContact O-N 3.16Å; I823-L826 WeakPolarHBondContact O-CA 3.38Å; I823-L826 WeakPolarHBondContact O-CB 3.37Å; I823-L826 PolarHBondContact O-N 2.94Å; L826-T828 VanDerWaalsContact C-N 3.31Å; L826-T828 PolarHBondContact O-N 3.07Å; L826-M829 HydrophobicContact CD2-CE 4.46Å; L826-M829 HydrophobicContact CD2-SD 4.44Å; L826-M829 WeakPolarHBondContact O-CB 3.47Å; L826-M829 PolarHBondContact O-N 2.84Å; L826-M829 VanDerWaalsContact O-N 3.16Å; L826-E830 PolarHBondContact O-N 3.43Å
827	V	88.6	Confident	87	Confident	32 Å²	32	42.5 Å²	42.5	19%	0.194	21%	0.209	C	C	.	.	H	α-helix	trans	-60.2	-43.7	174	-178.3	0	0	0	0	110.7	I823 N824 M829 E830 T831	I823-V827 HydrophobicContact CG2-CG2 4.32Å; I823-V827 WeakPolarHBondContact O-CG2 3.45Å; I823-V827 PolarHBondContact O-N 3.3Å; N824-V827 PolarHBondContact O-N 3.45Å; V827-M829 VanDerWaalsContact C-N 3.26Å; V827-M829 PolarHBondContact O-N 2.92Å; V827-E830 WeakPolarHBondContact O-CB 3.39Å; V827-E830 PolarHBondContact O-N 2.85Å; V827-E830 VanDerWaalsContact O-N 3.15Å; V827-T831 HydrophobicContact CG1-CG2 4.45Å; V827-T831 WeakPolarHBondContact O-CG2 3.32Å; V827-T831 PolarHBondContact O-N 2.87Å
828	T	88.6	Confident	87	Confident	83 Å²	83	35.6 Å²	35.6	51%	0.509	18%	0.179	S	C	.	.	H	α-helix	trans	-62.9	-33.2	177.2	-50.9	0	0	0	0	112.1	N824 Q825 L826 T831 V832	N824-T828 PolarHBondContact O-N 2.9Å; N824-T828 PolarHBondContact O-OG1 3Å; Q825-T828 PolarHBondContact O-N 3.39Å; L826-T828 VanDerWaalsContact C-N 3.31Å; L826-T828 PolarHBondContact O-N 3.07Å; T828-T831 WeakPolarHBondContact CA-OG1 3.41Å; T828-T831 PolarHBondContact O-OG1 3.38Å; T828-V832 VanDerWaalsContact O-CG2 3.3Å; T828-V832 WeakPolarHBondContact O-CG2 3.4Å; T828-V832 PolarHBondContact O-N 3.44Å
829	M	88.4	Confident	87	Confident	15 Å²	15	30.3 Å²	30.3	7%	0.074	16%	0.156	C	C	.	.	H	α-helix	trans	-68.4	-42.8	174.1	-66	178.3	-148.1	0	0	111.4	L782 V794 I798 A801 Q825 L826 V827 V832 I833	L782-M829 HydrophobicContact CD1-CB 4.27Å; L782-M829 HydrophobicContact CD1-SD 4.47Å; L782-M829 HydrophobicContact CD2-CB 4.17Å; V794-M829 HydrophobicContact CG1-CB 4.31Å; V794-M829 HydrophobicContact CG1-CG 4.48Å; I798-M829 HydrophobicContact CG1-SD 3.98Å; A801-M829 HydrophobicContact CB-CE 3.92Å; Q825-M829 HydrophobicContact CB-CE 4.36Å; Q825-M829 WeakPolarHBondContact O-CG 3.3Å; Q825-M829 PolarHBondContact O-N 3.39Å; L826-M829 HydrophobicContact CD2-CE 4.46Å; L826-M829 HydrophobicContact CD2-SD 4.44Å; L826-M829 WeakPolarHBondContact O-CB 3.47Å; L826-M829 PolarHBondContact O-N 2.84Å; L826-M829 VanDerWaalsContact O-N 3.16Å; V827-M829 VanDerWaalsContact C-N 3.26Å; V827-M829 PolarHBondContact O-N 2.92Å; M829-V832 PolarHBondContact O-N 2.97Å; M829-I833 VanDerWaalsContact O-CG1 3.27Å; M829-I833 WeakPolarHBondContact O-CG1 3.48Å; M829-I833 PolarHBondContact O-N 3.47Å; M829-I833 VanDerWaalsContact O-N 3.07Å
830	E	88.9	Confident	86.9	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-60.4	-46	174.9	179.8	174	-153.6	0	0	111.5	F268 G269 C321 L323 G324 L782 L826 V827 V832 I833 T834	F268-E830 HydrophobicContact CD2-CG 4.12Å; F268-E830 HydrophobicContact CE2-CB 4.14Å; F268-E830 HydrophobicContact CE2-CG 3.64Å; F268-E830 HydrophobicContact CZ-CG 4.12Å; G269-E830 PolarHBondContact N-OE1 2.69Å; C321-E830 VanDerWaalsContact CB-CD 3.45Å; C321-E830 HydrophobicContact CB-CG 3.94Å; C321-E830 WeakPolarHBondContact CB-OE2 3.43Å; L323-E830 VanDerWaalsContact CB-CD 3.46Å; L323-E830 VanDerWaalsContact CB-OE1 3.28Å; L323-E830 WeakPolarHBondContact CB-OE1 3.34Å; L323-E830 VanDerWaalsContact CB-OE2 3.26Å; L323-E830 WeakPolarHBondContact CB-OE2 3.44Å; L323-E830 PolarHBondContact N-OE1 3.06Å; L323-E830 PolarHBondContact N-OE2 3.02Å; G324-E830 PolarHBondContact N-OE2 2.7Å; L782-E830 HydrophobicContact CD2-CB 4.19Å; L826-E830 PolarHBondContact O-N 3.43Å; V827-E830 WeakPolarHBondContact O-CB 3.39Å; V827-E830 PolarHBondContact O-N 2.85Å; V827-E830 VanDerWaalsContact O-N 3.15Å; E830-V832 VanDerWaalsContact C-N 3.34Å; E830-V832 PolarHBondContact O-N 3.46Å; E830-I833 PolarHBondContact O-N 3.47Å; E830-T834 HydrophobicContact CG-CG2 4.29Å; E830-T834 VanDerWaalsContact O-CG2 3.31Å; E830-T834 WeakPolarHBondContact O-CG2 3.33Å; E830-T834 PolarHBondContact O-N 3.45Å; E830-T834 PolarHBondContact O-OG1 3.24Å
831	T	87.4	Confident	86.6	Confident	25 Å²	25	29.4 Å²	29.4	15%	0.153	16%	0.159	C	C	.	.	H	α-helix	trans	-57.5	-47.8	178.9	57.6	0	0	0	0	110.9	L319 C321 V827 T828 I833 T834 E835	L319-T831 HydrophobicContact CB-CG2 4.44Å; C321-T831 WeakPolarHBondContact SG-CG2 3.31Å; V827-T831 HydrophobicContact CG1-CG2 4.45Å; V827-T831 WeakPolarHBondContact O-CG2 3.32Å; V827-T831 PolarHBondContact O-N 2.87Å; T828-T831 WeakPolarHBondContact CA-OG1 3.41Å; T828-T831 PolarHBondContact O-OG1 3.38Å; T831-I833 PolarHBondContact O-N 3.48Å; T831-T834 WeakPolarHBondContact CA-OG1 3.28Å; T831-T834 PolarHBondContact O-N 3.49Å; T831-T834 PolarHBondContact O-OG1 2.88Å; T831-E835 WeakPolarHBondContact O-CB 3.47Å; T831-E835 VanDerWaalsContact O-CG 3.27Å; T831-E835 WeakPolarHBondContact O-CG 3.3Å; T831-E835 PolarHBondContact O-N 3.12Å
832	V	86.9	Confident	86.2	Confident	34 Å²	34	25.8 Å²	25.8	21%	0.206	14%	0.139	C	C	.	.	H	α-helix	trans	-62.5	-42.1	179.6	173.4	0	0	0	0	112	V794 T828 M829 E830 T834 E835 A836	V794-V832 HydrophobicContact CG2-CB 4.24Å; V794-V832 HydrophobicContact CG2-CG1 3.68Å; T828-V832 VanDerWaalsContact O-CG2 3.3Å; T828-V832 WeakPolarHBondContact O-CG2 3.4Å; T828-V832 PolarHBondContact O-N 3.44Å; M829-V832 PolarHBondContact O-N 2.97Å; E830-V832 VanDerWaalsContact C-N 3.34Å; E830-V832 PolarHBondContact O-N 3.46Å; V832-T834 VanDerWaalsContact C-N 3.34Å; V832-T834 PolarHBondContact O-N 3.33Å; V832-E835 PolarHBondContact O-N 3.22Å; V832-A836 WeakPolarHBondContact O-CB 3.35Å; V832-A836 PolarHBondContact O-N 3.45Å
833	I	86.3	Confident	85.7	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.8	-42.2	176.9	-64.9	166.3	0	0	0	110.3	F268 L782 E785 E786 E789 I791 V794 M829 E830 T831 A836 R837	F268-I833 HydrophobicContact CE1-CG2 4.01Å; F268-I833 HydrophobicContact CZ-CB 3.96Å; F268-I833 HydrophobicContact CZ-CD1 4.23Å; F268-I833 HydrophobicContact CZ-CG2 3.6Å; L782-I833 HydrophobicContact CD2-CD1 3.85Å; E785-I833 HydrophobicContact CB-CG2 4.39Å; E786-I833 HydrophobicContact CB-CD1 4.24Å; E789-I833 HydrophobicContact CG-CG2 4.05Å; I791-I833 HydrophobicContact CD1-CG1 4.49Å; V794-I833 HydrophobicContact CG1-CD1 4.02Å; V794-I833 HydrophobicContact CG1-CG1 4.09Å; V794-I833 HydrophobicContact CG2-CG1 4.48Å; M829-I833 VanDerWaalsContact O-CG1 3.27Å; M829-I833 WeakPolarHBondContact O-CG1 3.48Å; M829-I833 PolarHBondContact O-N 3.47Å; M829-I833 VanDerWaalsContact O-N 3.07Å; E830-I833 PolarHBondContact O-N 3.47Å; T831-I833 PolarHBondContact O-N 3.48Å; I833-A836 PolarHBondContact O-N 3.17Å; I833-R837 WeakPolarHBondContact O-CB 3.39Å; I833-R837 PolarHBondContact O-N 3.02Å
834	T	85.7	Confident	84.8	Confident	3 Å²	3	27.8 Å²	27.8	2%	0.018	16%	0.157	C	C	.	.	H	α-helix	trans	-67.6	-39.6	178.6	58.7	0	0	0	0	112.8	W243 F268 G269 A270 E830 T831 V832 A836 R837 S838	W243-T834 WeakPolarHBondContact CH2-O 3.45Å; F268-T834 HydrophobicContact CE1-CG2 4.36Å; F268-T834 HydrophobicContact CZ-CG2 4.46Å; G269-T834 VanDerWaalsContact CA-CG2 3.49Å; A270-T834 HydrophobicContact CB-CG2 4.35Å; E830-T834 HydrophobicContact CG-CG2 4.29Å; E830-T834 VanDerWaalsContact O-CG2 3.31Å; E830-T834 WeakPolarHBondContact O-CG2 3.33Å; E830-T834 PolarHBondContact O-N 3.45Å; E830-T834 PolarHBondContact O-OG1 3.24Å; T831-T834 WeakPolarHBondContact CA-OG1 3.28Å; T831-T834 PolarHBondContact O-N 3.49Å; T831-T834 PolarHBondContact O-OG1 2.88Å; V832-T834 VanDerWaalsContact C-N 3.34Å; V832-T834 PolarHBondContact O-N 3.33Å; T834-A836 VanDerWaalsContact C-N 3.35Å; T834-R837 PolarHBondContact O-N 3.45Å; T834-S838 PolarHBondContact O-N 3.08Å
835	E	85.5	Confident	83.3	Confident	30 Å²	30	27.3 Å²	27.3	14%	0.14	16%	0.156	C	C	.	.	H	α-helix	trans	-60.6	-45.3	173.6	-74.3	169.9	-176.5	0	0	110.9	P274 T315 T831 V832 S838 L839 L866	P274-E835 HydrophobicContact CB-CG 3.86Å; T315-E835 VanDerWaalsContact CG2-CD 3.42Å; T315-E835 HydrophobicContact CG2-CG 4.02Å; T315-E835 VanDerWaalsContact CG2-OE1 3.25Å; T315-E835 WeakPolarHBondContact CG2-OE1 3.4Å; T831-E835 WeakPolarHBondContact O-CB 3.47Å; T831-E835 VanDerWaalsContact O-CG 3.27Å; T831-E835 WeakPolarHBondContact O-CG 3.3Å; T831-E835 PolarHBondContact O-N 3.12Å; V832-E835 PolarHBondContact O-N 3.22Å; E835-S838 WeakPolarHBondContact O-CB 3.38Å; E835-S838 PolarHBondContact O-N 3.35Å; E835-L839 WeakPolarHBondContact O-CG 3.41Å; E835-L839 PolarHBondContact O-N 2.83Å; E835-L866 HydrophobicContact CB-CD2 3.93Å
836	A	84.6	Confident	81.5	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.008	16%	0.159	C	C	.	.	H	α-helix	trans	-60.3	-46.6	176.4	0	0	0	0	0	112	I791 V832 I833 T834 S838 L839 K840 L866	I791-A836 HydrophobicContact CD1-CB 3.38Å; I791-A836 HydrophobicContact CG1-CB 4.4Å; V832-A836 WeakPolarHBondContact O-CB 3.35Å; V832-A836 PolarHBondContact O-N 3.45Å; I833-A836 PolarHBondContact O-N 3.17Å; T834-A836 VanDerWaalsContact C-N 3.35Å; A836-S838 VanDerWaalsContact C-N 3.31Å; A836-S838 PolarHBondContact O-N 2.92Å; A836-L839 PolarHBondContact O-N 3.33Å; A836-K840 WeakPolarHBondContact O-CG 3.46Å; A836-K840 PolarHBondContact O-N 3.46Å; A836-L866 HydrophobicContact CB-CD1 3.54Å
837	R	83.8	Confident	79.7	Confident	66 Å²	66	35.5 Å²	35.5	25%	0.249	20%	0.197	C	C	.	.	H	α-helix	trans	-60.1	-41.9	177.1	-175.3	173.3	-70.2	171	-0.4	111.5	E785 E789 I833 T834 A841	E785-R837 IonicContact OE2-CZ 2.96Å; E785-R837 IonicContact OE2-NH1 2.81Å; E785-R837 PolarHBondContact OE2-NH1 3.47Å; E785-R837 IonicContact OE2-NH2 3.42Å; E785-R837 PolarHBondContact OE2-NH2 3.41Å; E789-R837 WeakPolarHBondContact OE1-CB 3.45Å; E789-R837 IonicContact OE1-CZ 2.78Å; E789-R837 IonicContact OE1-NE 3.05Å; E789-R837 PolarHBondContact OE1-NE 2.82Å; E789-R837 IonicContact OE1-NH2 3.22Å; I833-R837 WeakPolarHBondContact O-CB 3.39Å; I833-R837 PolarHBondContact O-N 3.02Å; T834-R837 PolarHBondContact O-N 3.45Å; R837-A841 WeakPolarHBondContact O-CB 3.33Å; R837-A841 PolarHBondContact O-N 3.19Å
