A0A096MI86_POEFO Loading...

26S proteasome non-ATPase regulatory subunit 1

Component of the 26S proteasome, a multiprotein complex involved in the ATP-dependent degradation of ubiquitinated proteins. This complex plays a key role in the maintenance of protein homeostasis by removing misfolded or damaged proteins, which could impair cellular functions, and by removing proteins whose functions are no longer required. Therefore, the proteasome participates in numerous cellular processes, including cell cycle progression, apoptosis, or DNA damage repair.

AlphaFold DB , UniProt , Accession A0A096MI86, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 963 aa.

						>A0A096MI86_POEFO|A0A096MI86
MITSAAGIISLLDEEEPKLKEFALHKLDSVVNDFWAEISGSVDKIEVLYEDESFQSREFAALVASKVFYHLGAFEESLNYALGAGDLFSVTDDSEYVETIIAKCIDHYTKLRVENAELSEDEEKKKIDPRLEGIVNKMFLRCLDDHKYKQAIGIALETRRLDIFEKTILESNDVSGLLAYSLKVCMSLMQNKKFRNEVLRVLVKLYMNLEKPDFINVCQCLIFLDDPQAVSDILEKLVKEDNLLMAYQICFDLYESASQQFLSSVIQNLHTVGTPIPAVPGSTNTGTVPTADKESEAMETDEKAGSSPAGKAAETKEEPKDQNAKMIKILSGEMSIELHLQFLIRNNNTDLMILKNTKDAVRNSVCHTATVIANSFMHTGTTSDQFLRENLEWLARATNWAKFTATASLGVIHKGHEKEALQLMATYLPKDTSPGSAYQEGGGLYALGLIHANHGGDIIDYLLGQLKNASNDIVRHGGALGLGLAALGTARQDVYDLLKSNLYQDDAVTGEAAGLALGLVMLGSKSAQAIEDMVGYAQETQHEKILRGLAVGIALVMYGRMEEADALIESLCRDKDPILRRSGMYTVGMAYCGSGNNKAIRRLLHVAVSDVNDDVRRAAVESIGFILFRTPEQCPSVVSLLSESYNPHVRCGAAMALGICCAGTGNKEAINLLEPMTNDPVNYVRQGALIASALIMIQQTEFTCPKVNQFRQLYAKVINDKHDDVMAKFGAILAQGILDAGGRNVSISLQSRTGHTHMPSVVGLLVFTQFWFWFPLSHFLSLAFTPTAIIGLNKDLKMPKVQYRSNCKPSTFAYPPALEVPKEKEKEKVSTAVLSITAKAKKKEKEKKEKEEEKMEVEVQEGEKEKEKKDEEKEKEKKKEVEPNFQLLENPARVMPAQLKVLTMPESCRYQPFKPLHTGGIIILKDTSEEEEELVEPVSAHGPKIEEEEQEPEPPEPFEYIDE
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.8	Very low	70.9	Confident	239 Å²	239	66.4 Å²	66.4	100%	1.177	41%	0.405	S	S	*	.				0	114.2	0	-68.7	178.9	-158.3	0	0	106.7
2	I	51.7	Low	71.4	Confident	70 Å²	70	61.8 Å²	61.8	36%	0.359	38%	0.376	S	S	.	.			trans	-79.4	134.1	175.6	-65.9	175.3	0	0	0	106.1	S4 I8 F34	I2-S4 WeakPolarHBondContact CG2-O 3.23Å; I2-I8 HydrophobicContact CD1-CD1 4.09Å; I2-F34 VanDerWaalsContact O-CZ 3.23Å; I2-F34 WeakPolarHBondContact O-CZ 3.43Å
3	T	64.6	Low	72	Confident	136 Å²	136	64.8 Å²	64.8	83%	0.834	39%	0.389	S	S	*	.	S	Bend	trans	-92.7	-15.7	-178.4	43.5	0	0	0	0	113.3
4	S	73	Confident	72.6	Confident	38 Å²	38	68.1 Å²	68.1	27%	0.266	40%	0.398	S	S	.	.			trans	-161.4	145.1	176.1	169.1	0	0	0	0	110.2	I2 A6 E37	I2-S4 WeakPolarHBondContact CG2-O 3.23Å; S4-A6 VanDerWaalsContact C-N 3.26Å; S4-A6 PolarHBondContact O-N 3.16Å; S4-A6 WeakPolarHBondContact OG-CB 3.47Å; S4-A6 PolarHBondContact OG-N 3.38Å; S4-A6 VanDerWaalsContact OG-N 3.14Å; S4-E37 WeakPolarHBondContact CA-OE2 3.35Å; S4-E37 PolarHBondContact OG-OE1 3.02Å; S4-E37 PolarHBondContact OG-OE2 3.27Å
5	A	73.4	Confident	72.7	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-6.9	175.1	0	0	0	0	0	113.1	G7 I8 I9 F34 E37 I38	A5-G7 VanDerWaalsContact C-N 3.26Å; A5-G7 PolarHBondContact O-N 3.28Å; A5-G7 VanDerWaalsContact O-N 3.16Å; A5-I8 WeakPolarHBondContact O-CA 3.36Å; A5-I8 WeakPolarHBondContact O-CB 3.03Å; A5-I8 PolarHBondContact O-N 3Å; A5-I9 HydrophobicContact CB-CD1 4.32Å; A5-I9 WeakPolarHBondContact O-CG1 3.44Å; A5-I9 PolarHBondContact O-N 2.76Å; A5-F34 HydrophobicContact CB-CB 3.87Å; A5-F34 HydrophobicContact CB-CG 4.25Å; A5-E37 HydrophobicContact CB-CB 4.48Å; A5-E37 PolarHBondContact N-OE2 3.29Å; A5-I38 HydrophobicContact CB-CG1 4.27Å
6	A	75.9	Confident	73.2	Confident	57 Å²	57	78.8 Å²	78.8	47%	0.471	44%	0.438	S	S	.	.	H	α-helix	trans	-53.8	-38.6	-177.3	0	0	0	0	0	113.8	S4 I8 I9 S10	S4-A6 VanDerWaalsContact C-N 3.26Å; S4-A6 PolarHBondContact O-N 3.16Å; S4-A6 WeakPolarHBondContact OG-CB 3.47Å; S4-A6 PolarHBondContact OG-N 3.38Å; S4-A6 VanDerWaalsContact OG-N 3.14Å; A6-I8 VanDerWaalsContact C-N 3.27Å; A6-I8 PolarHBondContact O-N 3.4Å; A6-I9 PolarHBondContact O-N 3.45Å; A6-S10 PolarHBondContact O-N 3.05Å; A6-S10 PolarHBondContact O-OG 3.38Å
7	G	76.1	Confident	73.5	Confident	49 Å²	49	78.8 Å²	78.8	51%	0.505	44%	0.443	S	S	.	.	H	α-helix	trans	-72.3	-17.5	177.1	0	0	0	0	0	114.3	A5 S10 L11	A5-G7 VanDerWaalsContact C-N 3.26Å; A5-G7 PolarHBondContact O-N 3.28Å; A5-G7 VanDerWaalsContact O-N 3.16Å; G7-S10 PolarHBondContact O-OG 2.86Å; G7-S10 VanDerWaalsContact O-OG 3.05Å; G7-L11 WeakPolarHBondContact O-CG 3.44Å
8	I	77.7	Confident	73.8	Confident	13 Å²	13	83.6 Å²	83.6	7%	0.067	46%	0.458	C	S	.	.	H	α-helix	trans	-88.9	-37.5	173.7	-50.3	166.3	0	0	0	109.4	I2 A5 A6 S10 L11 A23 K26 L27 V30	I2-I8 HydrophobicContact CD1-CD1 4.09Å; A5-I8 WeakPolarHBondContact O-CA 3.36Å; A5-I8 WeakPolarHBondContact O-CB 3.03Å; A5-I8 PolarHBondContact O-N 3Å; A6-I8 VanDerWaalsContact C-N 3.27Å; A6-I8 PolarHBondContact O-N 3.4Å; I8-S10 VanDerWaalsContact C-N 3.32Å; I8-S10 PolarHBondContact O-N 3.14Å; I8-L11 WeakPolarHBondContact O-CB 3.32Å; I8-L11 PolarHBondContact O-N 2.86Å; I8-L11 VanDerWaalsContact O-N 3.15Å; I8-A23 HydrophobicContact CG2-CB 4.12Å; I8-K26 HydrophobicContact CD1-CG 4.06Å; I8-K26 HydrophobicContact CG2-CB 4.3Å; I8-L27 HydrophobicContact CG2-CD1 4.22Å; I8-L27 HydrophobicContact CG2-CD2 4.31Å; I8-L27 HydrophobicContact CG2-CG 3.76Å; I8-V30 HydrophobicContact CD1-CG2 4.17Å
9	I	79.6	Confident	74.2	Confident	16 Å²	16	82.3 Å²	82.3	8%	0.082	45%	0.45	C	S	.	.	H	α-helix	trans	-63.6	-37.9	175.4	-63.9	167.2	0	0	0	110.8	A5 A6 L11 L12	A5-I9 HydrophobicContact CB-CD1 4.32Å; A5-I9 WeakPolarHBondContact O-CG1 3.44Å; A5-I9 PolarHBondContact O-N 2.76Å; A6-I9 PolarHBondContact O-N 3.45Å; I9-L11 PolarHBondContact O-N 2.76Å; I9-L12 VanDerWaalsContact O-CB 3.32Å; I9-L12 WeakPolarHBondContact O-CB 3.44Å; I9-L12 PolarHBondContact O-N 3.24Å; I9-L12 VanDerWaalsContact O-N 3.08Å
10	S	80.4	Confident	74.5	Confident	60 Å²	60	80.2 Å²	80.2	42%	0.42	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-64.8	-24.6	175.5	60.8	0	0	0	0	113.6	A6 G7 I8 L12 D13	A6-S10 PolarHBondContact O-N 3.05Å; A6-S10 PolarHBondContact O-OG 3.38Å; G7-S10 PolarHBondContact O-OG 2.86Å; G7-S10 VanDerWaalsContact O-OG 3.05Å; I8-S10 VanDerWaalsContact C-N 3.32Å; I8-S10 PolarHBondContact O-N 3.14Å; S10-L12 PolarHBondContact O-N 3.5Å; S10-D13 PolarHBondContact O-N 2.95Å
11	L	80.6	Confident	74.8	Confident	52 Å²	52	80.2 Å²	80.2	27%	0.272	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-72	-16.2	175.7	-64.5	167.3	0	0	0	112.3	G7 I8 I9 D13 A23	G7-L11 WeakPolarHBondContact O-CG 3.44Å; I8-L11 WeakPolarHBondContact O-CB 3.32Å; I8-L11 PolarHBondContact O-N 2.86Å; I8-L11 VanDerWaalsContact O-N 3.15Å; I9-L11 PolarHBondContact O-N 2.76Å; L11-D13 VanDerWaalsContact C-N 3.3Å; L11-A23 HydrophobicContact CB-CB 3.95Å
12	L	77.1	Confident	76.5	Confident	11 Å²	11	74.5 Å²	74.5	6%	0.058	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-76.2	-19.8	174.3	-61.3	168.7	0	0	0	112.3	I9 S10 E14 A23 L27 I45 L48	I9-L12 VanDerWaalsContact O-CB 3.32Å; I9-L12 WeakPolarHBondContact O-CB 3.44Å; I9-L12 PolarHBondContact O-N 3.24Å; I9-L12 VanDerWaalsContact O-N 3.08Å; S10-L12 PolarHBondContact O-N 3.5Å; L12-E14 VanDerWaalsContact C-N 3.35Å; L12-A23 HydrophobicContact CD2-CB 3.88Å; L12-A23 HydrophobicContact CG-CB 4.31Å; L12-L27 HydrophobicContact CD1-CD1 3.94Å; L12-L27 HydrophobicContact CD2-CD1 4.35Å; L12-L27 HydrophobicContact CG-CD1 4.43Å; L12-I45 HydrophobicContact CD1-CG1 4.36Å; L12-L48 HydrophobicContact CD2-CD1 3.74Å
13	D	79.3	Confident	78	Confident	101 Å²	101	71.2 Å²	71.2	54%	0.54	39%	0.385	S	S	.	.	S	Bend	trans	-81.1	-14.7	179	-66.2	-31.6	0	0	0	112.8	S10 L11 K44	S10-D13 PolarHBondContact O-N 2.95Å; L11-D13 VanDerWaalsContact C-N 3.3Å; D13-K44 WeakPolarHBondContact OD1-CE 3.42Å; D13-K44 IonicContact OD1-NZ 2.86Å; D13-K44 PolarHBondContact OD1-NZ 3.32Å; D13-K44 IonicContact OD2-NZ 2.86Å; D13-K44 PolarHBondContact OD2-NZ 3.47Å
14	E	80.8	Confident	78.9	Confident	112 Å²	112	64.8 Å²	64.8	52%	0.523	35%	0.346	S	S	.	.	S	Bend	trans	-75.9	143.2	178	-70.6	-70.8	-179	0	0	111.6	L12 E16 L19 K20	L12-E14 VanDerWaalsContact C-N 3.35Å; E14-E16 VanDerWaalsContact C-N 3.33Å; E14-E16 PolarHBondContact O-N 3.08Å; E14-L19 HydrophobicContact CB-CD1 4.1Å; E14-L19 HydrophobicContact CG-CD1 4.37Å; E14-K20 WeakPolarHBondContact O-CE 3.37Å
15	E	73.3	Confident	79.4	Confident	184 Å²	184	67.6 Å²	67.6	86%	0.86	36%	0.355	S	S	*	.	S	Bend	trans	-73.9	-19.3	-174.9	-70	-175.8	171.4	0	0	113.7
16	E	81.6	Confident	79.8	Confident	122 Å²	122	71.5 Å²	71.5	57%	0.57	37%	0.372	S	S	*	.			trans	-73	123.8	-177	-73	-166.2	161.9	0	0	113	E14 K18 L19 K20	E14-E16 VanDerWaalsContact C-N 3.33Å; E14-E16 PolarHBondContact O-N 3.08Å; E16-K18 VanDerWaalsContact C-N 3.28Å; E16-K18 PolarHBondContact O-N 3.29Å; E16-L19 HydrophobicContact CB-CB 4.4Å; E16-L19 HydrophobicContact CB-CD1 4.03Å; E16-L19 HydrophobicContact CB-CG 4.22Å; E16-L19 PolarHBondContact O-N 2.88Å; E16-L19 VanDerWaalsContact O-N 3.15Å; E16-K20 PolarHBondContact O-N 3.11Å
17	P	77.1	Confident	80.2	Confident	80 Å²	80	68.9 Å²	68.9	52%	0.519	35%	0.349	S	S	.	.	H	α-helix	trans	-65.3	-28	-176.6	23.5	-32.6	0	0	0	113.7	K20 E21 F54	P17-K20 PolarHBondContact O-N 2.73Å; P17-E21 PolarHBondContact O-N 3.35Å; P17-F54 HydrophobicContact CB-CD2 4.34Å; P17-F54 HydrophobicContact CB-CE2 3.95Å
18	K	79.8	Confident	80.5	Confident	165 Å²	165	68.4 Å²	68.4	72%	0.717	34%	0.335	S	S	*	.	H	α-helix	trans	-70	-32.5	177.3	-66.1	-179.3	-178.5	175	0	112.9	E16 F22	E16-K18 VanDerWaalsContact C-N 3.28Å; E16-K18 PolarHBondContact O-N 3.29Å; K18-F22 PolarHBondContact O-N 3.15Å; K18-F22 VanDerWaalsContact O-N 3.11Å