838	S	84.6	Confident	77.7	Confident	1 Å²	1	43 Å²	43	1%	0.007	23%	0.23	C	C	.	.	H	α-helix	trans	-60.9	-50.9	174.7	-168.2	0	0	0	0	112.5	W243 E273 I275 T834 E835 A836 K840 A841 K842	W243-S838 WeakPolarHBondContact CZ3-OG 3.41Å; E273-S838 PolarHBondContact OE1-OG 3.17Å; I275-S838 WeakPolarHBondContact CD1-OG 3.5Å; T834-S838 PolarHBondContact O-N 3.08Å; E835-S838 WeakPolarHBondContact O-CB 3.38Å; E835-S838 PolarHBondContact O-N 3.35Å; A836-S838 VanDerWaalsContact C-N 3.31Å; A836-S838 PolarHBondContact O-N 2.92Å; S838-K840 PolarHBondContact O-N 3.19Å; S838-A841 PolarHBondContact O-N 2.85Å; S838-K842 WeakPolarHBondContact O-CB 3.46Å; S838-K842 WeakPolarHBondContact O-CG 3.41Å; S838-K842 PolarHBondContact O-N 3.42Å
839	L	84.6	Confident	75.6	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-58.3	-50.3	179.5	-74	172.5	0	0	0	110.1	I275 V313 E835 A836 A841 K842 F843 V862 L865 L866	I275-L839 HydrophobicContact CD1-CB 4.42Å; I275-L839 HydrophobicContact CD1-CD2 3.39Å; I275-L839 HydrophobicContact CD1-CG 3.58Å; I275-L839 HydrophobicContact CG1-CD2 4.46Å; V313-L839 HydrophobicContact CG1-CD2 4.39Å; V313-L839 HydrophobicContact CG2-CD2 3.98Å; E835-L839 WeakPolarHBondContact O-CG 3.41Å; E835-L839 PolarHBondContact O-N 2.83Å; A836-L839 PolarHBondContact O-N 3.33Å; L839-A841 PolarHBondContact O-N 3.31Å; L839-K842 PolarHBondContact O-N 2.97Å; L839-F843 HydrophobicContact CD2-CD2 4.43Å; L839-F843 HydrophobicContact CD2-CE2 3.98Å; L839-F843 WeakPolarHBondContact O-CB 3.46Å; L839-F843 WeakPolarHBondContact O-CD2 3.25Å; L839-F843 PolarHBondContact O-N 3.44Å; L839-V862 HydrophobicContact CB-CG1 3.65Å; L839-V862 HydrophobicContact CB-CG2 4.4Å; L839-V862 HydrophobicContact CD1-CG1 4.09Å; L839-L865 HydrophobicContact CD1-CB 4.26Å; L839-L866 HydrophobicContact CD1-CD2 3.77Å; L839-L866 HydrophobicContact CD1-CG 4.04Å
840	K	81.4	Confident	73.7	Confident	45 Å²	45	54.6 Å²	54.6	20%	0.196	28%	0.278	C	S	.	.	H	α-helix	trans	-58.1	-48.2	178.1	-71.5	-174.4	-171.4	170.6	0	111.8	E789 A836 S838 K842 F843 A844 V862	E789-K840 PolarHBondContact O-NZ 2.96Å; E789-K840 WeakPolarHBondContact OE2-CD 3.27Å; E789-K840 WeakPolarHBondContact OE2-CE 3.27Å; E789-K840 IonicContact OE2-NZ 3.08Å; E789-K840 PolarHBondContact OE2-NZ 2.89Å; A836-K840 WeakPolarHBondContact O-CG 3.46Å; A836-K840 PolarHBondContact O-N 3.46Å; S838-K840 PolarHBondContact O-N 3.19Å; K840-K842 VanDerWaalsContact C-N 3.28Å; K840-K842 PolarHBondContact O-N 2.88Å; K840-F843 PolarHBondContact O-N 3.27Å; K840-A844 WeakPolarHBondContact O-CB 3.41Å; K840-A844 PolarHBondContact O-N 3.22Å; K840-V862 HydrophobicContact CG-CG1 4.06Å
841	A	79.9	Confident	72	Confident	42 Å²	42	60.7 Å²	60.7	35%	0.347	31%	0.311	S	S	.	.	H	α-helix	trans	-59.3	-38.2	178.6	0	0	0	0	0	112.8	R837 S838 L839	R837-A841 WeakPolarHBondContact O-CB 3.33Å; R837-A841 PolarHBondContact O-N 3.19Å; S838-A841 PolarHBondContact O-N 2.85Å; L839-A841 PolarHBondContact O-N 3.31Å
842	K	79.3	Confident	70.7	Confident	1 Å²	1	62.1 Å²	62.1	0%	0.004	33%	0.33	C	S	.	.	H	α-helix	trans	-75.5	-29.8	179.5	-76.6	165.9	166.9	-173.6	0	113.7	W238 E273 I275 S838 L839 K840 V845	W238-K842 HydrophobicContact CB-CD 4.44Å; W238-K842 HydrophobicContact CD2-CD 3.62Å; W238-K842 HydrophobicContact CD2-CG 4.3Å; W238-K842 HydrophobicContact CE3-CB 3.76Å; W238-K842 HydrophobicContact CE3-CD 3.37Å; W238-K842 HydrophobicContact CE3-CG 3.61Å; W238-K842 HydrophobicContact CG-CD 4.16Å; W238-K842 HydrophobicContact CH2-CB 4.39Å; W238-K842 HydrophobicContact CH2-CD 4.1Å; W238-K842 HydrophobicContact CZ2-CD 4.32Å; W238-K842 HydrophobicContact CZ3-CB 3.54Å; W238-K842 HydrophobicContact CZ3-CD 3.66Å; W238-K842 HydrophobicContact CZ3-CG 3.9Å; E273-K842 IonicContact OE1-NZ 2.7Å; E273-K842 PolarHBondContact OE1-NZ 3.35Å; E273-K842 WeakPolarHBondContact OE2-CE 3.39Å; E273-K842 IonicContact OE2-NZ 3.06Å; E273-K842 PolarHBondContact OE2-NZ 3.06Å; I275-K842 HydrophobicContact CD1-CD 4.01Å; S838-K842 WeakPolarHBondContact O-CB 3.46Å; S838-K842 WeakPolarHBondContact O-CG 3.41Å; S838-K842 PolarHBondContact O-N 3.42Å; L839-K842 PolarHBondContact O-N 2.97Å; K840-K842 VanDerWaalsContact C-N 3.28Å; K840-K842 PolarHBondContact O-N 2.88Å; K842-V845 WeakPolarHBondContact O-CG2 3.31Å
843	F	78.6	Confident	69.5	Low	2 Å²	2	68.3 Å²	68.3	1%	0.009	36%	0.357	C	S	.	.	H	α-helix	trans	-92.7	-16.2	178.5	-79.3	-78.9	0	0	0	113.3	W238 L839 K840 V845 L858 F861 V862 L865 I884 I885	W238-F843 HydrophobicContact CH2-CE2 4.36Å; L839-F843 HydrophobicContact CD2-CD2 4.43Å; L839-F843 HydrophobicContact CD2-CE2 3.98Å; L839-F843 WeakPolarHBondContact O-CB 3.46Å; L839-F843 WeakPolarHBondContact O-CD2 3.25Å; L839-F843 PolarHBondContact O-N 3.44Å; K840-F843 PolarHBondContact O-N 3.27Å; F843-V845 PolarHBondContact O-N 3.24Å; F843-V845 VanDerWaalsContact O-N 3.14Å; F843-L858 HydrophobicContact CB-CD1 4.07Å; F843-L858 HydrophobicContact CB-CD2 4.16Å; F843-L858 HydrophobicContact CB-CG 4.38Å; F843-L858 HydrophobicContact CD1-CD1 4.38Å; F843-L858 HydrophobicContact CG-CD1 4.49Å; F843-F861 HydrophobicContact CE1-CE1 4.19Å; F843-F861 HydrophobicContact CZ-CE1 4.2Å; F843-V862 HydrophobicContact CD2-CG2 4.4Å; F843-L865 HydrophobicContact CE2-CD1 4.07Å; F843-L865 HydrophobicContact CZ-CD1 4.27Å; F843-I884 HydrophobicContact CD1-CG2 3.95Å; F843-I885 HydrophobicContact CE1-CG1 4.12Å
844	A	70.8	Confident	68.3	Low	47 Å²	47	69.4 Å²	69.4	39%	0.388	37%	0.365	S	S	.	.			trans	-78.4	20.1	-179.9	0	0	0	0	0	115.3	K840 D846	K840-A844 WeakPolarHBondContact O-CB 3.41Å; K840-A844 PolarHBondContact O-N 3.22Å; A844-D846 PolarHBondContact O-N 3.49Å
845	V	57.4	Low	67.5	Low	63 Å²	63	71.5 Å²	71.5	38%	0.382	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-2.7	-172.1	177.7	0	0	0	0	114.1	K842 F843	K842-V845 WeakPolarHBondContact O-CG2 3.31Å; F843-V845 PolarHBondContact O-N 3.24Å; F843-V845 VanDerWaalsContact O-N 3.14Å
846	D	50.6	Low	66.9	Low	76 Å²	76	73.9 Å²	73.9	41%	0.406	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.2	55.6	-175.9	-82.3	-27.2	0	0	0	113.3	A844 E848 R887	A844-D846 PolarHBondContact O-N 3.49Å; D846-E848 PolarHBondContact O-N 2.89Å; D846-R887 VanDerWaalsContact CG-NH1 3.26Å; D846-R887 IonicContact OD1-CZ 3.93Å; D846-R887 IonicContact OD1-NH1 2.64Å; D846-R887 PolarHBondContact OD1-NH1 3.48Å; D846-R887 IonicContact OD1-NH2 2.97Å; D846-R887 IonicContact OD2-CZ 2.8Å; D846-R887 IonicContact OD2-NH1 3.86Å; D846-R887 PolarHBondContact OD2-NH1 3.03Å; D846-R887 IonicContact OD2-NH2 2.55Å; D846-R887 PolarHBondContact OD2-NH2 2.99Å
847	E	52.1	Low	66.7	Low	176 Å²	176	79.6 Å²	79.6	82%	0.822	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-0.7	168.7	-82.6	-89.5	141.8	0	0	113.6
848	E	45.8	Very low	66.6	Low	190 Å²	190	78.1 Å²	78.1	89%	0.888	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-7.8	-173.9	-67.8	-168.4	165.8	0	0	115.2	D846	D846-E848 PolarHBondContact O-N 2.89Å
849	E	45.8	Very low	66.3	Low	164 Å²	164	82.4 Å²	82.4	77%	0.766	44%	0.44	S	S	*	.	S	Bend	trans	-143.8	97.4	177.6	-69.5	-173.1	167.2	0	0	114.4
850	E	47.9	Very low	66.2	Low	178 Å²	178	88.6 Å²	88.6	83%	0.832	47%	0.467	S	S	*	.			trans	43.3	150.1	146.2	-67	-174.7	161.8	0	0	123.9
851	N	53.8	Low	66.4	Low	128 Å²	128	87 Å²	87	68%	0.684	46%	0.46	S	S	*	.			trans	82.7	115.1	169.2	-67	-23	0	0	0	119.4	E853 A854	N851-E853 PolarHBondContact O-N 3.4Å; N851-A854 PolarHBondContact O-N 3.47Å
852	G	59.1	Low	66.6	Low	54 Å²	54	85.1 Å²	85.1	56%	0.557	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-30.2	-179.9	0	0	0	0	0	115.7	A854 A855 D856	G852-A854 PolarHBondContact O-N 3.45Å; G852-A854 VanDerWaalsContact O-N 3.15Å; G852-A855 PolarHBondContact O-N 3.21Å; G852-D856 PolarHBondContact O-N 3.36Å
853	E	60.9	Low	66.9	Low	165 Å²	165	86.7 Å²	86.7	77%	0.771	45%	0.454	S	S	*	.	H	α-helix	trans	-60.6	-27.7	176.5	-66.5	-178.4	170.6	0	0	112.6	N851 E857	N851-E853 PolarHBondContact O-N 3.4Å; E853-E857 PolarHBondContact O-N 2.87Å
854	A	62.5	Low	67.2	Low	22 Å²	22	89.7 Å²	89.7	18%	0.182	47%	0.47	C	S	.	.	H	α-helix	trans	-90.9	-13.1	-175.5	0	0	0	0	0	112.8	N851 G852 R880	N851-A854 PolarHBondContact O-N 3.47Å; G852-A854 PolarHBondContact O-N 3.45Å; G852-A854 VanDerWaalsContact O-N 3.15Å; A854-R880 PolarHBondContact O-NH1 3.07Å
855	A	68.2	Low	67.9	Low	47 Å²	47	88.1 Å²	88.1	39%	0.388	46%	0.455	S	S	.	.	H	α-helix	trans	-78.2	-40.8	165.4	0	0	0	0	0	110.4	G852 E857 L858 E859	G852-A855 PolarHBondContact O-N 3.21Å; A855-E857 VanDerWaalsContact C-N 3.29Å; A855-E857 PolarHBondContact O-N 3.43Å; A855-L858 WeakPolarHBondContact O-CB 3.33Å; A855-L858 PolarHBondContact O-N 3.19Å; A855-E859 PolarHBondContact O-N 3.12Å
856	D	73.6	Confident	69.2	Low	80 Å²	80	87.4 Å²	87.4	43%	0.428	45%	0.449	S	S	.	.	H	α-helix	trans	-59.6	-36.1	176.4	-67.3	-6.2	0	0	0	112.8	G852 K860	G852-D856 PolarHBondContact O-N 3.36Å; D856-K860 WeakPolarHBondContact O-CB 3.13Å; D856-K860 WeakPolarHBondContact O-CD 3.31Å; D856-K860 WeakPolarHBondContact O-CG 3.38Å; D856-K860 PolarHBondContact O-N 3.35Å
857	E	80.4	Confident	70.6	Confident	122 Å²	122	89.2 Å²	89.2	57%	0.57	46%	0.455	S	S	*	.	H	α-helix	trans	-65.8	-37.7	174.7	-74.9	-172.2	169.5	0	0	112.3	E853 A855 F861	E853-E857 PolarHBondContact O-N 2.87Å; A855-E857 VanDerWaalsContact C-N 3.29Å; A855-E857 PolarHBondContact O-N 3.43Å; E857-F861 WeakPolarHBondContact O-CB 3.25Å; E857-F861 PolarHBondContact O-N 2.69Å
858	L	80.3	Confident	72.1	Confident	34 Å²	34	85.2 Å²	85.2	18%	0.178	44%	0.436	C	S	.	.	H	α-helix	trans	-72.3	-42.2	178.4	-170	66.7	0	0	0	111.2	F843 A855 F861 V862 I881 I884	F843-L858 HydrophobicContact CB-CD1 4.07Å; F843-L858 HydrophobicContact CB-CD2 4.16Å; F843-L858 HydrophobicContact CB-CG 4.38Å; F843-L858 HydrophobicContact CD1-CD1 4.38Å; F843-L858 HydrophobicContact CG-CD1 4.49Å; A855-L858 WeakPolarHBondContact O-CB 3.33Å; A855-L858 PolarHBondContact O-N 3.19Å; L858-F861 WeakPolarHBondContact O-CB 3.37Å; L858-F861 PolarHBondContact O-N 3.43Å; L858-V862 WeakPolarHBondContact O-CG2 3.35Å; L858-V862 PolarHBondContact O-N 2.76Å; L858-I881 HydrophobicContact CD1-CG1 4.21Å; L858-I884 HydrophobicContact CD1-CD1 4.44Å
859	E	78.6	Confident	73.7	Confident	92 Å²	92	78 Å²	78	43%	0.43	41%	0.405	S	S	.	.	H	α-helix	trans	-60.6	-46.6	175.4	-72.8	-172.8	171.9	0	0	111.3	A855 F861 V862 T863	A855-E859 PolarHBondContact O-N 3.12Å; E859-F861 VanDerWaalsContact C-N 3.27Å; E859-F861 PolarHBondContact O-N 3.12Å; E859-V862 PolarHBondContact O-N 3.5Å; E859-T863 PolarHBondContact O-N 2.78Å; E859-T863 PolarHBondContact O-OG1 3.46Å