19	L	81.5	Confident	80.7	Confident	58 Å²	58	71.8 Å²	71.8	30%	0.304	36%	0.36	S	S	.	.	H	α-helix	trans	-71.3	-39.7	175.7	-73.7	173.3	0	0	0	110.6	E14 E16 F22 A23	E14-L19 HydrophobicContact CB-CD1 4.1Å; E14-L19 HydrophobicContact CG-CD1 4.37Å; E16-L19 HydrophobicContact CB-CB 4.4Å; E16-L19 HydrophobicContact CB-CD1 4.03Å; E16-L19 HydrophobicContact CB-CG 4.22Å; E16-L19 PolarHBondContact O-N 2.88Å; E16-L19 VanDerWaalsContact O-N 3.15Å; L19-F22 PolarHBondContact O-N 3.35Å; L19-A23 WeakPolarHBondContact O-CB 3.36Å; L19-A23 PolarHBondContact O-N 3.15Å
20	K	79.4	Confident	81	Confident	41 Å²	41	71.8 Å²	71.8	18%	0.178	36%	0.361	C	S	.	.	H	α-helix	trans	-61.6	-43.2	173.8	-63.2	179.8	176.4	-171.9	0	112	E14 E16 P17 A23 L24 L48 F54	E14-K20 WeakPolarHBondContact O-CE 3.37Å; E16-K20 PolarHBondContact O-N 3.11Å; P17-K20 PolarHBondContact O-N 2.73Å; K20-A23 WeakPolarHBondContact O-CB 3.38Å; K20-A23 PolarHBondContact O-N 3.39Å; K20-L24 VanDerWaalsContact O-CG 3.29Å; K20-L24 WeakPolarHBondContact O-CG 3.36Å; K20-L24 PolarHBondContact O-N 3.22Å; K20-L48 HydrophobicContact CD-CD2 3.65Å; K20-F54 HydrophobicContact CB-CE2 4.06Å; K20-F54 HydrophobicContact CB-CZ 3.92Å; K20-F54 HydrophobicContact CD-CE2 4.3Å
21	E	81.5	Confident	81.1	Confident	81 Å²	81	69 Å²	69	38%	0.379	34%	0.341	S	S	.	.	H	α-helix	trans	-62.7	-44.8	175.5	-175.5	172.6	-142.5	0	0	112.3	P17 A23 L24 H25 S56	P17-E21 PolarHBondContact O-N 3.35Å; E21-A23 VanDerWaalsContact C-N 3.32Å; E21-A23 PolarHBondContact O-N 3.05Å; E21-L24 PolarHBondContact O-N 3.26Å; E21-H25 PolarHBondContact O-CD2 3.42Å; E21-H25 PolarHBondContact O-N 3.44Å; E21-S56 PolarHBondContact OE1-OG 3.22Å; E21-S56 VanDerWaalsContact OE1-OG 3.06Å
22	F	83.1	Confident	81.2	Confident	119 Å²	119	71.7 Å²	71.7	52%	0.522	36%	0.356	S	S	.	.	H	α-helix	trans	-63.3	-38.5	175.4	-175.4	-98.1	0	0	0	112.3	K18 L19 K26	K18-F22 PolarHBondContact O-N 3.15Å; K18-F22 VanDerWaalsContact O-N 3.11Å; L19-F22 PolarHBondContact O-N 3.35Å; F22-K26 HydrophobicContact CE1-CD 4.09Å; F22-K26 HydrophobicContact CZ-CD 4.26Å; F22-K26 WeakPolarHBondContact O-CB 3.49Å; F22-K26 PolarHBondContact O-N 3.05Å; F22-K26 VanDerWaalsContact O-N 3.15Å
23	A	82.6	Confident	81.5	Confident	0 Å²	0	77.2 Å²	77.2	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-62.4	-45.4	175.5	0	0	0	0	0	111.2	I8 L11 L12 L19 K20 E21 K26 L27	I8-A23 HydrophobicContact CG2-CB 4.12Å; L11-A23 HydrophobicContact CB-CB 3.95Å; L12-A23 HydrophobicContact CD2-CB 3.88Å; L12-A23 HydrophobicContact CG-CB 4.31Å; L19-A23 WeakPolarHBondContact O-CB 3.36Å; L19-A23 PolarHBondContact O-N 3.15Å; K20-A23 WeakPolarHBondContact O-CB 3.38Å; K20-A23 PolarHBondContact O-N 3.39Å; E21-A23 VanDerWaalsContact C-N 3.32Å; E21-A23 PolarHBondContact O-N 3.05Å; A23-K26 PolarHBondContact O-N 3.01Å; A23-L27 WeakPolarHBondContact O-CB 3.42Å; A23-L27 WeakPolarHBondContact O-CD1 2.9Å; A23-L27 VanDerWaalsContact O-CG 3.29Å; A23-L27 WeakPolarHBondContact O-CG 3.29Å; A23-L27 PolarHBondContact O-N 2.83Å
24	L	82.3	Confident	81.7	Confident	1 Å²	1	74.4 Å²	74.4	1%	0.005	37%	0.369	C	S	.	.	H	α-helix	trans	-62.7	-43.7	178.3	-71.9	171.1	0	0	0	112.8	K20 E21 K26 L27 D28 F54 F59 A60 V63	K20-L24 VanDerWaalsContact O-CG 3.29Å; K20-L24 WeakPolarHBondContact O-CG 3.36Å; K20-L24 PolarHBondContact O-N 3.22Å; E21-L24 PolarHBondContact O-N 3.26Å; L24-K26 VanDerWaalsContact C-N 3.28Å; L24-K26 PolarHBondContact O-N 3.39Å; L24-L27 PolarHBondContact O-N 3.35Å; L24-D28 PolarHBondContact O-N 3.5Å; L24-F54 HydrophobicContact CD1-CE1 3.98Å; L24-F54 HydrophobicContact CD1-CZ 4.31Å; L24-F59 HydrophobicContact CB-CD1 4Å; L24-A60 HydrophobicContact CD1-CB 3.98Å; L24-A60 HydrophobicContact CD2-CB 4.21Å; L24-V63 HydrophobicContact CD2-CB 4.4Å; L24-V63 HydrophobicContact CD2-CG2 4.28Å
25	H	83.8	Confident	81.8	Confident	98 Å²	98	73.9 Å²	73.9	45%	0.454	36%	0.362	S	S	.	.	H	α-helix	trans	-60.5	-38.8	174.5	-84.4	-62.1	0	0	0	112.8	E21 F59	E21-H25 PolarHBondContact O-CD2 3.42Å; E21-H25 PolarHBondContact O-N 3.44Å; H25-F59 AromaticContact CE1-CE2 3.41Å; H25-F59 VanDerWaalsContact CE1-CE2 3.41Å; H25-F59 WeakPolarHBondContact CE1-CE2 3.29Å; H25-F59 AromaticContact CE1-CZ 3.42Å; H25-F59 VanDerWaalsContact CE1-CZ 3.42Å; H25-F59 WeakPolarHBondContact CE1-CZ 3.36Å; H25-F59 AromaticContact ND1-CE1 3.62Å; H25-F59 AromaticContact ND1-CE2 3.75Å; H25-F59 AromaticContact ND1-CZ 3.22Å; H25-F59 WeakPolarHBondContact ND1-CZ 3.38Å