860	K	82.9	Confident	75.6	Confident	133 Å²	133	71.5 Å²	71.5	58%	0.578	38%	0.375	S	S	*	.	H	α-helix	trans	-58.8	-40.6	174.1	-73.2	167	-170.6	162.1	0	111.8	D856 T863 L864	D856-K860 WeakPolarHBondContact O-CB 3.13Å; D856-K860 WeakPolarHBondContact O-CD 3.31Å; D856-K860 WeakPolarHBondContact O-CG 3.38Å; D856-K860 PolarHBondContact O-N 3.35Å; K860-T863 PolarHBondContact O-N 2.89Å; K860-L864 VanDerWaalsContact O-CG 3.29Å; K860-L864 WeakPolarHBondContact O-CG 3.46Å; K860-L864 PolarHBondContact O-N 3.37Å
861	F	85.7	Confident	77.6	Confident	11 Å²	11	63.2 Å²	63.2	5%	0.048	34%	0.336	C	S	.	.	H	α-helix	trans	-65.4	-42.8	177.8	-179.3	-104.5	0	0	0	112.5	I311 F843 E857 L858 E859 L864 L865 V871 V873 I881	I311-F861 HydrophobicContact CD1-CE1 4.24Å; I311-F861 HydrophobicContact CD1-CZ 3.68Å; F843-F861 HydrophobicContact CE1-CE1 4.19Å; F843-F861 HydrophobicContact CZ-CE1 4.2Å; E857-F861 WeakPolarHBondContact O-CB 3.25Å; E857-F861 PolarHBondContact O-N 2.69Å; L858-F861 WeakPolarHBondContact O-CB 3.37Å; L858-F861 PolarHBondContact O-N 3.43Å; E859-F861 VanDerWaalsContact C-N 3.27Å; E859-F861 PolarHBondContact O-N 3.12Å; F861-L864 PolarHBondContact O-N 2.86Å; F861-L865 HydrophobicContact CD1-CD1 3.86Å; F861-L865 HydrophobicContact CD1-CG 4.41Å; F861-L865 HydrophobicContact CE1-CD1 3.41Å; F861-L865 VanDerWaalsContact CE1-CD1 3.41Å; F861-L865 HydrophobicContact CE1-CG 4.04Å; F861-L865 HydrophobicContact CZ-CD1 3.95Å; F861-L865 HydrophobicContact CZ-CD2 4.25Å; F861-L865 HydrophobicContact CZ-CG 4.15Å; F861-L865 WeakPolarHBondContact O-CG 3.49Å; F861-L865 PolarHBondContact O-N 3.13Å; F861-V871 HydrophobicContact CD2-CG1 3.89Å; F861-V871 HydrophobicContact CE2-CB 4.25Å; F861-V871 HydrophobicContact CE2-CG1 3.58Å; F861-V873 HydrophobicContact CE2-CG2 4.34Å; F861-V873 HydrophobicContact CZ-CG2 4.27Å; F861-I881 HydrophobicContact CB-CD1 3.79Å; F861-I881 HydrophobicContact CD1-CD1 4.13Å; F861-I881 HydrophobicContact CD1-CG1 4.5Å; F861-I881 HydrophobicContact CD1-CG2 3.98Å; F861-I881 HydrophobicContact CD2-CD1 3.9Å; F861-I881 HydrophobicContact CE1-CG2 3.59Å; F861-I881 HydrophobicContact CE2-CG2 4.18Å; F861-I881 HydrophobicContact CG-CD1 3.67Å; F861-I881 HydrophobicContact CG-CG2 4.41Å; F861-I881 HydrophobicContact CZ-CG2 3.72Å
862	V	85	Confident	79.2	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.012	33%	0.329	C	S	.	.	H	α-helix	trans	-64.9	-41.6	175.8	172.4	0	0	0	0	111.1	L839 K840 F843 L858 E859 L864 L865 L866	L839-V862 HydrophobicContact CB-CG1 3.65Å; L839-V862 HydrophobicContact CB-CG2 4.4Å; L839-V862 HydrophobicContact CD1-CG1 4.09Å; K840-V862 HydrophobicContact CG-CG1 4.06Å; F843-V862 HydrophobicContact CD2-CG2 4.4Å; L858-V862 WeakPolarHBondContact O-CG2 3.35Å; L858-V862 PolarHBondContact O-N 2.76Å; E859-V862 PolarHBondContact O-N 3.5Å; V862-L864 VanDerWaalsContact C-N 3.33Å; V862-L864 PolarHBondContact O-N 3Å; V862-L865 WeakPolarHBondContact O-CB 3.42Å; V862-L865 PolarHBondContact O-N 3.31Å; V862-L865 VanDerWaalsContact O-N 3.15Å; V862-L866 PolarHBondContact O-N 2.65Å
863	T	84.1	Confident	80.7	Confident	34 Å²	34	58.8 Å²	58.8	21%	0.209	30%	0.303	C	S	.	.	H	α-helix	trans	-61.3	-42.1	174.8	-55.2	0	0	0	0	111.5	E859 K860 L865 L866 E867	E859-T863 PolarHBondContact O-N 2.78Å; E859-T863 PolarHBondContact O-OG1 3.46Å; K860-T863 PolarHBondContact O-N 2.89Å; T863-L865 VanDerWaalsContact C-N 3.32Å; T863-L865 PolarHBondContact O-N 3.42Å; T863-L866 PolarHBondContact O-N 3.07Å; T863-E867 PolarHBondContact O-N 3.32Å
864	L	85.8	Confident	81.7	Confident	66 Å²	66	58.2 Å²	58.2	35%	0.346	30%	0.304	S	S	.	.	H	α-helix	trans	-63.4	-36.1	174.2	-72.4	171.2	0	0	0	112.5	K860 F861 V862 L866 E867 E868 V871	K860-L864 VanDerWaalsContact O-CG 3.29Å; K860-L864 WeakPolarHBondContact O-CG 3.46Å; K860-L864 PolarHBondContact O-N 3.37Å; F861-L864 PolarHBondContact O-N 2.86Å; V862-L864 VanDerWaalsContact C-N 3.33Å; V862-L864 PolarHBondContact O-N 3Å; L864-L866 PolarHBondContact O-N 3.42Å; L864-E867 PolarHBondContact O-N 3.41Å; L864-E868 WeakPolarHBondContact O-CB 3.39Å; L864-E868 PolarHBondContact O-N 3.11Å; L864-V871 HydrophobicContact CB-CG1 4.1Å; L864-V871 HydrophobicContact CB-CG2 3.99Å; L864-V871 WeakPolarHBondContact O-CG2 3.48Å
865	L	86.1	Confident	82.6	Confident	14 Å²	14	59.9 Å²	59.9	7%	0.073	32%	0.324	C	S	.	.	H	α-helix	trans	-66.1	-25.6	176.9	-76.5	173.2	0	0	0	113.4	I311 V313 L839 F843 F861 V862 T863 V871	I311-L865 HydrophobicContact CB-CD2 4.16Å; I311-L865 HydrophobicContact CG2-CD2 3.88Å; V313-L865 HydrophobicContact CG2-CD1 4.41Å; V313-L865 HydrophobicContact CG2-CD2 4.15Å; L839-L865 HydrophobicContact CD1-CB 4.26Å; F843-L865 HydrophobicContact CE2-CD1 4.07Å; F843-L865 HydrophobicContact CZ-CD1 4.27Å; F861-L865 HydrophobicContact CD1-CD1 3.86Å; F861-L865 HydrophobicContact CD1-CG 4.41Å; F861-L865 HydrophobicContact CE1-CD1 3.41Å; F861-L865 VanDerWaalsContact CE1-CD1 3.41Å; F861-L865 HydrophobicContact CE1-CG 4.04Å; F861-L865 HydrophobicContact CZ-CD1 3.95Å; F861-L865 HydrophobicContact CZ-CD2 4.25Å; F861-L865 HydrophobicContact CZ-CG 4.15Å; F861-L865 WeakPolarHBondContact O-CG 3.49Å; F861-L865 PolarHBondContact O-N 3.13Å; V862-L865 WeakPolarHBondContact O-CB 3.42Å; V862-L865 PolarHBondContact O-N 3.31Å; V862-L865 VanDerWaalsContact O-N 3.15Å; T863-L865 VanDerWaalsContact C-N 3.32Å; T863-L865 PolarHBondContact O-N 3.42Å; L865-V871 HydrophobicContact CD2-CB 3.88Å; L865-V871 HydrophobicContact CD2-CG2 3.75Å; L865-V871 HydrophobicContact CG-CB 4.48Å; L865-V871 HydrophobicContact CG-CG2 4.16Å
866	L	83.4	Confident	83.6	Confident	48 Å²	48	58 Å²	58	25%	0.251	31%	0.308	S	S	.	.	H	α-helix	trans	-82.2	-34	175.6	-66.1	167.3	0	0	0	112	E835 A836 L839 V862 T863 L864	E835-L866 HydrophobicContact CB-CD2 3.93Å; A836-L866 HydrophobicContact CB-CD1 3.54Å; L839-L866 HydrophobicContact CD1-CD2 3.77Å; L839-L866 HydrophobicContact CD1-CG 4.04Å; V862-L866 PolarHBondContact O-N 2.65Å; T863-L866 PolarHBondContact O-N 3.07Å; L864-L866 PolarHBondContact O-N 3.42Å
867	E	81.5	Confident	83.9	Confident	114 Å²	114	54.6 Å²	54.6	53%	0.533	29%	0.292	S	S	.	.	H	α-helix	trans	-88.2	-39.7	-176.6	-66.6	-175.4	169.1	0	0	113	T863 L864	T863-E867 PolarHBondContact O-N 3.32Å; L864-E867 PolarHBondContact O-N 3.41Å
868	E	81.8	Confident	84	Confident	92 Å²	92	56 Å²	56	43%	0.43	30%	0.299	S	S	.	.	S	Bend	trans	-101.7	142.9	-175.2	-62	-171.5	165.2	0	0	112.4	L864 E870 V871	L864-E868 WeakPolarHBondContact O-CB 3.39Å; L864-E868 PolarHBondContact O-N 3.11Å; E868-E870 VanDerWaalsContact C-N 3.31Å; E868-E870 PolarHBondContact O-N 2.86Å; E868-V871 HydrophobicContact CB-CG2 3.97Å
869	P	80	Confident	84.1	Confident	38 Å²	38	55.5 Å²	55.5	25%	0.247	30%	0.3	C	S	.	.	S	Bend	trans	-71.8	-23.3	-179	30.6	-37	0	0	0	113.9	R113 R312	R113-P869 HydrophobicContact CG-CB 4.22Å; R113-P869 HydrophobicContact CG-CG 4.47Å; R312-P869 WeakPolarHBondContact CG-O 3.37Å
870	E	86.7	Confident	84.3	Confident	27 Å²	27	56.8 Å²	56.8	13%	0.126	30%	0.301	C	S	.	.	S	Bend	trans	-152.4	120.1	178.3	179	167.1	-148.6	0	0	108.5	P112 R230 S310 I311 E868	P112-E870 HydrophobicContact CB-CB 3.92Å; P112-E870 VanDerWaalsContact CB-OE2 3.23Å; P112-E870 WeakPolarHBondContact CB-OE2 3.31Å; P112-E870 WeakPolarHBondContact CD-OE2 3.25Å; P112-E870 HydrophobicContact CG-CB 3.91Å; P112-E870 WeakPolarHBondContact CG-OE2 3.18Å; R230-E870 IonicContact CZ-OE1 2.82Å; R230-E870 IonicContact CZ-OE2 3.56Å; R230-E870 IonicContact NH1-OE1 2.85Å; R230-E870 PolarHBondContact NH1-OE1 2.7Å; R230-E870 IonicContact NH1-OE2 3.14Å; R230-E870 PolarHBondContact NH1-OE2 2.9Å; R230-E870 VanDerWaalsContact NH1-OE2 3.17Å; R230-E870 IonicContact NH2-OE1 3.25Å; R230-E870 PolarHBondContact NH2-OE1 2.91Å; R230-E870 IonicContact NH2-OE2 2.68Å; S310-E870 WeakPolarHBondContact CB-OE1 3.47Å; S310-E870 PolarHBondContact OG-OE1 3.4Å; I311-E870 CarbonylContact O-C 3.58Å; I311-E870 VanDerWaalsContact O-CA 3.29Å; I311-E870 WeakPolarHBondContact O-CA 3.48Å; E868-E870 VanDerWaalsContact C-N 3.31Å; E868-E870 PolarHBondContact O-N 2.86Å
871	V	89.6	Confident	84.4	Confident	4 Å²	4	51.8 Å²	51.8	2%	0.024	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	134.3	-176.3	-177.8	0	0	0	0	110	S310 I311 F861 L864 L865 E868	S310-V871 CarbonylContact C-O 3.59Å; S310-V871 VanDerWaalsContact CA-O 3.23Å; S310-V871 WeakPolarHBondContact CA-O 3.13Å; I311-V871 PolarHBondContact N-O 3.06Å; I311-V871 PolarHBondContact O-N 2.82Å; F861-V871 HydrophobicContact CD2-CG1 3.89Å; F861-V871 HydrophobicContact CE2-CB 4.25Å; F861-V871 HydrophobicContact CE2-CG1 3.58Å; L864-V871 HydrophobicContact CB-CG1 4.1Å; L864-V871 HydrophobicContact CB-CG2 3.99Å; L864-V871 WeakPolarHBondContact O-CG2 3.48Å; L865-V871 HydrophobicContact CD2-CB 3.88Å; L865-V871 HydrophobicContact CD2-CG2 3.75Å; L865-V871 HydrophobicContact CG-CB 4.48Å; L865-V871 HydrophobicContact CG-CG2 4.16Å; E868-V871 HydrophobicContact CB-CG2 3.97Å
872	V	88.1	Confident	84.5	Confident	86 Å²	86	51.3 Å²	51.3	52%	0.521	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	131.1	177.6	-178.8	0	0	0	0	110.5	L874	V872-L874 PolarHBondContact O-N 2.95Å
873	V	89.1	Confident	84.5	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.024	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	108.5	173.2	-175.5	0	0	0	0	108.9	W309 I311 F861 G875 A876 I881 I885	W309-V873 HydrophobicContact CB-CB 4Å; W309-V873 HydrophobicContact CB-CG2 4.2Å; W309-V873 PolarHBondContact O-N 2.92Å; I311-V873 HydrophobicContact CD1-CG2 3.76Å; I311-V873 HydrophobicContact CG1-CG2 3.91Å; F861-V873 HydrophobicContact CE2-CG2 4.34Å; F861-V873 HydrophobicContact CZ-CG2 4.27Å; V873-G875 PolarHBondContact O-N 3.34Å; V873-A876 PolarHBondContact O-N 2.9Å; V873-I881 HydrophobicContact CG1-CB 4.21Å; V873-I881 HydrophobicContact CG1-CG2 4.03Å; V873-I885 HydrophobicContact CG2-CD1 4.08Å
874	L	83.3	Confident	84.6	Confident	152 Å²	152	58.1 Å²	58.1	80%	0.796	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	119.2	178	-61.4	178	0	0	0	109.9	V872 A879	V872-L874 PolarHBondContact O-N 2.95Å; L874-A879 WeakPolarHBondContact O-CB 3.43Å
875	G	81.5	Confident	84.7	Confident	57 Å²	57	55 Å²	55	59%	0.588	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	12.1	-176.8	0	0	0	0	0	115.3	V873 Q878 A879	V873-G875 PolarHBondContact O-N 3.34Å; G875-Q878 PolarHBondContact O-N 3.24Å; G875-A879 PolarHBondContact O-N 3.45Å
876	A	87.9	Confident	84.8	Confident	8 Å²	8	55.9 Å²	55.9	7%	0.066	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	49.4	-135.3	172.1	0	0	0	0	0	112.9	A306 W309 V873 Q878 G882	A306-A876 WeakPolarHBondContact O-CB 3.29Å; W309-A876 HydrophobicContact CB-CB 4.17Å; W309-A876 HydrophobicContact CD2-CB 4.37Å; W309-A876 HydrophobicContact CG-CB 3.82Å; V873-A876 PolarHBondContact O-N 2.9Å; A876-Q878 VanDerWaalsContact C-N 3.26Å; A876-Q878 PolarHBondContact O-N 2.83Å; A876-G882 VanDerWaalsContact O-CA 3.31Å; A876-G882 WeakPolarHBondContact O-CA 3.41Å
877	G	81.3	Confident	85	Confident	8 Å²	8	58.6 Å²	58.6	8%	0.082	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-70.2	-15.2	-177.8	0	0	0	0	0	115.6	W309	W309-G877 VanDerWaalsContact CZ2-CA 3.41Å
878	Q	81.9	Confident	85.2	Confident	152 Å²	152	53.7 Å²	53.7	71%	0.71	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-86.5	-21.8	-178.5	-64.2	-172.5	-6.4	0	0	113.1	G875 A876 R883	G875-Q878 PolarHBondContact O-N 3.24Å; A876-Q878 VanDerWaalsContact C-N 3.26Å; A876-Q878 PolarHBondContact O-N 2.83Å; Q878-R883 PolarHBondContact O-NE 3.48Å; Q878-R883 PolarHBondContact O-NH2 3.48Å; Q878-R883 VanDerWaalsContact O-NH2 3.14Å
879	A	82.8	Confident	85.4	Confident	24 Å²	24	49.3 Å²	49.3	20%	0.198	25%	0.252	C	S	.	.	S	Bend	trans	-71.8	165.8	179.5	0	0	0	0	0	113.1	L874 G875 G882 R883	L874-A879 WeakPolarHBondContact O-CB 3.43Å; G875-A879 PolarHBondContact O-N 3.45Å; A879-G882 WeakPolarHBondContact O-CA 3.2Å; A879-G882 PolarHBondContact O-N 2.93Å; A879-R883 WeakPolarHBondContact O-CG 3.37Å; A879-R883 PolarHBondContact O-N 2.96Å
880	R	82	Confident	85.7	Confident	119 Å²	119	49 Å²	49	45%	0.449	25%	0.247	S	C	.	.	H	α-helix	trans	-58.9	-52.7	-177.2	-156	-177.3	-164.8	-148.1	8.7	111.6	A854 G882 R883 I884	A854-R880 PolarHBondContact O-NH1 3.07Å; R880-G882 VanDerWaalsContact C-N 3.3Å; R880-G882 PolarHBondContact O-N 3.24Å; R880-R883 PolarHBondContact O-N 3.47Å; R880-R883 VanDerWaalsContact O-N 3.16Å; R880-I884 WeakPolarHBondContact O-CG1 3.41Å; R880-I884 PolarHBondContact O-N 3Å; R880-I884 VanDerWaalsContact O-N 3.11Å
881	I	85.4	Confident	85.5	Confident	28 Å²	28	49 Å²	49	14%	0.144	25%	0.248	C	C	.	.	H	α-helix	trans	-58.8	-42.6	175.1	-66.2	162.2	0	0	0	110.7	L858 F861 V873 R883 I884 I885	L858-I881 HydrophobicContact CD1-CG1 4.21Å; F861-I881 HydrophobicContact CB-CD1 3.79Å; F861-I881 HydrophobicContact CD1-CD1 4.13Å; F861-I881 HydrophobicContact CD1-CG1 4.5Å; F861-I881 HydrophobicContact CD1-CG2 3.98Å; F861-I881 HydrophobicContact CD2-CD1 3.9Å; F861-I881 HydrophobicContact CE1-CG2 3.59Å; F861-I881 HydrophobicContact CE2-CG2 4.18Å; F861-I881 HydrophobicContact CG-CD1 3.67Å; F861-I881 HydrophobicContact CG-CG2 4.41Å; F861-I881 HydrophobicContact CZ-CG2 3.72Å; V873-I881 HydrophobicContact CG1-CB 4.21Å; V873-I881 HydrophobicContact CG1-CG2 4.03Å; I881-R883 PolarHBondContact O-N 3.15Å; I881-I884 PolarHBondContact O-N 2.93Å; I881-I885 HydrophobicContact CG2-CD1 3.76Å; I881-I885 WeakPolarHBondContact O-CD1 3.4Å; I881-I885 VanDerWaalsContact O-CG1 3.27Å; I881-I885 WeakPolarHBondContact O-CG1 3.38Å; I881-I885 PolarHBondContact O-N 2.95Å
882	G	86.8	Confident	85.2	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-54.7	-45	173.7	0	0	0	0	0	113.9	W309 A876 A879 R880 I885 H886	W309-G882 WeakPolarHBondContact CZ3-O 3.38Å; A876-G882 VanDerWaalsContact O-CA 3.31Å; A876-G882 WeakPolarHBondContact O-CA 3.41Å; A879-G882 WeakPolarHBondContact O-CA 3.2Å; A879-G882 PolarHBondContact O-N 2.93Å; R880-G882 VanDerWaalsContact C-N 3.3Å; R880-G882 PolarHBondContact O-N 3.24Å; G882-I885 PolarHBondContact O-N 3.39Å; G882-H886 WeakPolarHBondContact O-CB 3.11Å; G882-H886 PolarHBondContact O-N 3.32Å
883	R	86.3	Confident	85	Confident	161 Å²	161	47.5 Å²	47.5	61%	0.608	24%	0.238	S	C	*	.	H	α-helix	trans	-67.5	-37.2	177.7	-68.2	176.5	-160.6	-179.7	3.9	112.7	Q878 A879 R880 I881 H886 R887	Q878-R883 PolarHBondContact O-NE 3.48Å; Q878-R883 PolarHBondContact O-NH2 3.48Å; Q878-R883 VanDerWaalsContact O-NH2 3.14Å; A879-R883 WeakPolarHBondContact O-CG 3.37Å; A879-R883 PolarHBondContact O-N 2.96Å; R880-R883 PolarHBondContact O-N 3.47Å; R880-R883 VanDerWaalsContact O-N 3.16Å; I881-R883 PolarHBondContact O-N 3.15Å; R883-H886 PolarHBondContact O-N 3.42Å; R883-R887 WeakPolarHBondContact O-CB 3.37Å; R883-R887 PolarHBondContact O-N 3.42Å
884	I	85.8	Confident	84.7	Confident	18 Å²	18	54.1 Å²	54.1	9%	0.092	26%	0.263	C	S	.	.	H	α-helix	trans	-60.6	-49.3	174.6	-64.3	167.7	0	0	0	109.1	F843 L858 R880 I881 H886 R887 L888	F843-I884 HydrophobicContact CD1-CG2 3.95Å; L858-I884 HydrophobicContact CD1-CD1 4.44Å; R880-I884 WeakPolarHBondContact O-CG1 3.41Å; R880-I884 PolarHBondContact O-N 3Å; R880-I884 VanDerWaalsContact O-N 3.11Å; I881-I884 PolarHBondContact O-N 2.93Å; I884-H886 PolarHBondContact O-N 3.26Å; I884-R887 WeakPolarHBondContact O-CB 3.45Å; I884-R887 PolarHBondContact O-N 2.89Å; I884-L888 HydrophobicContact CG2-CD1 4.41Å; I884-L888 WeakPolarHBondContact O-CG 3.3Å; I884-L888 PolarHBondContact O-N 3.46Å
885	I	88.1	Confident	84.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.5	-47	178.5	-60.9	150.4	0	0	0	111.3	L280 W309 I311 F843 V873 I881 G882 R887 L888 F889	L280-I885 HydrophobicContact CD1-CG2 4.37Å; L280-I885 HydrophobicContact CD2-CG2 4.08Å; W309-I885 HydrophobicContact CZ3-CB 4.34Å; W309-I885 HydrophobicContact CZ3-CG2 4.37Å; I311-I885 HydrophobicContact CD1-CD1 3.11Å; I311-I885 HydrophobicContact CD1-CG1 3.79Å; I311-I885 HydrophobicContact CG1-CD1 4.17Å; F843-I885 HydrophobicContact CE1-CG1 4.12Å; V873-I885 HydrophobicContact CG2-CD1 4.08Å; I881-I885 HydrophobicContact CG2-CD1 3.76Å; I881-I885 WeakPolarHBondContact O-CD1 3.4Å; I881-I885 VanDerWaalsContact O-CG1 3.27Å; I881-I885 WeakPolarHBondContact O-CG1 3.38Å; I881-I885 PolarHBondContact O-N 2.95Å; G882-I885 PolarHBondContact O-N 3.39Å; I885-R887 VanDerWaalsContact C-N 3.26Å; I885-R887 PolarHBondContact O-N 3.38Å; I885-L888 WeakPolarHBondContact O-CB 3.3Å; I885-L888 PolarHBondContact O-N 3.05Å; I885-L888 VanDerWaalsContact O-N 3.11Å; I885-F889 HydrophobicContact CG2-CD2 3.79Å; I885-F889 HydrophobicContact CG2-CE2 3.71Å; I885-F889 WeakPolarHBondContact O-CD2 3.22Å; I885-F889 PolarHBondContact O-N 3.19Å
886	H	88.8	Confident	84	Confident	34 Å²	34	48.3 Å²	48.3	16%	0.157	23%	0.231	C	C	.	.	H	α-helix	trans	-56.3	-42.8	176.9	178.1	-146.4	0	0	0	111.5	W309 G882 R883 I884 F889 I890 D916 F917	W309-H886 HydrophobicContact CH2-CB 4.37Å; G882-H886 WeakPolarHBondContact O-CB 3.11Å; G882-H886 PolarHBondContact O-N 3.32Å; R883-H886 PolarHBondContact O-N 3.42Å; I884-H886 PolarHBondContact O-N 3.26Å; H886-F889 PolarHBondContact O-N 3.14Å; H886-I890 WeakPolarHBondContact NE2-CD1 3.31Å; H886-I890 WeakPolarHBondContact O-CG1 3.32Å; H886-I890 PolarHBondContact O-N 2.8Å; H886-D916 IonicContact CE1-OD2 3.94Å; H886-D916 PolarHBondContact CE1-OD2 2.63Å; H886-D916 WeakPolarHBondContact NE2-CB 3.41Å; H886-D916 IonicContact NE2-OD2 3.73Å; H886-D916 PolarHBondContact NE2-OD2 3.3Å; H886-F917 HydrophobicContact CB-CZ 4.45Å; H886-F917 AromaticContact CD2-CE2 3.59Å; H886-F917 AromaticContact CD2-CZ 3.59Å
887	R	85.6	Confident	83.2	Confident	104 Å²	104	52.9 Å²	52.9	39%	0.392	25%	0.254	S	S	.	.	H	α-helix	trans	-64.2	-41.6	175.7	-170.3	-175.6	-65	169.4	5.8	112.2	D846 R883 I884 I885 F889 I890 N891	D846-R887 VanDerWaalsContact CG-NH1 3.26Å; D846-R887 IonicContact OD1-CZ 3.93Å; D846-R887 IonicContact OD1-NH1 2.64Å; D846-R887 PolarHBondContact OD1-NH1 3.48Å; D846-R887 IonicContact OD1-NH2 2.97Å; D846-R887 IonicContact OD2-CZ 2.8Å; D846-R887 IonicContact OD2-NH1 3.86Å; D846-R887 PolarHBondContact OD2-NH1 3.03Å; D846-R887 IonicContact OD2-NH2 2.55Å; D846-R887 PolarHBondContact OD2-NH2 2.99Å; R883-R887 WeakPolarHBondContact O-CB 3.37Å; R883-R887 PolarHBondContact O-N 3.42Å; I884-R887 WeakPolarHBondContact O-CB 3.45Å; I884-R887 PolarHBondContact O-N 2.89Å; I885-R887 VanDerWaalsContact C-N 3.26Å; I885-R887 PolarHBondContact O-N 3.38Å; R887-F889 VanDerWaalsContact C-N 3.32Å; R887-F889 PolarHBondContact O-N 3.04Å; R887-I890 PolarHBondContact O-N 3.36Å; R887-N891 WeakPolarHBondContact O-CB 3.22Å; R887-N891 PolarHBondContact O-N 2.88Å; R887-N891 PolarHBondContact O-ND2 3.37Å
888	L	85.7	Confident	82.4	Confident	11 Å²	11	59.6 Å²	59.6	6%	0.058	29%	0.287	C	S	.	.	H	α-helix	trans	-57.9	-45.1	175.2	-69.4	171.9	0	0	0	111.3	L235 W238 I884 I885 N891 A892	L235-L888 HydrophobicContact CD2-CB 4.11Å; W238-L888 HydrophobicContact CE3-CD1 4.35Å; W238-L888 HydrophobicContact CZ3-CD1 3.73Å; I884-L888 HydrophobicContact CG2-CD1 4.41Å; I884-L888 WeakPolarHBondContact O-CG 3.3Å; I884-L888 PolarHBondContact O-N 3.46Å; I885-L888 WeakPolarHBondContact O-CB 3.3Å; I885-L888 PolarHBondContact O-N 3.05Å; I885-L888 VanDerWaalsContact O-N 3.11Å; L888-N891 PolarHBondContact O-N 3.45Å; L888-A892 WeakPolarHBondContact O-CB 3.46Å; L888-A892 PolarHBondContact O-N 2.96Å
889	F	87.8	Confident	81.1	Confident	1 Å²	1	54.8 Å²	54.8	0%	0.004	27%	0.274	C	S	.	.	H	α-helix	trans	-64.4	-45.2	175.9	-83.8	-80.6	0	0	0	112.7	L235 L280 I885 H886 R887 N891 A892 Q893 F917 P918	L235-F889 HydrophobicContact CB-CE1 3.88Å; L235-F889 HydrophobicContact CB-CZ 3.91Å; L235-F889 HydrophobicContact CD1-CD1 3.98Å; L235-F889 HydrophobicContact CD1-CE1 4.15Å; L235-F889 HydrophobicContact CD1-CG 4.42Å; L280-F889 HydrophobicContact CB-CE2 3.76Å; L280-F889 HydrophobicContact CB-CZ 3.84Å; L280-F889 HydrophobicContact CD2-CD2 4.24Å; L280-F889 HydrophobicContact CD2-CE2 3.79Å; L280-F889 HydrophobicContact CD2-CZ 4.4Å; L280-F889 HydrophobicContact CG-CE2 4.41Å; I885-F889 HydrophobicContact CG2-CD2 3.79Å; I885-F889 HydrophobicContact CG2-CE2 3.71Å; I885-F889 WeakPolarHBondContact O-CD2 3.22Å; I885-F889 PolarHBondContact O-N 3.19Å; H886-F889 PolarHBondContact O-N 3.14Å; R887-F889 VanDerWaalsContact C-N 3.32Å; R887-F889 PolarHBondContact O-N 3.04Å; F889-N891 VanDerWaalsContact C-N 3.27Å; F889-N891 PolarHBondContact O-N 2.79Å; F889-A892 PolarHBondContact O-N 3.45Å; F889-Q893 WeakPolarHBondContact O-CG 3.32Å; F889-Q893 PolarHBondContact O-N 3.07Å; F889-F917 HydrophobicContact CB-CD1 3.87Å; F889-F917 HydrophobicContact CB-CE1 3.9Å; F889-F917 AromaticContact CD1-CD1 3.99Å; F889-F917 HydrophobicContact CD1-CD1 3.99Å; F889-F917 HydrophobicContact CD1-CE1 4.47Å; F889-F917 HydrophobicContact CD2-CD1 4.11Å; F889-F917 AromaticContact CD2-CE1 3.76Å; F889-F917 HydrophobicContact CD2-CE1 3.76Å; F889-F917 HydrophobicContact CE2-CE1 4.43Å; F889-F917 AromaticContact CG-CD1 3.72Å; F889-F917 HydrophobicContact CG-CD1 3.72Å; F889-F917 AromaticContact CG-CE1 3.79Å; F889-F917 HydrophobicContact CG-CE1 3.79Å; F889-P918 HydrophobicContact CD1-CG 4.24Å; F889-P918 HydrophobicContact CE1-CG 4.33Å