26	K	82.9	Confident	82.3	Confident	82 Å²	82	68.2 Å²	68.2	36%	0.357	35%	0.346	S	S	.	.	H	α-helix	trans	-75.6	-38.2	-179.5	-154.8	145.5	-176	171.6	0	111.5	I8 F22 A23 L24 D28 S29 V30	I8-K26 HydrophobicContact CD1-CG 4.06Å; I8-K26 HydrophobicContact CG2-CB 4.3Å; F22-K26 HydrophobicContact CE1-CD 4.09Å; F22-K26 HydrophobicContact CZ-CD 4.26Å; F22-K26 WeakPolarHBondContact O-CB 3.49Å; F22-K26 PolarHBondContact O-N 3.05Å; F22-K26 VanDerWaalsContact O-N 3.15Å; A23-K26 PolarHBondContact O-N 3.01Å; L24-K26 VanDerWaalsContact C-N 3.28Å; L24-K26 PolarHBondContact O-N 3.39Å; K26-D28 VanDerWaalsContact C-N 3.34Å; K26-D28 PolarHBondContact O-N 3.11Å; K26-S29 PolarHBondContact O-N 3.23Å; K26-S29 PolarHBondContact O-OG 3.36Å; K26-V30 WeakPolarHBondContact O-CG2 3.49Å; K26-V30 PolarHBondContact O-N 3.25Å
27	L	82.8	Confident	82.3	Confident	1 Å²	1	66.1 Å²	66.1	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-58	-43.8	173.2	-80.6	158.8	0	0	0	111.6	I8 L12 A23 L24 S29 V30 V31 I38 V63	I8-L27 HydrophobicContact CG2-CD1 4.22Å; I8-L27 HydrophobicContact CG2-CD2 4.31Å; I8-L27 HydrophobicContact CG2-CG 3.76Å; L12-L27 HydrophobicContact CD1-CD1 3.94Å; L12-L27 HydrophobicContact CD2-CD1 4.35Å; L12-L27 HydrophobicContact CG-CD1 4.43Å; A23-L27 WeakPolarHBondContact O-CB 3.42Å; A23-L27 WeakPolarHBondContact O-CD1 2.9Å; A23-L27 VanDerWaalsContact O-CG 3.29Å; A23-L27 WeakPolarHBondContact O-CG 3.29Å; A23-L27 PolarHBondContact O-N 2.83Å; L24-L27 PolarHBondContact O-N 3.35Å; L27-S29 VanDerWaalsContact C-N 3.29Å; L27-S29 PolarHBondContact O-N 3.15Å; L27-V30 PolarHBondContact O-N 3.23Å; L27-V30 VanDerWaalsContact O-N 3.16Å; L27-V31 WeakPolarHBondContact O-CB 3.35Å; L27-V31 PolarHBondContact O-N 3.23Å; L27-I38 HydrophobicContact CD2-CD1 3.64Å; L27-I38 HydrophobicContact CD2-CG1 3.76Å; L27-I38 HydrophobicContact CD2-CG2 4.27Å; L27-V63 HydrophobicContact CB-CG1 3.96Å
28	D	82.5	Confident	82.5	Confident	39 Å²	39	62.4 Å²	62.4	21%	0.209	31%	0.312	C	S	.	.	H	α-helix	trans	-58.6	-40.3	178.6	-169.2	57.1	0	0	0	112.8	L24 K26 V30 F59 V63 K66	L24-D28 PolarHBondContact O-N 3.5Å; K26-D28 VanDerWaalsContact C-N 3.34Å; K26-D28 PolarHBondContact O-N 3.11Å; D28-V30 VanDerWaalsContact C-N 3.33Å; D28-V30 PolarHBondContact O-N 2.96Å; D28-F59 HydrophobicContact CB-CE1 3.99Å; D28-V63 HydrophobicContact CB-CG2 4.1Å; D28-K66 WeakPolarHBondContact OD1-CD 3.42Å; D28-K66 WeakPolarHBondContact OD1-CE 3.26Å; D28-K66 IonicContact OD1-NZ 3.35Å; D28-K66 PolarHBondContact OD1-NZ 2.97Å; D28-K66 IonicContact OD2-NZ 2.73Å; D28-K66 PolarHBondContact OD2-NZ 3.09Å
29	S	83.6	Confident	82.6	Confident	85 Å²	85	56.2 Å²	56.2	59%	0.594	29%	0.29	S	S	*	.	H	α-helix	trans	-71.6	-24.6	179.6	70.8	0	0	0	0	114.4	K26 L27	K26-S29 PolarHBondContact O-N 3.23Å; K26-S29 PolarHBondContact O-OG 3.36Å; L27-S29 VanDerWaalsContact C-N 3.29Å; L27-S29 PolarHBondContact O-N 3.15Å
30	V	85.3	Confident	82.6	Confident	16 Å²	16	56.5 Å²	56.5	10%	0.097	31%	0.307	C	S	.	.	H	α-helix	trans	-110.2	0.7	-174.2	-57.2	0	0	0	0	113.2	I8 K26 L27 D28 N32 D33 F34	I8-V30 HydrophobicContact CD1-CG2 4.17Å; K26-V30 WeakPolarHBondContact O-CG2 3.49Å; K26-V30 PolarHBondContact O-N 3.25Å; L27-V30 PolarHBondContact O-N 3.23Å; L27-V30 VanDerWaalsContact O-N 3.16Å; D28-V30 VanDerWaalsContact C-N 3.33Å; D28-V30 PolarHBondContact O-N 2.96Å; V30-N32 VanDerWaalsContact C-N 3.25Å; V30-N32 PolarHBondContact O-N 2.95Å; V30-D33 PolarHBondContact O-N 3.44Å; V30-D33 VanDerWaalsContact O-N 3.12Å; V30-F34 HydrophobicContact CB-CD2 4.02Å; V30-F34 PolarHBondContact O-N 3.29Å
31	V	82.8	Confident	82.8	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.006	31%	0.307	C	S	.	.	H	α-helix	trans	-61.1	-35	-172	95.1	0	0	0	0	112.1	L27 D33 W35 I38 K66 V67	L27-V31 WeakPolarHBondContact O-CB 3.35Å; L27-V31 PolarHBondContact O-N 3.23Å; V31-D33 VanDerWaalsContact C-N 3.29Å; V31-D33 PolarHBondContact O-N 3.3Å; V31-W35 WeakPolarHBondContact O-CA 3.38Å; V31-W35 VanDerWaalsContact O-CB 3.3Å; V31-W35 WeakPolarHBondContact O-CB 3.48Å; V31-W35 PolarHBondContact O-N 3.32Å; V31-W35 VanDerWaalsContact O-N 3.07Å; V31-I38 HydrophobicContact CG2-CD1 3.9Å; V31-K66 HydrophobicContact CG1-CB 3.88Å; V31-K66 HydrophobicContact CG1-CD 3.88Å; V31-K66 HydrophobicContact CG1-CG 4.48Å; V31-K66 HydrophobicContact CG2-CB 4.26Å; V31-V67 HydrophobicContact CG2-CG2 3.75Å
32	N	81.4	Confident	82.9	Confident	108 Å²	108	52.5 Å²	52.5	58%	0.578	29%	0.293	S	S	*	.	H	α-helix	trans	-67.8	-30	-179.4	-65.8	-23.9	0	0	0	112.7	V30 H70	V30-N32 VanDerWaalsContact C-N 3.25Å; V30-N32 PolarHBondContact O-N 2.95Å; N32-H70 PolarHBondContact OD1-NE2 3.08Å
33	D	84.1	Confident	82.9	Confident	128 Å²	128	52 Å²	52	68%	0.684	30%	0.295	S	S	*	.	H	α-helix	trans	-92.5	-32.7	-176.8	-63	-29.1	0	0	0	112.2	V30 V31	V30-D33 PolarHBondContact O-N 3.44Å; V30-D33 VanDerWaalsContact O-N 3.12Å; V31-D33 VanDerWaalsContact C-N 3.29Å; V31-D33 PolarHBondContact O-N 3.3Å