890	I	86.4	Confident	79.1	Confident	30 Å²	30	59.9 Å²	59.9	15%	0.154	31%	0.305	C	S	.	.	H	α-helix	trans	-56.9	-45.3	175.9	-72.8	165.6	0	0	0	110.6	H886 R887 Q893 R894 D916	H886-I890 WeakPolarHBondContact NE2-CD1 3.31Å; H886-I890 WeakPolarHBondContact O-CG1 3.32Å; H886-I890 PolarHBondContact O-N 2.8Å; R887-I890 PolarHBondContact O-N 3.36Å; I890-Q893 PolarHBondContact O-N 2.74Å; I890-R894 WeakPolarHBondContact O-CG 3.4Å; I890-R894 PolarHBondContact O-N 3.05Å; I890-D916 HydrophobicContact CD1-CB 4.49Å; I890-D916 HydrophobicContact CG1-CB 3.94Å
891	N	82.2	Confident	77.3	Confident	28 Å²	28	60.4 Å²	60.4	15%	0.15	32%	0.321	C	S	.	.	H	α-helix	trans	-70.2	-40.1	-175.8	-73	-20.4	0	0	0	112.3	Q240 R887 L888 F889 Q893 R894 A895	Q240-N891 HydrophobicContact CG-CB 4.23Å; Q240-N891 PolarHBondContact NE2-ND2 3.48Å; Q240-N891 PolarHBondContact OE1-ND2 3.29Å; R887-N891 WeakPolarHBondContact O-CB 3.22Å; R887-N891 PolarHBondContact O-N 2.88Å; R887-N891 PolarHBondContact O-ND2 3.37Å; L888-N891 PolarHBondContact O-N 3.45Å; F889-N891 VanDerWaalsContact C-N 3.27Å; F889-N891 PolarHBondContact O-N 2.79Å; N891-Q893 VanDerWaalsContact C-N 3.35Å; N891-R894 PolarHBondContact O-N 3.3Å; N891-A895 WeakPolarHBondContact O-CB 3.33Å; N891-A895 PolarHBondContact O-N 2.91Å
892	A	83.4	Confident	75	Confident	16 Å²	16	66.8 Å²	66.8	13%	0.132	36%	0.355	C	S	.	.	H	α-helix	trans	-64.1	-38.5	172.8	0	0	0	0	0	112.3	L235 L888 F889 R894 A895 A896	L235-A892 HydrophobicContact CD1-CB 3.33Å; L888-A892 WeakPolarHBondContact O-CB 3.46Å; L888-A892 PolarHBondContact O-N 2.96Å; F889-A892 PolarHBondContact O-N 3.45Å; A892-R894 VanDerWaalsContact C-N 3.34Å; A892-R894 PolarHBondContact O-N 3.49Å; A892-A895 PolarHBondContact O-N 3.29Å; A892-A896 WeakPolarHBondContact O-CB 3.44Å; A892-A896 PolarHBondContact O-N 3.43Å
893	Q	83.8	Confident	72.9	Confident	42 Å²	42	74.5 Å²	74.5	20%	0.196	40%	0.397	C	S	.	.	H	α-helix	trans	-61.9	-40.4	173	-74.9	-59.6	-62.5	0	0	112.2	F889 I890 N891 L897 I914	F889-Q893 WeakPolarHBondContact O-CG 3.32Å; F889-Q893 PolarHBondContact O-N 3.07Å; I890-Q893 PolarHBondContact O-N 2.74Å; N891-Q893 VanDerWaalsContact C-N 3.35Å; Q893-L897 WeakPolarHBondContact O-CD1 3.44Å; Q893-L897 WeakPolarHBondContact O-CG 3.42Å; Q893-L897 PolarHBondContact O-N 2.88Å; Q893-I914 HydrophobicContact CB-CG2 4.23Å
894	R	81.3	Confident	70.8	Confident	143 Å²	143	74.1 Å²	74.1	54%	0.54	41%	0.406	S	S	.	.	H	α-helix	trans	-65.9	-42.9	174.9	-71.5	174.6	-175.2	170.9	2.5	112.1	I890 N891 A892 L897 L898	I890-R894 WeakPolarHBondContact O-CG 3.4Å; I890-R894 PolarHBondContact O-N 3.05Å; N891-R894 PolarHBondContact O-N 3.3Å; A892-R894 VanDerWaalsContact C-N 3.34Å; A892-R894 PolarHBondContact O-N 3.49Å; R894-L897 PolarHBondContact O-N 3.4Å; R894-L898 WeakPolarHBondContact O-CG 3.43Å; R894-L898 PolarHBondContact O-N 2.79Å
895	A	75.8	Confident	68.7	Low	26 Å²	26	81.6 Å²	81.6	22%	0.215	45%	0.446	C	S	.	.	H	α-helix	trans	-64.5	-44.4	179.2	0	0	0	0	0	111.9	N891 A892 L897 L898 A899	N891-A895 WeakPolarHBondContact O-CB 3.33Å; N891-A895 PolarHBondContact O-N 2.91Å; A892-A895 PolarHBondContact O-N 3.29Å; A895-L897 PolarHBondContact O-N 3.07Å; A895-L898 PolarHBondContact O-N 3.15Å; A895-A899 PolarHBondContact O-N 3.22Å; A895-A899 VanDerWaalsContact O-N 3.11Å
896	A	74.6	Confident	66.2	Low	62 Å²	62	90.4 Å²	90.4	51%	0.512	49%	0.487	S	S	.	.	H	α-helix	trans	-59.5	-28.1	177.2	0	0	0	0	0	113.4	A892	A892-A896 WeakPolarHBondContact O-CB 3.44Å; A892-A896 PolarHBondContact O-N 3.43Å
897	L	71.3	Confident	63.8	Low	104 Å²	104	94.8 Å²	94.8	55%	0.545	52%	0.518	S	S	.	.	H	α-helix	trans	-85.7	-19.2	176.6	-70.5	167.1	0	0	0	113.8	Q893 R894 A895 I914	Q893-L897 WeakPolarHBondContact O-CD1 3.44Å; Q893-L897 WeakPolarHBondContact O-CG 3.42Å; Q893-L897 PolarHBondContact O-N 2.88Å; R894-L897 PolarHBondContact O-N 3.4Å; A895-L897 PolarHBondContact O-N 3.07Å; L897-I914 HydrophobicContact CD1-CB 4.23Å; L897-I914 HydrophobicContact CD1-CD1 3.4Å; L897-I914 VanDerWaalsContact CD1-CD1 3.4Å; L897-I914 HydrophobicContact CD1-CG1 3.55Å; L897-I914 HydrophobicContact CD1-CG2 3.61Å
898	L	66	Low	61.4	Low	148 Å²	148	94.7 Å²	94.7	78%	0.775	54%	0.54	S	S	*	.	H	α-helix	trans	-92.8	-11.3	177.1	-72.2	168.5	0	0	0	112.8	R894 A895	R894-L898 WeakPolarHBondContact O-CG 3.43Å; R894-L898 PolarHBondContact O-N 2.79Å; A895-L898 PolarHBondContact O-N 3.15Å
899	A	52.5	Low	59.4	Low	52 Å²	52	98.9 Å²	98.9	43%	0.43	58%	0.576	S	S	.	*	S	Bend	trans	-60.5	134.9	169.2	0	0	0	0	0	109.5	A895 V901	A895-A899 PolarHBondContact O-N 3.22Å; A895-A899 VanDerWaalsContact O-N 3.11Å; A899-V901 PolarHBondContact O-N 3.3Å
900	P	42.7	Very low	57	Low	131 Å²	131	106.9 Å²	106.9	85%	0.851	61%	0.614	S	S	*	*			trans	-66.8	101.6	-175.3	27.1	-31.9	0	0	0	109
901	V	43	Very low	54.9	Low	130 Å²	130	111.4 Å²	111.4	79%	0.788	65%	0.648	S	S	*	*			trans	-68.9	128.4	161.8	-178.6	0	0	0	0	106	A899 D903	A899-V901 PolarHBondContact O-N 3.3Å; V901-D903 PolarHBondContact O-N 2.83Å
902	D	38.2	Very low	53.3	Low	162 Å²	162	120.5 Å²	120.5	87%	0.866	68%	0.68	S	S	*	*			trans	-41.1	126.1	176.1	-87.8	-43.8	0	0	0	111.1	D904	D902-D904 PolarHBondContact O-N 2.64Å
903	D	42.3	Very low	52.2	Low	162 Å²	162	129.4 Å²	129.4	87%	0.866	72%	0.716	S	S	*	*	S	Bend	trans	-68.3	89	-169.6	-155.1	14.8	0	0	0	110	V901	V901-D903 PolarHBondContact O-N 2.83Å
904	D	42.1	Very low	51.5	Low	152 Å²	152	131.4 Å²	131.4	81%	0.813	73%	0.727	S	S	*	*			trans	-157.7	20	170.3	-109.9	-14.2	0	0	0	117.2	D902	D902-D904 PolarHBondContact O-N 2.64Å
905	L	40.8	Very low	51.5	Low	176 Å²	176	128.6 Å²	128.6	92%	0.921	73%	0.727	S	S	*	*	S	Bend	trans	-141.9	118.8	168.9	-72.7	172.5	0	0	0	112.4
906	E	35.6	Very low	51.9	Low	184 Å²	184	130.5 Å²	130.5	86%	0.86	73%	0.734	S	S	*	*			trans	-51.1	147.9	-178.2	-69.6	-169.3	155.1	0	0	114.6	A908	E906-A908 PolarHBondContact O-N 3.49Å; E906-A908 VanDerWaalsContact O-N 3.15Å
907	P	39.5	Very low	52.4	Low	126 Å²	126	128.2 Å²	128.2	82%	0.818	71%	0.713	S	S	*	*			trans	-81.2	99.6	-177.5	32.8	-31.7	0	0	0	110.7	A909	P907-A909 PolarHBondContact O-N 2.93Å; P907-A909 VanDerWaalsContact O-N 3.16Å
908	A	33.8	Very low	53.3	Low	102 Å²	102	124.3 Å²	124.3	84%	0.843	69%	0.693	S	S	*	*			trans	-75.6	99.5	161.6	0	0	0	0	0	109.2	E906 E910	E906-A908 PolarHBondContact O-N 3.49Å; E906-A908 VanDerWaalsContact O-N 3.15Å; A908-E910 PolarHBondContact O-N 2.89Å; A908-E910 VanDerWaalsContact O-N 3.11Å
909	A	43.7	Very low	54.3	Low	100 Å²	100	122.5 Å²	122.5	83%	0.826	69%	0.691	S	S	*	*			trans	-63.5	102.4	170.3	0	0	0	0	0	111.2	P907	P907-A909 PolarHBondContact O-N 2.93Å; P907-A909 VanDerWaalsContact O-N 3.16Å
910	E	38	Very low	56.1	Low	168 Å²	168	122 Å²	122	79%	0.785	68%	0.683	S	S	*	*			trans	-136.9	134.9	149.2	-76.9	-171.2	166.7	0	0	108.5	A908 R912	A908-E910 PolarHBondContact O-N 2.89Å; A908-E910 VanDerWaalsContact O-N 3.11Å; E910-R912 PolarHBondContact O-N 3.2Å
911	S	43.4	Very low	58.4	Low	125 Å²	125	117.9 Å²	117.9	87%	0.874	66%	0.66	S	S	*	*			trans	-62.6	73.3	179.8	57.5	0	0	0	0	112.5	K913	S911-K913 PolarHBondContact O-N 2.92Å
912	R	47.4	Very low	60.7	Low	219 Å²	219	112 Å²	112	83%	0.826	63%	0.625	S	S	*	*			trans	-73.6	107.6	163.6	-73.5	-176.8	178.4	176.4	0.6	106.8	E910 I914	E910-R912 PolarHBondContact O-N 3.2Å; R912-I914 PolarHBondContact O-N 3.49Å
913	K	61	Low	63.3	Low	203 Å²	203	106.4 Å²	106.4	88%	0.883	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-51.6	117.6	166.6	-72.8	-176.6	177.3	-177.2	0	107	S911	S911-K913 PolarHBondContact O-N 2.92Å
914	I	69.4	Low	65.8	Low	84 Å²	84	99.1 Å²	99.1	43%	0.431	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-62.4	126	173.2	-62.1	159.8	0	0	0	105.9	Q893 L897 R912	Q893-I914 HydrophobicContact CB-CG2 4.23Å; L897-I914 HydrophobicContact CD1-CB 4.23Å; L897-I914 HydrophobicContact CD1-CD1 3.4Å; L897-I914 VanDerWaalsContact CD1-CD1 3.4Å; L897-I914 HydrophobicContact CD1-CG1 3.55Å; L897-I914 HydrophobicContact CD1-CG2 3.61Å; R912-I914 PolarHBondContact O-N 3.49Å
915	P	80	Confident	68.3	Low	84 Å²	84	91.9 Å²	91.9	55%	0.545	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-63.1	140.6	176.5	26.9	-33.1	0	0	0	109.6	F917	P915-F917 PolarHBondContact O-N 3.28Å
916	D	83.8	Confident	70.9	Confident	66 Å²	66	83.6 Å²	83.6	35%	0.353	47%	0.471	S	S	.	.	S	Bend	trans	-63.4	-27.2	-177.9	-71.4	-3.7	0	0	0	112.7	H886 I890	H886-D916 IonicContact CE1-OD2 3.94Å; H886-D916 PolarHBondContact CE1-OD2 2.63Å; H886-D916 WeakPolarHBondContact NE2-CB 3.41Å; H886-D916 IonicContact NE2-OD2 3.73Å; H886-D916 PolarHBondContact NE2-OD2 3.3Å; I890-D916 HydrophobicContact CD1-CB 4.49Å; I890-D916 HydrophobicContact CG1-CB 3.94Å
917	F	86.7	Confident	73.6	Confident	15 Å²	15	74.9 Å²	74.9	7%	0.066	43%	0.43	C	S	.	.	S	Bend	trans	-120.5	147.4	179.2	-66.1	-87.1	0	0	0	111.3	Y233 L280 P303 L304 W309 H886 F889 P915	Y233-F917 HydrophobicContact CD1-CB 4.06Å; Y233-F917 HydrophobicContact CE1-CB 4.04Å; Y233-F917 HydrophobicContact CG-CD1 4.49Å; L280-F917 HydrophobicContact CD2-CD1 4.41Å; L280-F917 HydrophobicContact CD2-CE1 3.66Å; L280-F917 HydrophobicContact CD2-CZ 4.39Å; P303-F917 HydrophobicContact CB-CD2 4.24Å; P303-F917 HydrophobicContact CB-CE2 4.27Å; P303-F917 HydrophobicContact CG-CB 4.43Å; P303-F917 HydrophobicContact CG-CD2 3.56Å; P303-F917 HydrophobicContact CG-CE2 3.98Å; P303-F917 HydrophobicContact CG-CG 4.03Å; L304-F917 HydrophobicContact CD2-CE2 3.92Å; L304-F917 HydrophobicContact CD2-CZ 4.25Å; L304-F917 HydrophobicContact CG-CE2 3.98Å; W309-F917 AromaticContact CH2-CZ 3.98Å; W309-F917 HydrophobicContact CH2-CZ 3.98Å; W309-F917 HydrophobicContact CZ2-CZ 4.25Å; H886-F917 HydrophobicContact CB-CZ 4.45Å; H886-F917 AromaticContact CD2-CE2 3.59Å; H886-F917 AromaticContact CD2-CZ 3.59Å; F889-F917 HydrophobicContact CB-CD1 3.87Å; F889-F917 HydrophobicContact CB-CE1 3.9Å; F889-F917 AromaticContact CD1-CD1 3.99Å; F889-F917 HydrophobicContact CD1-CD1 3.99Å; F889-F917 HydrophobicContact CD1-CE1 4.47Å; F889-F917 HydrophobicContact CD2-CD1 4.11Å; F889-F917 AromaticContact CD2-CE1 3.76Å; F889-F917 HydrophobicContact CD2-CE1 3.76Å; F889-F917 HydrophobicContact CE2-CE1 4.43Å; F889-F917 AromaticContact CG-CD1 3.72Å; F889-F917 HydrophobicContact CG-CD1 3.72Å; F889-F917 AromaticContact CG-CE1 3.79Å; F889-F917 HydrophobicContact CG-CE1 3.79Å; P915-F917 PolarHBondContact O-N 3.28Å
918	P	88.4	Confident	76.2	Confident	21 Å²	21	69.1 Å²	69.1	14%	0.136	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-61.2	165.3	167.4	24.5	-31.1	0	0	0	111.4	Y233 F889	Y233-P918 HydrophobicContact CD1-CG 4.49Å; Y233-P918 VanDerWaalsContact CD1-O 3.26Å; Y233-P918 WeakPolarHBondContact CD1-O 3.39Å; Y233-P918 VanDerWaalsContact CE1-O 3.27Å; Y233-P918 WeakPolarHBondContact CE1-O 3.36Å; F889-P918 HydrophobicContact CD1-CG 4.24Å; F889-P918 HydrophobicContact CE1-CG 4.33Å
919	P	87.6	Confident	79	Confident	111 Å²	111	64.6 Å²	64.6	72%	0.721	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-56.3	140.1	167.1	26	-34.3	0	0	0	110.3	A921	P919-A921 PolarHBondContact O-N 3.17Å
920	P	90.5	Very high	81.2	Confident	42 Å²	42	62.3 Å²	62.3	27%	0.273	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-61.5	128.6	-177.5	25	-33.7	0	0	0	110.3	Y231 T232 Y233 G922 R923	Y231-P920 HydrophobicContact CG-CB 4.47Å; T232-P920 CarbonylContact O-C 3.51Å; Y233-P920 HydrophobicContact CD1-CB 4.28Å; Y233-P920 HydrophobicContact CE1-CB 3.85Å; Y233-P920 HydrophobicContact CE1-CG 4.44Å; P920-G922 VanDerWaalsContact C-N 3.31Å; P920-R923 HydrophobicContact CB-CG 3.94Å; P920-R923 HydrophobicContact CG-CG 3.76Å
921	A	90.9	Very high	83.7	Confident	44 Å²	44	54.4 Å²	54.4	36%	0.364	29%	0.294	S	S	.	.	S	Bend	trans	-69.7	-32.5	-179.5	0	0	0	0	0	111.9	T232 I234 P919	T232-A921 PolarHBondContact O-N 3.26Å; I234-A921 HydrophobicContact CB-CB 4.4Å; I234-A921 HydrophobicContact CD1-CB 3.5Å; I234-A921 VanDerWaalsContact CD1-CB 3.5Å; I234-A921 HydrophobicContact CG1-CB 3.7Å; P919-A921 PolarHBondContact O-N 3.17Å
922	G	91.3	Very high	85.8	Confident	6 Å²	6	49.3 Å²	49.3	6%	0.062	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	139.6	173.5	0	0	0	0	0	111.1	T232 P920	T232-G922 PolarHBondContact N-O 3.47Å; T232-G922 PolarHBondContact O-N 2.84Å; P920-G922 VanDerWaalsContact C-N 3.31Å
923	R	93.2	Very high	87.7	Confident	45 Å²	45	41.5 Å²	41.5	17%	0.17	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	124.8	171.6	-58.7	173.7	-76.1	165.3	3.6	108.8	N202 Y231 P920 L949	N202-R923 PolarHBondContact O-NH1 2.77Å; N202-R923 PolarHBondContact OD1-NH2 2.93Å; Y231-R923 HydrophobicContact CD1-CB 3.7Å; Y231-R923 HydrophobicContact CD1-CG 3.47Å; Y231-R923 VanDerWaalsContact CD1-CG 3.47Å; Y231-R923 HydrophobicContact CE1-CB 3.63Å; Y231-R923 HydrophobicContact CE1-CG 3.48Å; Y231-R923 VanDerWaalsContact CE1-CG 3.48Å; Y231-R923 HydrophobicContact CG-CG 4.1Å; P920-R923 HydrophobicContact CB-CG 3.94Å; P920-R923 HydrophobicContact CG-CG 3.76Å; R923-L949 HydrophobicContact CB-CB 4.14Å; R923-L949 HydrophobicContact CB-CD1 4.12Å; R923-L949 PolarHBondContact N-O 3.12Å; R923-L949 PolarHBondContact O-N 3.41Å
924	E	94.1	Very high	88.6	Confident	9 Å²	9	34.2 Å²	34.2	4%	0.042	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	126.5	176.9	-57.5	-178.1	130.8	0	0	108.5	F110 R119 I229 R230 F946 C947 V948	F110-E924 HydrophobicContact CD1-CB 3.89Å; F110-E924 WeakPolarHBondContact CD1-OE2 3.5Å; F110-E924 HydrophobicContact CE1-CB 3.51Å; R119-E924 IonicContact CZ-OE1 2.72Å; R119-E924 IonicContact CZ-OE2 2.9Å; R119-E924 IonicContact NE-OE1 3.37Å; R119-E924 PolarHBondContact NE-OE1 3.11Å; R119-E924 IonicContact NE-OE2 3.01Å; R119-E924 IonicContact NH2-OE1 3.51Å; R119-E924 PolarHBondContact NH2-OE1 3.45Å; R119-E924 IonicContact NH2-OE2 3.79Å; R119-E924 PolarHBondContact NH2-OE2 3.21Å; I229-E924 WeakPolarHBondContact CA-O 3.14Å; R230-E924 HydrophobicContact CB-CB 4.43Å; R230-E924 PolarHBondContact N-O 3.16Å; R230-E924 IonicContact NE-OE2 3.75Å; R230-E924 PolarHBondContact O-N 2.84Å; E924-F946 HydrophobicContact CB-CE2 4.33Å; E924-F946 HydrophobicContact CB-CZ 4.18Å; E924-F946 HydrophobicContact CG-CZ 4.33Å; E924-C947 CarbonylContact C-O 3.57Å; E924-C947 VanDerWaalsContact CA-O 3.28Å; E924-C947 WeakPolarHBondContact CA-O 3.07Å; E924-V948 HydrophobicContact CG-CG2 4.48Å
925	I	94.8	Very high	89.4	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	136.6	-176.2	-62.9	167.5	0	0	0	107.7	L204 L207 I227 A228 I229 L927 C947 L949	L204-I925 HydrophobicContact CD1-CG2 3.79Å; L207-I925 HydrophobicContact CD1-CB 4.3Å; L207-I925 HydrophobicContact CD1-CD1 3.58Å; L207-I925 HydrophobicContact CD1-CG2 4.4Å; I227-I925 HydrophobicContact CG2-CG2 4.42Å; A228-I925 CarbonylContact O-C 3.58Å; I229-I925 HydrophobicContact CG1-CG1 4.35Å; I229-I925 HydrophobicContact CG1-CG2 4.46Å; I229-I925 HydrophobicContact CG2-CG1 4.15Å; I925-L927 HydrophobicContact CG2-CD2 3.95Å; I925-L927 HydrophobicContact CG2-CG 4.3Å; I925-C947 HydrophobicContact CB-CB 4.23Å; I925-C947 PolarHBondContact N-O 2.89Å; I925-C947 PolarHBondContact O-N 3.28Å; I925-L949 HydrophobicContact CD1-CD1 3.93Å
926	L	94.7	Very high	89.4	Confident	2 Å²	2	30.5 Å²	30.5	1%	0.01	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	124.2	-178.5	-178.3	71.9	0	0	0	109.9	D109 F110 I227 A228 R928 R944 L945 F946	D109-L926 WeakPolarHBondContact OD2-CD2 3.39Å; F110-L926 HydrophobicContact CZ-CB 4.22Å; I227-L926 CarbonylContact C-O 3.58Å; I227-L926 VanDerWaalsContact CA-O 3.29Å; I227-L926 WeakPolarHBondContact CA-O 3.32Å; A228-L926 HydrophobicContact CB-CB 4.24Å; A228-L926 HydrophobicContact CB-CD2 4.41Å; A228-L926 PolarHBondContact N-O 3.43Å; A228-L926 PolarHBondContact O-N 3.01Å; L926-R928 VanDerWaalsContact CD2-CZ 3.44Å; L926-R928 HydrophobicContact CG-CG 4.32Å; L926-R944 HydrophobicContact CD1-CG 3.92Å; L926-R944 VanDerWaalsContact CD1-NH2 3.33Å; L926-L945 WeakPolarHBondContact CA-O 3.35Å; L926-F946 HydrophobicContact CB-CD2 4.31Å; L926-F946 HydrophobicContact CD1-CB 3.85Å; L926-F946 HydrophobicContact CD1-CD2 3.81Å; L926-F946 HydrophobicContact CD1-CG 4.34Å
927	L	94.1	Very high	89.4	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	133.6	-177.8	-54.1	179.7	0	0	0	109.3	L204 L207 L208 F211 V225 N226 I227 I925 R944 L945	L204-L927 HydrophobicContact CD1-CD2 4.03Å; L207-L927 HydrophobicContact CB-CD1 4.34Å; L208-L927 HydrophobicContact CD2-CD1 4.14Å; L208-L927 HydrophobicContact CD2-CD2 3.89Å; F211-L927 HydrophobicContact CB-CD1 3.82Å; F211-L927 HydrophobicContact CD1-CB 3.92Å; F211-L927 HydrophobicContact CD1-CD1 4.14Å; F211-L927 HydrophobicContact CE1-CB 3.98Å; F211-L927 HydrophobicContact CG-CB 4.26Å; F211-L927 HydrophobicContact CG-CD1 4.06Å; F211-L927 HydrophobicContact CZ-CB 4.38Å; V225-L927 HydrophobicContact CG1-CB 3.89Å; V225-L927 HydrophobicContact CG1-CD2 4.19Å; N226-L927 CarbonylContact O-C 3.49Å; N226-L927 WeakPolarHBondContact O-CA 3.41Å; I227-L927 HydrophobicContact CB-CD2 4.26Å; I227-L927 HydrophobicContact CD1-CD2 4.36Å; I227-L927 HydrophobicContact CG1-CD2 3.81Å; I227-L927 HydrophobicContact CG2-CD2 3.88Å; I925-L927 HydrophobicContact CG2-CD2 3.95Å; I925-L927 HydrophobicContact CG2-CG 4.3Å; L927-R944 CarbonylContact O-C 3.55Å; L927-R944 VanDerWaalsContact O-CA 3.3Å; L927-R944 WeakPolarHBondContact O-CA 3.34Å; L927-L945 HydrophobicContact CB-CB 4.32Å; L927-L945 HydrophobicContact CD1-CD2 4.28Å; L927-L945 PolarHBondContact N-O 3.02Å; L927-L945 PolarHBondContact O-N 3.25Å
928	R	92.9	Very high	89.4	Confident	6 Å²	6	34.6 Å²	34.6	2%	0.023	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	141.4	-178.9	-50.8	175.7	-165.1	-172.7	-7	111.1	L104 C105 D109 N226 L926 Q943 R944	L104-R928 VanDerWaalsContact C-NH1 3.27Å; L104-R928 PolarHBondContact O-NH1 3Å; C105-R928 PolarHBondContact O-NH1 2.85Å; C105-R928 PolarHBondContact O-NH2 2.82Å; D109-R928 IonicContact OD1-CZ 2.81Å; D109-R928 IonicContact OD1-NH1 3.22Å; D109-R928 IonicContact OD1-NH2 2.61Å; D109-R928 PolarHBondContact OD1-NH2 3.02Å; D109-R928 IonicContact OD2-CZ 2.81Å; D109-R928 IonicContact OD2-NH1 2.9Å; D109-R928 IonicContact OD2-NH2 2.66Å; D109-R928 PolarHBondContact OD2-NH2 3.11Å; N226-R928 PolarHBondContact N-O 2.93Å; N226-R928 PolarHBondContact O-N 3.5Å; L926-R928 VanDerWaalsContact CD2-CZ 3.44Å; L926-R928 HydrophobicContact CG-CG 4.32Å; R928-Q943 VanDerWaalsContact CA-O 3.31Å; R928-Q943 WeakPolarHBondContact CA-O 3.33Å; R928-R944 HydrophobicContact CG-CG 4.3Å; R928-R944 VanDerWaalsContact NE-NH1 3.15Å
929	T	92.4	Very high	89.4	Confident	7 Å²	7	37 Å²	37	4%	0.043	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	162.5	171.9	-170.5	0	0	0	0	110.2	F211 I215 P224 V931 Q943	F211-T929 HydrophobicContact CE1-CG2 3.73Å; F211-T929 HydrophobicContact CZ-CG2 3.92Å; I215-T929 HydrophobicContact CD1-CG2 3.77Å; P224-T929 PolarHBondContact O-OG1 2.91Å; T929-V931 HydrophobicContact CG2-CG2 3.64Å; T929-Q943 HydrophobicContact CG2-CB 4.12Å; T929-Q943 HydrophobicContact CG2-CG 4.43Å; T929-Q943 PolarHBondContact N-O 2.86Å; T929-Q943 PolarHBondContact O-N 3.09Å
930	C	91.1	Very high	89.4	Confident	52 Å²	52	34.5 Å²	34.5	35%	0.351	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	118.4	170.7	-70	0	0	0	0	108.5	L104 L941	L104-C930 WeakPolarHBondContact CD1-SG 3.49Å; C930-L941 WeakPolarHBondContact CA-O 3.45Å
931	V	90	Very high	89.4	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.006	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	139.9	-176.4	-175.9	0	0	0	0	109	I215 C217 L222 P223 T929 R933 L941	I215-V931 HydrophobicContact CG2-CB 4.26Å; I215-V931 HydrophobicContact CG2-CG1 4.03Å; I215-V931 HydrophobicContact CG2-CG2 4.5Å; C217-V931 HydrophobicContact CB-CG1 4.08Å; L222-V931 HydrophobicContact CD2-CG1 3.98Å; L222-V931 HydrophobicContact CD2-CG2 4.42Å; P223-V931 HydrophobicContact CG-CG2 4.06Å; T929-V931 HydrophobicContact CG2-CG2 3.64Å; V931-R933 PolarHBondContact O-N 3.21Å; V931-L941 PolarHBondContact N-O 2.89Å; V931-L941 PolarHBondContact O-N 3.22Å
932	P	88.2	Confident	89.4	Confident	19 Å²	19	30.5 Å²	30.5	12%	0.123	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	119.6	170.9	31.4	-36.4	0	0	0	110.5	C217 L219 A935 S938 K939	C217-P932 PolarHBondContact SG-O 2.57Å; L219-P932 HydrophobicContact CD1-CG 3.23Å; P932-A935 CarbonylContact C-O 3.54Å; P932-S938 WeakPolarHBondContact CB-O 3.37Å; P932-K939 WeakPolarHBondContact CA-O 3.43Å
933	R	85.6	Confident	89.6	Confident	54 Å²	54	30.2 Å²	30.2	20%	0.204	16%	0.162	C	C	.	.			trans	-137.6	137.1	-176.8	-175.2	175.4	177.2	-110.6	-0.6	109.3	I215 C217 V931 S938 S961 A962 D963	I215-R933 WeakPolarHBondContact O-CD 3.3Å; I215-R933 PolarHBondContact O-NE 3.02Å; C217-R933 VanDerWaalsContact SG-CB 3.57Å; V931-R933 PolarHBondContact O-N 3.21Å; R933-S938 WeakPolarHBondContact O-CB 3.38Å; R933-S961 WeakPolarHBondContact CD-O 3.48Å; R933-A962 HydrophobicContact CG-CB 4.43Å; R933-D963 WeakPolarHBondContact O-CB 3.38Å; R933-D963 PolarHBondContact O-N 2.99Å