34	F	83.9	Confident	82.9	Confident	41 Å²	41	55.5 Å²	55.5	18%	0.18	31%	0.31	C	S	.	.	H	α-helix	trans	-121.3	21.2	-170.8	-62.6	-81.5	0	0	0	114.8	I2 A5 V30 A36 E37 I38	I2-F34 VanDerWaalsContact O-CZ 3.23Å; I2-F34 WeakPolarHBondContact O-CZ 3.43Å; A5-F34 HydrophobicContact CB-CB 3.87Å; A5-F34 HydrophobicContact CB-CG 4.25Å; V30-F34 HydrophobicContact CB-CD2 4.02Å; V30-F34 PolarHBondContact O-N 3.29Å; F34-A36 PolarHBondContact O-N 3.22Å; F34-A36 VanDerWaalsContact O-N 3.11Å; F34-E37 PolarHBondContact O-N 3Å; F34-I38 WeakPolarHBondContact O-CG1 3.3Å; F34-I38 PolarHBondContact O-N 3.34Å
35	W	83	Confident	82.9	Confident	102 Å²	102	55.5 Å²	55.5	39%	0.386	31%	0.311	S	S	.	.	H	α-helix	trans	-52.3	-36	-179.8	63.8	-90.6	0	0	0	113.6	V31 E37 I38 S39 H70	V31-W35 WeakPolarHBondContact O-CA 3.38Å; V31-W35 VanDerWaalsContact O-CB 3.3Å; V31-W35 WeakPolarHBondContact O-CB 3.48Å; V31-W35 PolarHBondContact O-N 3.32Å; V31-W35 VanDerWaalsContact O-N 3.07Å; W35-E37 VanDerWaalsContact C-N 3.32Å; W35-E37 PolarHBondContact O-N 2.81Å; W35-I38 PolarHBondContact O-N 2.63Å; W35-S39 WeakPolarHBondContact O-CB 3.3Å; W35-S39 PolarHBondContact O-N 3.04Å; W35-S39 PolarHBondContact O-OG 3.06Å; W35-H70 HydrophobicContact CB-CB 3.8Å; W35-H70 HydrophobicContact CD2-CB 3.9Å; W35-H70 HydrophobicContact CE3-CB 4.13Å; W35-H70 HydrophobicContact CG-CB 3.77Å
36	A	82.4	Confident	83	Confident	64 Å²	64	53.3 Å²	53.3	53%	0.529	30%	0.301	S	S	.	.	H	α-helix	trans	-67.5	-27.9	-179.1	0	0	0	0	0	113.9	F34 S39	F34-A36 PolarHBondContact O-N 3.22Å; F34-A36 VanDerWaalsContact O-N 3.11Å; A36-S39 PolarHBondContact O-OG 3.38Å
37	E	81.6	Confident	83.1	Confident	78 Å²	78	54 Å²	54	36%	0.364	31%	0.311	S	S	.	.	H	α-helix	trans	-81.6	-37	173.7	-68.8	-172.6	170.4	0	0	110.9	S4 A5 F34 W35 G40	S4-E37 WeakPolarHBondContact CA-OE2 3.35Å; S4-E37 PolarHBondContact OG-OE1 3.02Å; S4-E37 PolarHBondContact OG-OE2 3.27Å; A5-E37 HydrophobicContact CB-CB 4.48Å; A5-E37 PolarHBondContact N-OE2 3.29Å; F34-E37 PolarHBondContact O-N 3Å; W35-E37 VanDerWaalsContact C-N 3.32Å; W35-E37 PolarHBondContact O-N 2.81Å; E37-G40 PolarHBondContact O-N 3.29Å
38	I	81.8	Confident	83.1	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-71.2	-35	-179.1	-56.3	165.7	0	0	0	110.9	A5 L27 V31 F34 W35 G40 S41 V42 I45 V67	A5-I38 HydrophobicContact CB-CG1 4.27Å; L27-I38 HydrophobicContact CD2-CD1 3.64Å; L27-I38 HydrophobicContact CD2-CG1 3.76Å; L27-I38 HydrophobicContact CD2-CG2 4.27Å; V31-I38 HydrophobicContact CG2-CD1 3.9Å; F34-I38 WeakPolarHBondContact O-CG1 3.3Å; F34-I38 PolarHBondContact O-N 3.34Å; W35-I38 PolarHBondContact O-N 2.63Å; I38-G40 PolarHBondContact O-N 3.38Å; I38-S41 CarbonylContact O-C 3.43Å; I38-S41 PolarHBondContact O-N 3.12Å; I38-V42 PolarHBondContact O-N 2.98Å; I38-I45 HydrophobicContact CG2-CD1 3.89Å; I38-V67 HydrophobicContact CB-CG2 4.13Å; I38-V67 HydrophobicContact CG2-CG1 4.45Å; I38-V67 HydrophobicContact CG2-CG2 3.46Å; I38-V67 VanDerWaalsContact CG2-CG2 3.46Å
39	S	81.9	Confident	83.1	Confident	36 Å²	36	55.7 Å²	55.7	25%	0.252	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-60.4	-30.9	177.3	61.3	0	0	0	0	113	W35 A36 S41 L71	W35-S39 WeakPolarHBondContact O-CB 3.3Å; W35-S39 PolarHBondContact O-N 3.04Å; W35-S39 PolarHBondContact O-OG 3.06Å; A36-S39 PolarHBondContact O-OG 3.38Å; S39-S41 PolarHBondContact O-N 3.07Å; S39-L71 VanDerWaalsContact CB-CD1 3.49Å
40	G	81.9	Confident	83.2	Confident	63 Å²	63	58.7 Å²	58.7	65%	0.649	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-71.8	-4.4	175.4	0	0	0	0	0	114.1	E37 I38	E37-G40 PolarHBondContact O-N 3.29Å; I38-G40 PolarHBondContact O-N 3.38Å
41	S	83	Confident	83.1	Confident	28 Å²	28	61.2 Å²	61.2	20%	0.196	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-136.3	23.7	-179.5	-64.2	0	0	0	0	112.3	I38 S39 D43 K44	I38-S41 CarbonylContact O-C 3.43Å; I38-S41 PolarHBondContact O-N 3.12Å; S39-S41 PolarHBondContact O-N 3.07Å; S41-D43 VanDerWaalsContact C-N 3.27Å; S41-D43 PolarHBondContact O-N 3.44Å; S41-K44 WeakPolarHBondContact O-CB 3.3Å; S41-K44 PolarHBondContact O-N 3.16Å
42	V	83.6	Confident	82.6	Confident	11 Å²	11	69.5 Å²	69.5	7%	0.067	37%	0.372	C	S	.	.	H	α-helix	trans	-62.7	-35.3	-178.7	112.3	0	0	0	0	111.8	I38 K44 I45 E46 V67 F68	I38-V42 PolarHBondContact O-N 2.98Å; V42-K44 PolarHBondContact O-N 3.35Å; V42-I45 WeakPolarHBondContact O-CA 3.48Å; V42-I45 WeakPolarHBondContact O-CB 3.45Å; V42-I45 PolarHBondContact O-N 3.24Å; V42-E46 HydrophobicContact CG1-CG 4.44Å; V42-E46 PolarHBondContact O-N 2.96Å; V42-V67 HydrophobicContact CG2-CB 4.07Å; V42-V67 HydrophobicContact CG2-CG1 3.63Å; V42-F68 HydrophobicContact CG1-CE1 4.16Å; V42-F68 HydrophobicContact CG1-CE2 4.31Å; V42-F68 HydrophobicContact CG1-CZ 3.6Å; V42-F68 HydrophobicContact CG2-CE2 4.3Å; V42-F68 HydrophobicContact CG2-CZ 4.26Å