934	P	81.9	Confident	89.6	Confident	50 Å²	50	28.4 Å²	28.4	33%	0.325	16%	0.155	S	C	.	.	S	Bend	cis	-80.7	-26.4	7.3	31.3	-35.2	0	0	0	115	D963	P934-D963 WeakPolarHBondContact CD-O 3.34Å
935	A	84.4	Confident	89.7	Confident	13 Å²	13	28.4 Å²	28.4	11%	0.107	16%	0.155	C	C	.	.	S	Bend	trans	-109.7	160	-174.3	0	0	0	0	0	112.2	P932 Y937 S938	P932-A935 CarbonylContact C-O 3.54Å; A935-Y937 HydrophobicContact CB-CD1 3.96Å; A935-Y937 HydrophobicContact CB-CD2 4.14Å; A935-Y937 HydrophobicContact CB-CE1 3.51Å; A935-Y937 HydrophobicContact CB-CE2 3.7Å; A935-Y937 HydrophobicContact CB-CG 4.26Å; A935-Y937 PolarHBondContact O-N 3.41Å; A935-Y937 VanDerWaalsContact O-N 3.12Å; A935-S938 PolarHBondContact N-OG 3.2Å; A935-S938 VanDerWaalsContact N-OG 3.14Å; A935-S938 VanDerWaalsContact O-CB 3.23Å; A935-S938 WeakPolarHBondContact O-CB 3.12Å; A935-S938 PolarHBondContact O-N 2.88Å; A935-S938 PolarHBondContact O-OG 3.28Å
936	P	81.6	Confident	89.7	Confident	78 Å²	78	28.5 Å²	28.5	51%	0.506	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-20.9	179.2	-24.5	34.7	0	0	0	115.2	L219	L219-P936 HydrophobicContact CD1-CB 3.98Å; L219-P936 HydrophobicContact CD1-CG 4.5Å; L219-P936 HydrophobicContact CG-CB 4.29Å
937	Y	84	Confident	89.7	Confident	158 Å²	158	28.4 Å²	28.4	62%	0.62	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-4.4	177.2	53.1	-102.2	0	0	0	113.6	A935 F966 F967	A935-Y937 HydrophobicContact CB-CD1 3.96Å; A935-Y937 HydrophobicContact CB-CD2 4.14Å; A935-Y937 HydrophobicContact CB-CE1 3.51Å; A935-Y937 HydrophobicContact CB-CE2 3.7Å; A935-Y937 HydrophobicContact CB-CG 4.26Å; A935-Y937 PolarHBondContact O-N 3.41Å; A935-Y937 VanDerWaalsContact O-N 3.12Å; Y937-F966 HydrophobicContact CD2-CB 4.45Å; Y937-F966 HydrophobicContact CE2-CB 4.25Å; Y937-F967 PolarHBondContact OH-OXT 2.84Å
938	S	86.8	Confident	89.7	Confident	8 Å²	8	28.6 Å²	28.6	6%	0.056	16%	0.156	C	C	.	.	S	Bend	trans	-68.1	163.3	175.7	-58	0	0	0	0	111.3	P932 R933 A935	P932-S938 WeakPolarHBondContact CB-O 3.37Å; R933-S938 WeakPolarHBondContact O-CB 3.38Å; A935-S938 PolarHBondContact N-OG 3.2Å; A935-S938 VanDerWaalsContact N-OG 3.14Å; A935-S938 VanDerWaalsContact O-CB 3.23Å; A935-S938 WeakPolarHBondContact O-CB 3.12Å; A935-S938 PolarHBondContact O-N 2.88Å; A935-S938 PolarHBondContact O-OG 3.28Å
939	K	86.4	Confident	89.7	Confident	73 Å²	73	28.4 Å²	28.4	32%	0.317	16%	0.156	S	C	.	.	P	Polyproline II helix	trans	-58.7	140.3	172	-166.8	169.1	-176.9	168.9	0	110.3	D94 P932 L941 D963	D94-K939 PolarHBondContact O-NZ 2.92Å; D94-K939 IonicContact OD1-NZ 3.2Å; P932-K939 WeakPolarHBondContact CA-O 3.43Å; K939-L941 HydrophobicContact CG-CD2 4.36Å; K939-L941 WeakPolarHBondContact O-CG 3.5Å; K939-L941 PolarHBondContact O-N 3.12Å; K939-D963 PolarHBondContact N-OD2 3.19Å
940	A	88	Confident	89.6	Confident	58 Å²	58	31.8 Å²	31.8	48%	0.479	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	116.2	174.1	0	0	0	0	0	109.6
941	L	90.6	Very high	89.2	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	150.1	-172.3	-65.9	172.7	0	0	0	112.1	L96 V185 C930 V931 K939 Q943 D963	L96-L941 HydrophobicContact CD2-CD2 3.64Å; V185-L941 HydrophobicContact CB-CD2 4.46Å; V185-L941 HydrophobicContact CG1-CD1 4.12Å; V185-L941 HydrophobicContact CG1-CD2 3.72Å; C930-L941 WeakPolarHBondContact CA-O 3.45Å; V931-L941 PolarHBondContact N-O 2.89Å; V931-L941 PolarHBondContact O-N 3.22Å; K939-L941 HydrophobicContact CG-CD2 4.36Å; K939-L941 WeakPolarHBondContact O-CG 3.5Å; K939-L941 PolarHBondContact O-N 3.12Å; L941-Q943 PolarHBondContact O-NE2 3.1Å; L941-D963 HydrophobicContact CD1-CB 4.11Å
942	P	92	Very high	89	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.013	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	134.4	-178.3	26.9	-32.6	0	0	0	112	M100 L103 L104 S961	M100-P942 HydrophobicContact CB-CG 3.79Å; M100-P942 HydrophobicContact CG-CG 4.23Å; M100-P942 WeakPolarHBondContact O-CG 3.45Å; L103-P942 HydrophobicContact CB-CB 4.39Å; L103-P942 HydrophobicContact CD1-CB 4.4Å; L103-P942 HydrophobicContact CD1-CG 4.32Å; L104-P942 HydrophobicContact CD1-CB 3.96Å; L104-P942 HydrophobicContact CD2-CB 3.79Å; L104-P942 HydrophobicContact CG-CB 3.71Å; P942-S961 WeakPolarHBondContact O-CB 3.26Å; P942-S961 PolarHBondContact O-OG 3.21Å
943	Q	93.9	Very high	89	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	134	173.1	-46.5	-59.4	-35.9	0	0	107.9	F211 I215 R928 T929 L941 S961	F211-Q943 HydrophobicContact CE2-CB 4.17Å; F211-Q943 HydrophobicContact CZ-CB 3.88Å; I215-Q943 HydrophobicContact CD1-CB 4.37Å; I215-Q943 HydrophobicContact CD1-CG 4.4Å; I215-Q943 HydrophobicContact CG1-CB 4.35Å; I215-Q943 HydrophobicContact CG1-CG 4.22Å; R928-Q943 VanDerWaalsContact CA-O 3.31Å; R928-Q943 WeakPolarHBondContact CA-O 3.33Å; T929-Q943 HydrophobicContact CG2-CB 4.12Å; T929-Q943 HydrophobicContact CG2-CG 4.43Å; T929-Q943 PolarHBondContact N-O 2.86Å; T929-Q943 PolarHBondContact O-N 3.09Å; L941-Q943 PolarHBondContact O-NE2 3.1Å; Q943-S961 PolarHBondContact NE2-O 2.92Å
944	R	94.5	Very high	89.4	Confident	6 Å²	6	42.3 Å²	42.3	2%	0.023	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	139.1	-179.5	180	-176.2	178.6	105.8	-4.3	110.6	L103 W120 Y121 L926 L927 R928 G958 A959	L103-R944 HydrophobicContact CB-CB 4.41Å; L103-R944 HydrophobicContact CD2-CB 4.44Å; L103-R944 PolarHBondContact O-NH1 3.29Å; W120-R944 PolarHBondContact O-NE 2.89Å; W120-R944 PolarHBondContact O-NH2 3.4Å; Y121-R944 PolarHBondContact O-NE 3.34Å; L926-R944 HydrophobicContact CD1-CG 3.92Å; L926-R944 VanDerWaalsContact CD1-NH2 3.33Å; L927-R944 CarbonylContact O-C 3.55Å; L927-R944 VanDerWaalsContact O-CA 3.3Å; L927-R944 WeakPolarHBondContact O-CA 3.34Å; R928-R944 HydrophobicContact CG-CG 4.3Å; R928-R944 VanDerWaalsContact NE-NH1 3.15Å; R944-G958 CarbonylContact O-C 3.56Å; R944-G958 WeakPolarHBondContact O-CA 3.15Å; R944-A959 HydrophobicContact CB-CB 4.36Å; R944-A959 PolarHBondContact N-O 2.97Å; R944-A959 PolarHBondContact O-N 2.83Å
945	L	95.2	Very high	89.9	Confident	10 Å²	10	40.7 Å²	40.7	5%	0.052	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	122.6	170.1	-176.8	69.3	0	0	0	109.7	F211 L926 L927 L956	F211-L945 HydrophobicContact CB-CD2 3.89Å; F211-L945 HydrophobicContact CD2-CB 3.48Å; F211-L945 VanDerWaalsContact CD2-CB 3.48Å; F211-L945 HydrophobicContact CD2-CD2 4Å; F211-L945 HydrophobicContact CD2-CG 4.33Å; F211-L945 HydrophobicContact CE2-CB 3.73Å; F211-L945 HydrophobicContact CG-CB 4.26Å; F211-L945 HydrophobicContact CG-CD2 4.29Å; L926-L945 WeakPolarHBondContact CA-O 3.35Å; L927-L945 HydrophobicContact CB-CB 4.32Å; L927-L945 HydrophobicContact CD1-CD2 4.28Å; L927-L945 PolarHBondContact N-O 3.02Å; L927-L945 PolarHBondContact O-N 3.25Å; L945-L956 HydrophobicContact CD1-CB 4.26Å
946	F	95.3	Very high	90.4	Very high	1 Å²	1	40.7 Å²	40.7	0%	0.004	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	129.8	172.4	-178.8	-98	0	0	0	110	F110 R119 W120 E924 L926 V948 L956 A957	F110-F946 AromaticContact CD1-CE2 3.86Å; F110-F946 HydrophobicContact CD1-CE2 3.86Å; F110-F946 HydrophobicContact CD1-CZ 4.45Å; F110-F946 HydrophobicContact CE1-CD2 4.47Å; F110-F946 AromaticContact CE1-CE2 3.64Å; F110-F946 HydrophobicContact CE1-CE2 3.64Å; F110-F946 HydrophobicContact CE1-CZ 4.47Å; R119-F946 HydrophobicContact CG-CZ 4.29Å; W120-F946 HydrophobicContact CB-CB 4.49Å; W120-F946 HydrophobicContact CB-CD1 4.08Å; W120-F946 HydrophobicContact CB-CG 4.43Å; W120-F946 AromaticContact CD1-CD1 3.28Å; W120-F946 AromaticContact CD1-CE1 3.16Å; W120-F946 AromaticContact CG-CD1 3.86Å; W120-F946 HydrophobicContact CG-CD1 3.86Å; W120-F946 HydrophobicContact CG-CE1 4.16Å; W120-F946 AromaticContact NE1-CE1 3.71Å; W120-F946 WeakPolarHBondContact O-CB 3.39Å; E924-F946 HydrophobicContact CB-CE2 4.33Å; E924-F946 HydrophobicContact CB-CZ 4.18Å; E924-F946 HydrophobicContact CG-CZ 4.33Å; L926-F946 HydrophobicContact CB-CD2 4.31Å; L926-F946 HydrophobicContact CD1-CB 3.85Å; L926-F946 HydrophobicContact CD1-CD2 3.81Å; L926-F946 HydrophobicContact CD1-CG 4.34Å; F946-V948 HydrophobicContact CD1-CG2 3.96Å; F946-V948 HydrophobicContact CE1-CG2 3.19Å; F946-V948 HydrophobicContact CZ-CG2 3.89Å; F946-L956 CarbonylContact O-C 3.58Å; F946-L956 WeakPolarHBondContact O-CA 3.4Å; F946-A957 HydrophobicContact CB-CB 4.38Å; F946-A957 PolarHBondContact N-O 2.67Å; F946-A957 PolarHBondContact O-N 3.4Å
947	C	94.9	Very high	91.1	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	130.2	-174.7	-54	0	0	0	0	109.4	L207 E924 I925 R955 L956	L207-C947 HydrophobicContact CD1-CB 3.98Å; L207-C947 HydrophobicContact CD2-CB 4.43Å; E924-C947 CarbonylContact C-O 3.57Å; E924-C947 VanDerWaalsContact CA-O 3.28Å; E924-C947 WeakPolarHBondContact CA-O 3.07Å; I925-C947 HydrophobicContact CB-CB 4.23Å; I925-C947 PolarHBondContact N-O 2.89Å; I925-C947 PolarHBondContact O-N 3.28Å; C947-R955 CarbonylContact C-O 3.58Å; C947-R955 WeakPolarHBondContact CA-O 3.28Å; C947-L956 HydrophobicContact CB-CD2 3.84Å; C947-L956 WeakPolarHBondContact SG-CD2 3.24Å
948	V	93.9	Very high	91.6	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.024	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	125.4	170.5	-176.4	0	0	0	0	108.7	E924 F946 M950 F954 R955	E924-V948 HydrophobicContact CG-CG2 4.48Å; F946-V948 HydrophobicContact CD1-CG2 3.96Å; F946-V948 HydrophobicContact CE1-CG2 3.19Å; F946-V948 HydrophobicContact CZ-CG2 3.89Å; V948-M950 HydrophobicContact CG1-CE 3.85Å; V948-M950 HydrophobicContact CG1-CG 4Å; V948-M950 HydrophobicContact CG1-SD 4.36Å; V948-F954 WeakPolarHBondContact O-CA 3.37Å; V948-R955 HydrophobicContact CB-CB 4.24Å; V948-R955 PolarHBondContact N-O 2.98Å; V948-R955 PolarHBondContact O-N 3.11Å
949	L	92.2	Very high	92.1	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.016	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	103.5	179.1	-60.5	149.5	0	0	0	108.2	V197 Y201 L207 R923 I925 F954	V197-L949 HydrophobicContact CB-CD2 4.35Å; V197-L949 HydrophobicContact CG1-CD2 3.43Å; V197-L949 VanDerWaalsContact CG1-CD2 3.43Å; V197-L949 HydrophobicContact CG2-CD2 3.93Å; Y201-L949 WeakPolarHBondContact O-CD2 3.35Å; L207-L949 HydrophobicContact CD1-CD1 4.18Å; R923-L949 HydrophobicContact CB-CB 4.14Å; R923-L949 HydrophobicContact CB-CD1 4.12Å; R923-L949 PolarHBondContact N-O 3.12Å; R923-L949 PolarHBondContact O-N 3.41Å; I925-L949 HydrophobicContact CD1-CD1 3.93Å; L949-F954 HydrophobicContact CD2-CD2 3.63Å; L949-F954 HydrophobicContact CD2-CE2 3.65Å; L949-F954 HydrophobicContact CG-CD2 4.44Å