43	D	84.4	Confident	82.4	Confident	109 Å²	109	69 Å²	69	58%	0.583	38%	0.377	S	S	*	.	H	α-helix	trans	-51.9	-35.5	177.2	-46.6	-9.1	0	0	0	111.9	S41 I45 E46 V47	S41-D43 VanDerWaalsContact C-N 3.27Å; S41-D43 PolarHBondContact O-N 3.44Å; D43-I45 VanDerWaalsContact C-N 3.34Å; D43-E46 PolarHBondContact O-N 3.38Å; D43-V47 VanDerWaalsContact O-CG2 3.3Å; D43-V47 WeakPolarHBondContact O-CG2 3.41Å; D43-V47 PolarHBondContact O-N 3.27Å
44	K	82.4	Confident	82.1	Confident	72 Å²	72	63.7 Å²	63.7	31%	0.313	35%	0.348	S	S	.	.	H	α-helix	trans	-68.6	-35.2	178	-59.7	-173.1	-178.8	-171.2	0	111.9	D13 S41 V42 L48	D13-K44 WeakPolarHBondContact OD1-CE 3.42Å; D13-K44 IonicContact OD1-NZ 2.86Å; D13-K44 PolarHBondContact OD1-NZ 3.32Å; D13-K44 IonicContact OD2-NZ 2.86Å; D13-K44 PolarHBondContact OD2-NZ 3.47Å; S41-K44 WeakPolarHBondContact O-CB 3.3Å; S41-K44 PolarHBondContact O-N 3.16Å; V42-K44 PolarHBondContact O-N 3.35Å; K44-L48 VanDerWaalsContact O-CG 3.3Å; K44-L48 WeakPolarHBondContact O-CG 3.43Å; K44-L48 PolarHBondContact O-N 2.73Å
45	I	82.8	Confident	81.7	Confident	2 Å²	2	70.8 Å²	70.8	1%	0.01	38%	0.382	C	S	.	.	H	α-helix	trans	-73.4	-35.5	177.3	-51.4	177.1	0	0	0	109.6	L12 I38 V42 D43 L48 Y49 A60 V63 A64	L12-I45 HydrophobicContact CD1-CG1 4.36Å; I38-I45 HydrophobicContact CG2-CD1 3.89Å; V42-I45 WeakPolarHBondContact O-CA 3.48Å; V42-I45 WeakPolarHBondContact O-CB 3.45Å; V42-I45 PolarHBondContact O-N 3.24Å; D43-I45 VanDerWaalsContact C-N 3.34Å; I45-L48 PolarHBondContact O-N 3.3Å; I45-Y49 PolarHBondContact O-N 2.86Å; I45-A60 HydrophobicContact CG2-CB 4.23Å; I45-A60 VanDerWaalsContact CG2-O 3.31Å; I45-A60 WeakPolarHBondContact CG2-O 3.41Å; I45-V63 HydrophobicContact CD1-CG1 4.11Å; I45-A64 HydrophobicContact CG2-CB 3.88Å
46	E	83.9	Confident	81.4	Confident	52 Å²	52	66.8 Å²	66.8	24%	0.243	37%	0.369	C	S	.	.	H	α-helix	trans	-63	-45.7	173.6	-61.5	-177.6	171.3	0	0	111.8	V42 D43 L48 Y49 E50 F68 Y80	V42-E46 HydrophobicContact CG1-CG 4.44Å; V42-E46 PolarHBondContact O-N 2.96Å; D43-E46 PolarHBondContact O-N 3.38Å; E46-L48 PolarHBondContact O-N 3.04Å; E46-Y49 CarbonylContact O-C 3.6Å; E46-Y49 WeakPolarHBondContact O-CA 3.22Å; E46-Y49 WeakPolarHBondContact O-CB 3.41Å; E46-Y49 PolarHBondContact O-N 3Å; E46-E50 PolarHBondContact O-N 3.05Å; E46-F68 WeakPolarHBondContact OE1-CZ 3.38Å; E46-Y80 HydrophobicContact CG-CE1 4.48Å; E46-Y80 WeakPolarHBondContact CG-OH 3.31Å; E46-Y80 PolarHBondContact OE1-OH 2.92Å
47	V	85.8	Confident	81.3	Confident	96 Å²	96	68.5 Å²	68.5	58%	0.582	36%	0.362	S	S	*	.	H	α-helix	trans	-58.7	-37.2	175.9	171.6	0	0	0	0	111.6	D43 Y49 D51	D43-V47 VanDerWaalsContact O-CG2 3.3Å; D43-V47 WeakPolarHBondContact O-CG2 3.41Å; D43-V47 PolarHBondContact O-N 3.27Å; V47-Y49 VanDerWaalsContact C-N 3.32Å; V47-D51 PolarHBondContact O-N 3.4Å
48	L	82.4	Confident	81.3	Confident	9 Å²	9	67.9 Å²	67.9	5%	0.047	36%	0.359	C	S	.	.	H	α-helix	trans	-71.8	-26	175.7	-67.3	174.5	0	0	0	113.5	L12 K20 K44 I45 E46 A60	L12-L48 HydrophobicContact CD2-CD1 3.74Å; K20-L48 HydrophobicContact CD-CD2 3.65Å; K44-L48 VanDerWaalsContact O-CG 3.3Å; K44-L48 WeakPolarHBondContact O-CG 3.43Å; K44-L48 PolarHBondContact O-N 2.73Å; I45-L48 PolarHBondContact O-N 3.3Å; E46-L48 PolarHBondContact O-N 3.04Å; L48-A60 HydrophobicContact CB-CB 4.29Å
49	Y	83.8	Confident	81.3	Confident	66 Å²	66	69.3 Å²	69.3	26%	0.259	37%	0.365	S	S	.	.	H	α-helix	trans	-79.2	-36.7	174.3	172.4	-106.3	0	0	0	112.1	I45 E46 V47 D51 A61 Y80 G83	I45-Y49 PolarHBondContact O-N 2.86Å; E46-Y49 CarbonylContact O-C 3.6Å; E46-Y49 WeakPolarHBondContact O-CA 3.22Å; E46-Y49 WeakPolarHBondContact O-CB 3.41Å; E46-Y49 PolarHBondContact O-N 3Å; V47-Y49 VanDerWaalsContact C-N 3.32Å; Y49-D51 VanDerWaalsContact C-N 3.28Å; Y49-D51 PolarHBondContact O-N 3.09Å; Y49-A61 HydrophobicContact CD2-CB 3.57Å; Y49-A61 HydrophobicContact CE2-CB 3.66Å; Y49-A61 HydrophobicContact CG-CB 4.5Å; Y49-Y80 AromaticContact CD1-CD1 3.84Å; Y49-Y80 HydrophobicContact CD1-CD1 3.84Å; Y49-Y80 AromaticContact CD1-CE1 3.51Å; Y49-Y80 HydrophobicContact CD1-CE1 3.51Å; Y49-Y80 HydrophobicContact CE1-CD1 4Å; Y49-Y80 AromaticContact CE1-CE1 3.9Å; Y49-Y80 HydrophobicContact CE1-CE1 3.9Å; Y49-Y80 HydrophobicContact CG-CD1 4.16Å; Y49-Y80 HydrophobicContact CG-CE1 4.1Å; Y49-G83 VanDerWaalsContact OH-CA 3.31Å; Y49-G83 WeakPolarHBondContact OH-CA 3.33Å
50	E	83.9	Confident	81.4	Confident	149 Å²	149	67.6 Å²	67.6	70%	0.696	35%	0.353	S	S	*	.	H	α-helix	trans	-70.2	-22.4	177.4	-70.4	-166.1	165.8	0	0	113.3	E46 E52	E46-E50 PolarHBondContact O-N 3.05Å; E50-E52 PolarHBondContact O-N 3.43Å; E50-E52 VanDerWaalsContact O-N 3.14Å
51	D	83.6	Confident	81.5	Confident	69 Å²	69	64.6 Å²	64.6	37%	0.369	32%	0.322	S	S	.	.			trans	-74.9	101.4	178.4	-169.5	-8.6	0	0	0	112.2	V47 Y49 S53 F54	V47-D51 PolarHBondContact O-N 3.4Å; Y49-D51 VanDerWaalsContact C-N 3.28Å; Y49-D51 PolarHBondContact O-N 3.09Å; D51-S53 VanDerWaalsContact CG-OG 3.31Å; D51-S53 PolarHBondContact O-N 3.36Å; D51-S53 VanDerWaalsContact O-N 3.14Å; D51-S53 WeakPolarHBondContact OD1-CB 3.38Å; D51-S53 PolarHBondContact OD1-N 3.32Å; D51-S53 PolarHBondContact OD1-OG 3.05Å; D51-S53 PolarHBondContact OD2-OG 3.06Å; D51-F54 HydrophobicContact CB-CB 4.44Å; D51-F54 PolarHBondContact O-N 3.29Å
52	E	73.9	Confident	81.6	Confident	175 Å²	175	64.1 Å²	64.1	82%	0.818	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-18.7	178.1	-64.9	-169.1	158.2	0	0	114	E50 F54	E50-E52 PolarHBondContact O-N 3.43Å; E50-E52 VanDerWaalsContact O-N 3.14Å; E52-F54 VanDerWaalsContact C-N 3.31Å
53	S	76.9	Confident	81.7	Confident	96 Å²	96	63.6 Å²	63.6	67%	0.671	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-11.8	180	75.2	0	0	0	0	113.5	D51	D51-S53 VanDerWaalsContact CG-OG 3.31Å; D51-S53 PolarHBondContact O-N 3.36Å; D51-S53 VanDerWaalsContact O-N 3.14Å; D51-S53 WeakPolarHBondContact OD1-CB 3.38Å; D51-S53 PolarHBondContact OD1-N 3.32Å; D51-S53 PolarHBondContact OD1-OG 3.05Å; D51-S53 PolarHBondContact OD2-OG 3.06Å
54	F	76.9	Confident	81.7	Confident	18 Å²	18	58.4 Å²	58.4	8%	0.079	29%	0.286	C	S	.	.			trans	-86.1	123.1	-175.7	-168.8	-113.2	0	0	0	112.3	P17 K20 L24 D51 E52 S56	P17-F54 HydrophobicContact CB-CD2 4.34Å; P17-F54 HydrophobicContact CB-CE2 3.95Å; K20-F54 HydrophobicContact CB-CE2 4.06Å; K20-F54 HydrophobicContact CB-CZ 3.92Å; K20-F54 HydrophobicContact CD-CE2 4.3Å; L24-F54 HydrophobicContact CD1-CE1 3.98Å; L24-F54 HydrophobicContact CD1-CZ 4.31Å; D51-F54 HydrophobicContact CB-CB 4.44Å; D51-F54 PolarHBondContact O-N 3.29Å; E52-F54 VanDerWaalsContact C-N 3.31Å; F54-S56 PolarHBondContact O-N 3.29Å
55	Q	75.1	Confident	82	Confident	190 Å²	190	55 Å²	55	89%	0.888	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-33.2	-175.4	-68.7	-179.2	-5.4	0	0	113.2	R57	Q55-R57 PolarHBondContact O-N 3.04Å
56	S	77.1	Confident	82.1	Confident	17 Å²	17	56.9 Å²	56.9	12%	0.119	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	28.9	-176	-36.9	0	0	0	0	112.7	E21 F54 E58 F59 A60	E21-S56 PolarHBondContact OE1-OG 3.22Å; E21-S56 VanDerWaalsContact OE1-OG 3.06Å; F54-S56 PolarHBondContact O-N 3.29Å; S56-E58 PolarHBondContact O-N 3.18Å; S56-F59 WeakPolarHBondContact O-CB 3.36Å; S56-F59 PolarHBondContact O-N 3.5Å; S56-A60 PolarHBondContact O-N 2.97Å
57	R	81.2	Confident	82.3	Confident	101 Å²	101	54.5 Å²	54.5	38%	0.381	27%	0.268	S	S	.	.	H	α-helix	trans	-54.6	-35.4	178.1	70.9	-179.2	-172	174.7	-0.5	112.9	Q55 F59 A60 A61	Q55-R57 PolarHBondContact O-N 3.04Å; R57-F59 VanDerWaalsContact C-N 3.26Å; R57-F59 PolarHBondContact O-N 3.21Å; R57-A60 PolarHBondContact O-N 3.44Å; R57-A61 PolarHBondContact O-N 3.19Å
58	E	80.7	Confident	82.3	Confident	65 Å²	65	50.4 Å²	50.4	30%	0.304	24%	0.243	S	C	.	.	H	α-helix	trans	-67.8	-32.7	-178.3	-63.1	175.3	177.5	0	0	110.6	S56 L62 A84 L87	S56-E58 PolarHBondContact O-N 3.18Å; E58-L62 PolarHBondContact O-N 3.14Å; E58-L62 VanDerWaalsContact O-N 3.08Å; E58-A84 WeakPolarHBondContact O-CB 3.31Å; E58-L87 HydrophobicContact CB-CD1 3.58Å; E58-L87 HydrophobicContact CB-CG 4.31Å
59	F	81.5	Confident	82.6	Confident	32 Å²	32	52 Å²	52	14%	0.14	25%	0.249	C	C	.	.	H	α-helix	trans	-75.8	-37.3	176.7	-137.1	-81	0	0	0	111.6	L24 H25 D28 S56 R57 A61 L62 V63 L87	L24-F59 HydrophobicContact CB-CD1 4Å; H25-F59 AromaticContact CE1-CE2 3.41Å; H25-F59 VanDerWaalsContact CE1-CE2 3.41Å; H25-F59 WeakPolarHBondContact CE1-CE2 3.29Å; H25-F59 AromaticContact CE1-CZ 3.42Å; H25-F59 VanDerWaalsContact CE1-CZ 3.42Å; H25-F59 WeakPolarHBondContact CE1-CZ 3.36Å; H25-F59 AromaticContact ND1-CE1 3.62Å; H25-F59 AromaticContact ND1-CE2 3.75Å; H25-F59 AromaticContact ND1-CZ 3.22Å; H25-F59 WeakPolarHBondContact ND1-CZ 3.38Å; D28-F59 HydrophobicContact CB-CE1 3.99Å; S56-F59 WeakPolarHBondContact O-CB 3.36Å; S56-F59 PolarHBondContact O-N 3.5Å; R57-F59 VanDerWaalsContact C-N 3.26Å; R57-F59 PolarHBondContact O-N 3.21Å; F59-A61 VanDerWaalsContact C-N 3.31Å; F59-L62 PolarHBondContact O-N 3.44Å; F59-V63 HydrophobicContact CD1-CG2 4.34Å; F59-V63 WeakPolarHBondContact O-CG2 3.45Å; F59-V63 PolarHBondContact O-N 2.89Å; F59-V63 VanDerWaalsContact O-N 3.09Å; F59-L87 HydrophobicContact CB-CD1 4.19Å; F59-L87 HydrophobicContact CD2-CD1 3.59Å; F59-L87 HydrophobicContact CD2-CD2 4.49Å; F59-L87 HydrophobicContact CE2-CD1 4.35Å; F59-L87 HydrophobicContact CG-CD1 4.26Å