950	M	90.3	Very high	92.4	Very high	78 Å²	78	26 Å²	26	38%	0.384	13%	0.134	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	171.3	171.1	-61.2	-177.4	-179.1	0	0	109.7	V948 D952 E953	V948-M950 HydrophobicContact CG1-CE 3.85Å; V948-M950 HydrophobicContact CG1-CG 4Å; V948-M950 HydrophobicContact CG1-SD 4.36Å; M950-D952 VanDerWaalsContact C-N 3.27Å; M950-D952 PolarHBondContact O-N 3.44Å; M950-E953 HydrophobicContact CB-CB 4.2Å; M950-E953 PolarHBondContact N-O 2.93Å
951	K	83.6	Confident	92.7	Very high	193 Å²	193	23.2 Å²	23.2	84%	0.839	11%	0.111	S	C	*	.	S	Bend	trans	-56.7	-39	-178.6	-170.1	178.1	179.5	-179	0	113.3
952	D	85.1	Confident	92.7	Very high	102 Å²	102	24 Å²	24	55%	0.545	12%	0.117	S	C	.	.	S	Bend	trans	-119.6	9.9	-176.2	-71.7	-58.6	0	0	0	113.9	R195 M950	R195-D952 CarbonylContact O-C 3.57Å; R195-D952 WeakPolarHBondContact O-CA 3.15Å; M950-D952 VanDerWaalsContact C-N 3.27Å; M950-D952 PolarHBondContact O-N 3.44Å
953	E	89.3	Confident	92.5	Very high	48 Å²	48	24.1 Å²	24.1	22%	0.224	12%	0.118	C	C	.	.			trans	-143.4	126.4	-178	-175.7	173.6	-156.4	0	0	111.1	H193 M950 R955	H193-E953 IonicContact CD2-OE1 3.4Å; H193-E953 IonicContact NE2-OE1 2.83Å; M950-E953 HydrophobicContact CB-CB 4.2Å; M950-E953 PolarHBondContact N-O 2.93Å; E953-R955 IonicContact OE1-CZ 2.73Å; E953-R955 IonicContact OE1-NH1 3.48Å; E953-R955 PolarHBondContact OE1-NH1 3.19Å; E953-R955 IonicContact OE1-NH2 3.79Å; E953-R955 PolarHBondContact OE1-NH2 2.95Å
954	F	93	Very high	92.1	Very high	3 Å²	3	27.3 Å²	27.3	1%	0.013	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	113.2	168.2	177.8	-114.3	0	0	0	108.6	H193 L194 V197 Y201 L207 V948 L949 L956	H193-F954 CarbonylContact C-O 3.07Å; H193-F954 WeakPolarHBondContact CA-O 3.41Å; L194-F954 HydrophobicContact CB-CB 4.25Å; L194-F954 HydrophobicContact CB-CD1 4.12Å; L194-F954 HydrophobicContact CD1-CD1 3.92Å; L194-F954 HydrophobicContact CD1-CE1 4.33Å; L194-F954 HydrophobicContact CG-CD1 4.19Å; L194-F954 PolarHBondContact N-O 2.86Å; L194-F954 PolarHBondContact O-N 3.42Å; V197-F954 HydrophobicContact CB-CD2 4.42Å; V197-F954 HydrophobicContact CG1-CD2 4.11Å; V197-F954 HydrophobicContact CG1-CE2 4.42Å; V197-F954 HydrophobicContact CG2-CB 3.93Å; V197-F954 HydrophobicContact CG2-CD2 4.06Å; V197-F954 HydrophobicContact CG2-CG 4.34Å; Y201-F954 HydrophobicContact CD2-CZ 4.36Å; L207-F954 HydrophobicContact CD2-CE2 4.49Å; V948-F954 WeakPolarHBondContact O-CA 3.37Å; L949-F954 HydrophobicContact CD2-CD2 3.63Å; L949-F954 HydrophobicContact CD2-CE2 3.65Å; L949-F954 HydrophobicContact CG-CD2 4.44Å; F954-L956 HydrophobicContact CE1-CD1 3.84Å; F954-L956 HydrophobicContact CE1-CD2 4.43Å; F954-L956 HydrophobicContact CE1-CG 3.85Å; F954-L956 HydrophobicContact CE2-CD2 4.02Å; F954-L956 HydrophobicContact CE2-CG 4.29Å; F954-L956 HydrophobicContact CZ-CD1 3.72Å; F954-L956 HydrophobicContact CZ-CD2 3.72Å; F954-L956 HydrophobicContact CZ-CG 3.64Å
955	R	93.9	Very high	91.4	Very high	16 Å²	16	30.4 Å²	30.4	6%	0.06	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	133	178	-173.1	178.2	-75.8	112.2	4.9	110.8	W120 R173 I191 V192 C947 V948 E953	W120-R955 VanDerWaalsContact CZ2-NH1 3.33Å; R173-R955 PolarHBondContact O-NH2 3.16Å; I191-R955 HydrophobicContact CG2-CG 3.9Å; V192-R955 CarbonylContact O-C 3.58Å; V192-R955 VanDerWaalsContact O-CA 3.29Å; V192-R955 WeakPolarHBondContact O-CA 3.29Å; C947-R955 CarbonylContact C-O 3.58Å; C947-R955 WeakPolarHBondContact CA-O 3.28Å; V948-R955 HydrophobicContact CB-CB 4.24Å; V948-R955 PolarHBondContact N-O 2.98Å; V948-R955 PolarHBondContact O-N 3.11Å; E953-R955 IonicContact OE1-CZ 2.73Å; E953-R955 IonicContact OE1-NH1 3.48Å; E953-R955 PolarHBondContact OE1-NH1 3.19Å; E953-R955 IonicContact OE1-NH2 3.79Å; E953-R955 PolarHBondContact OE1-NH2 2.95Å
956	L	95	Very high	89.7	Confident	13 Å²	13	36 Å²	36	7%	0.068	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	120.9	167.9	-60.9	178.1	0	0	0	108.1	I191 V192 L207 I210 L945 F946 C947 F954	I191-L956 CarbonylContact C-O 3.6Å; I191-L956 VanDerWaalsContact CA-O 3.29Å; I191-L956 WeakPolarHBondContact CA-O 3.4Å; V192-L956 HydrophobicContact CB-CB 4.31Å; V192-L956 PolarHBondContact N-O 2.98Å; V192-L956 PolarHBondContact O-N 2.78Å; L207-L956 HydrophobicContact CD2-CD2 4.05Å; I210-L956 HydrophobicContact CD1-CD1 3.92Å; L945-L956 HydrophobicContact CD1-CB 4.26Å; F946-L956 CarbonylContact O-C 3.58Å; F946-L956 WeakPolarHBondContact O-CA 3.4Å; C947-L956 HydrophobicContact CB-CD2 3.84Å; C947-L956 WeakPolarHBondContact SG-CD2 3.24Å; F954-L956 HydrophobicContact CE1-CD1 3.84Å; F954-L956 HydrophobicContact CE1-CD2 4.43Å; F954-L956 HydrophobicContact CE1-CG 3.85Å; F954-L956 HydrophobicContact CE2-CD2 4.02Å; F954-L956 HydrophobicContact CE2-CG 4.29Å; F954-L956 HydrophobicContact CZ-CD1 3.72Å; F954-L956 HydrophobicContact CZ-CD2 3.72Å; F954-L956 HydrophobicContact CZ-CG 3.64Å
957	A	95.5	Very high	87.5	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	104.2	174.4	0	0	0	0	0	108.5	W120 Y121 E190 I191 F946	W120-A957 HydrophobicContact CB-CB 3.84Å; W120-A957 HydrophobicContact CD2-CB 4.36Å; W120-A957 HydrophobicContact CE3-CB 4.48Å; W120-A957 HydrophobicContact CG-CB 4.12Å; Y121-A957 HydrophobicContact CE1-CB 4.03Å; E190-A957 CarbonylContact O-C 3.57Å; E190-A957 WeakPolarHBondContact O-CA 3.29Å; I191-A957 HydrophobicContact CG1-CB 4.09Å; F946-A957 HydrophobicContact CB-CB 4.38Å; F946-A957 PolarHBondContact N-O 2.67Å; F946-A957 PolarHBondContact O-N 3.4Å
958	G	95.2	Very high	87.2	Confident	3 Å²	3	47.9 Å²	47.9	3%	0.031	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	139.5	-178.8	0	0	0	0	0	111.6	Y121 F189 E190 R944	Y121-G958 WeakPolarHBondContact CE1-O 3.42Å; Y121-G958 PolarHBondContact OH-O 3.4Å; F189-G958 WeakPolarHBondContact CA-O 3.43Å; E190-G958 PolarHBondContact N-O 3.42Å; E190-G958 PolarHBondContact O-N 2.85Å; R944-G958 CarbonylContact O-C 3.56Å; R944-G958 WeakPolarHBondContact O-CA 3.15Å
959	A	95.3	Very high	86.8	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	111.5	167.6	0	0	0	0	0	107.5	L103 Y121 T187 D188 F189 R944	L103-A959 HydrophobicContact CD1-CB 3.95Å; L103-A959 HydrophobicContact CD2-CB 3.87Å; Y121-A959 HydrophobicContact CD1-CB 3.88Å; Y121-A959 HydrophobicContact CE1-CB 4Å; T187-A959 HydrophobicContact CG2-CB 4.05Å; D188-A959 WeakPolarHBondContact O-CA 3.46Å; F189-A959 HydrophobicContact CD1-CB 3.64Å; F189-A959 HydrophobicContact CE1-CB 3.64Å; R944-A959 HydrophobicContact CB-CB 4.36Å; R944-A959 PolarHBondContact N-O 2.97Å; R944-A959 PolarHBondContact O-N 2.83Å
960	F	94.3	Very high	86.5	Confident	6 Å²	6	52.8 Å²	52.8	3%	0.026	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	114.3	-174.7	-61.3	-78.5	0	0	0	111	D188 F211 K214 I215	D188-F960 PolarHBondContact N-O 3.2Å; D188-F960 PolarHBondContact O-N 3.35Å; F211-F960 AromaticContact CD2-CE1 3.98Å; F211-F960 HydrophobicContact CD2-CE1 3.98Å; F211-F960 HydrophobicContact CD2-CZ 4.34Å; F211-F960 AromaticContact CE2-CE1 3.9Å; F211-F960 HydrophobicContact CE2-CE1 3.9Å; K214-F960 HydrophobicContact CB-CE1 4.16Å; K214-F960 HydrophobicContact CB-CZ 3.94Å; K214-F960 HydrophobicContact CD-CE2 3.7Å; K214-F960 HydrophobicContact CD-CZ 3.79Å; K214-F960 HydrophobicContact CG-CD2 4.41Å; K214-F960 HydrophobicContact CG-CE1 4.06Å; K214-F960 HydrophobicContact CG-CE2 3.81Å; K214-F960 HydrophobicContact CG-CZ 3.62Å; I215-F960 HydrophobicContact CG1-CE1 4.36Å
961	S	93	Very high	86.3	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	141.4	-177.5	-52.6	0	0	0	0	111.3	R186 T187 R933 P942 Q943	R186-S961 CarbonylContact O-C 3.57Å; R186-S961 VanDerWaalsContact O-CA 3.25Å; R186-S961 WeakPolarHBondContact O-CA 3.41Å; T187-S961 PolarHBondContact OG1-OG 2.85Å; R933-S961 WeakPolarHBondContact CD-O 3.48Å; P942-S961 WeakPolarHBondContact O-CB 3.26Å; P942-S961 PolarHBondContact O-OG 3.21Å; Q943-S961 PolarHBondContact NE2-O 2.92Å
962	A	90.9	Very high	86.5	Confident	16 Å²	16	42.4 Å²	42.4	13%	0.132	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	145.2	176.5	0	0	0	0	0	110.9	V185 R186 R933	V185-A962 WeakPolarHBondContact CA-O 3.15Å; R186-A962 PolarHBondContact N-O 3.2Å; R186-A962 PolarHBondContact O-N 3.47Å; R933-A962 HydrophobicContact CG-CB 4.43Å
963	D	88.8	Confident	86.6	Confident	5 Å²	5	38.5 Å²	38.5	3%	0.027	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	122.6	172.1	-171.4	-16.8	0	0	0	108.5	G184 R933 P934 K939 L941 S965	G184-D963 VanDerWaalsContact O-OD1 3.11Å; R933-D963 WeakPolarHBondContact O-CB 3.38Å; R933-D963 PolarHBondContact O-N 2.99Å; P934-D963 WeakPolarHBondContact CD-O 3.34Å; K939-D963 PolarHBondContact N-OD2 3.19Å; L941-D963 HydrophobicContact CD1-CB 4.11Å; D963-S965 WeakPolarHBondContact OD1-CA 3.32Å; D963-S965 WeakPolarHBondContact OD1-CB 3.3Å; D963-S965 PolarHBondContact OD1-N 3.45Å; D963-S965 PolarHBondContact OD1-OG 2.81Å; D963-S965 VanDerWaalsContact OD1-OG 3.11Å
964	T	85.9	Confident	86.4	Confident	67 Å²	67	37.8 Å²	37.8	41%	0.411	19%	0.193	S	C	.	.	S	Bend	trans	-98.8	-4.8	178.3	59.7	0	0	0	0	112.3	G184 V185 R186	G184-T964 PolarHBondContact O-N 2.9Å; G184-T964 PolarHBondContact O-OG1 3.04Å; V185-T964 PolarHBondContact N-OG1 3.44Å; R186-T964 HydrophobicContact CB-CG2 3.79Å
965	S	78.1	Confident	85.9	Confident	70 Å²	70	40.5 Å²	40.5	49%	0.49	21%	0.207	S	C	.	.	S	Bend	trans	-81.2	-37.3	-177.5	-40.9	0	0	0	0	111.9	G184 D963	G184-S965 WeakPolarHBondContact CA-OG 3.24Å; G184-S965 PolarHBondContact O-N 3.45Å; G184-S965 PolarHBondContact O-OG 3.02Å; G184-S965 VanDerWaalsContact O-OG 3.06Å; D963-S965 WeakPolarHBondContact OD1-CA 3.32Å; D963-S965 WeakPolarHBondContact OD1-CB 3.3Å; D963-S965 PolarHBondContact OD1-N 3.45Å; D963-S965 PolarHBondContact OD1-OG 2.81Å; D963-S965 VanDerWaalsContact OD1-OG 3.11Å
966	F	60	Low	85.2	Confident	129 Å²	129	42.5 Å²	42.5	57%	0.566	22%	0.219	S	C	*	.			trans	-122.4	87.2	-176.3	-60.8	-79.5	0	0	0	110	Y937	Y937-F966 HydrophobicContact CD2-CB 4.45Å; Y937-F966 HydrophobicContact CE2-CB 4.25Å
967	F	50.2	Low	84.3	Confident	201 Å²	201	45.2 Å²	45.2	88%	0.882	23%	0.233	S	C	*	.			trans	-84.2	0	167.9	-101.2	-85.8	0	0	0	111.4	Y937	Y937-F967 PolarHBondContact OH-OXT 2.84Å

Retrieved 967 of 967 residues in 886.5 ms (Link to these results)

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