60	A	83.7	Confident	82.6	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61	-42.9	171.6	0	0	0	0	0	111.2	L24 I45 L48 S56 R57 L62 V63 A64	L24-A60 HydrophobicContact CD1-CB 3.98Å; L24-A60 HydrophobicContact CD2-CB 4.21Å; I45-A60 HydrophobicContact CG2-CB 4.23Å; I45-A60 VanDerWaalsContact CG2-O 3.31Å; I45-A60 WeakPolarHBondContact CG2-O 3.41Å; L48-A60 HydrophobicContact CB-CB 4.29Å; S56-A60 PolarHBondContact O-N 2.97Å; R57-A60 PolarHBondContact O-N 3.44Å; A60-L62 PolarHBondContact O-N 3.14Å; A60-V63 PolarHBondContact O-N 3.06Å; A60-A64 WeakPolarHBondContact O-CB 3.46Å; A60-A64 PolarHBondContact O-N 3.39Å
61	A	84.8	Confident	82.7	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.1	-41	175.9	0	0	0	0	0	112.4	Y49 R57 F59 S65 Y80 A84	Y49-A61 HydrophobicContact CD2-CB 3.57Å; Y49-A61 HydrophobicContact CE2-CB 3.66Å; Y49-A61 HydrophobicContact CG-CB 4.5Å; R57-A61 PolarHBondContact O-N 3.19Å; F59-A61 VanDerWaalsContact C-N 3.31Å; A61-S65 VanDerWaalsContact O-CB 3.26Å; A61-S65 WeakPolarHBondContact O-CB 3.33Å; A61-S65 PolarHBondContact O-N 3.17Å; A61-Y80 VanDerWaalsContact CB-O 3.29Å; A61-Y80 WeakPolarHBondContact CB-O 3.4Å; A61-Y80 WeakPolarHBondContact O-CB 3.08Å; A61-A84 HydrophobicContact CB-CB 4.07Å
62	L	84.7	Confident	82.8	Confident	17 Å²	17	47.7 Å²	47.7	9%	0.089	24%	0.241	C	C	.	.	H	α-helix	trans	-63.3	-45.5	177.1	-172.8	70.6	0	0	0	112.1	E58 F59 A60 S65 K66 A84 Y96	E58-L62 PolarHBondContact O-N 3.14Å; E58-L62 VanDerWaalsContact O-N 3.08Å; F59-L62 PolarHBondContact O-N 3.44Å; A60-L62 PolarHBondContact O-N 3.14Å; L62-S65 PolarHBondContact O-N 3.24Å; L62-K66 PolarHBondContact O-N 2.65Å; L62-A84 HydrophobicContact CB-CB 4.2Å; L62-Y96 HydrophobicContact CD1-CE1 4.43Å
63	V	85.3	Confident	83.5	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.6	-44.8	179	177.1	0	0	0	0	110.6	L24 L27 D28 I45 F59 A60 S65 K66 V67	L24-V63 HydrophobicContact CD2-CB 4.4Å; L24-V63 HydrophobicContact CD2-CG2 4.28Å; L27-V63 HydrophobicContact CB-CG1 3.96Å; D28-V63 HydrophobicContact CB-CG2 4.1Å; I45-V63 HydrophobicContact CD1-CG1 4.11Å; F59-V63 HydrophobicContact CD1-CG2 4.34Å; F59-V63 WeakPolarHBondContact O-CG2 3.45Å; F59-V63 PolarHBondContact O-N 2.89Å; F59-V63 VanDerWaalsContact O-N 3.09Å; A60-V63 PolarHBondContact O-N 3.06Å; V63-S65 VanDerWaalsContact C-N 3.29Å; V63-S65 PolarHBondContact O-N 3.46Å; V63-K66 PolarHBondContact O-N 3.3Å; V63-V67 VanDerWaalsContact O-CG2 3.31Å; V63-V67 WeakPolarHBondContact O-CG2 3.23Å; V63-V67 PolarHBondContact O-N 2.93Å
64	A	85.8	Confident	83.9	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-56.3	-46.7	174.6	0	0	0	0	0	110.9	I45 A60 K66 V67 F68 Y80	I45-A64 HydrophobicContact CG2-CB 3.88Å; A60-A64 WeakPolarHBondContact O-CB 3.46Å; A60-A64 PolarHBondContact O-N 3.39Å; A64-K66 PolarHBondContact O-N 3.14Å; A64-V67 PolarHBondContact O-N 3.37Å; A64-V67 VanDerWaalsContact O-N 3.11Å; A64-F68 HydrophobicContact CB-CD2 4.44Å; A64-F68 HydrophobicContact CB-CE2 4.36Å; A64-F68 WeakPolarHBondContact O-CD2 3.38Å; A64-F68 PolarHBondContact O-N 3.45Å; A64-Y80 HydrophobicContact CB-CD1 4.16Å; A64-Y80 HydrophobicContact CB-CD2 4.36Å; A64-Y80 HydrophobicContact CB-CG 4.02Å
65	S	87.6	Confident	84.2	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.8	-40.4	-179.9	-173.6	0	0	0	0	113.1	A61 L62 V63 V67 F68 Y69 S77 Y96	A61-S65 VanDerWaalsContact O-CB 3.26Å; A61-S65 WeakPolarHBondContact O-CB 3.33Å; A61-S65 PolarHBondContact O-N 3.17Å; L62-S65 PolarHBondContact O-N 3.24Å; V63-S65 VanDerWaalsContact C-N 3.29Å; V63-S65 PolarHBondContact O-N 3.46Å; S65-V67 PolarHBondContact O-N 2.91Å; S65-F68 PolarHBondContact O-N 2.93Å; S65-Y69 WeakPolarHBondContact O-CB 3.1Å; S65-Y69 PolarHBondContact O-N 3.5Å; S65-S77 WeakPolarHBondContact CB-O 3.43Å; S65-S77 PolarHBondContact O-OG 3.19Å; S65-S77 PolarHBondContact OG-O 3.35Å; S65-S77 PolarHBondContact OG-OG 2.7Å; S65-Y96 WeakPolarHBondContact CB-OH 3.1Å; S65-Y96 PolarHBondContact OG-OH 3Å
66	K	85.9	Confident	84.6	Confident	43 Å²	43	40.2 Å²	40.2	19%	0.187	20%	0.2	C	C	.	.	H	α-helix	trans	-66.4	-33.7	173.6	-71.5	-175.8	-177.8	177	0	113.2	D28 V31 L62 V63 A64 Y69 H70 Y96	D28-K66 WeakPolarHBondContact OD1-CD 3.42Å; D28-K66 WeakPolarHBondContact OD1-CE 3.26Å; D28-K66 IonicContact OD1-NZ 3.35Å; D28-K66 PolarHBondContact OD1-NZ 2.97Å; D28-K66 IonicContact OD2-NZ 2.73Å; D28-K66 PolarHBondContact OD2-NZ 3.09Å; V31-K66 HydrophobicContact CG1-CB 3.88Å; V31-K66 HydrophobicContact CG1-CD 3.88Å; V31-K66 HydrophobicContact CG1-CG 4.48Å; V31-K66 HydrophobicContact CG2-CB 4.26Å; L62-K66 PolarHBondContact O-N 2.65Å; V63-K66 PolarHBondContact O-N 3.3Å; A64-K66 PolarHBondContact O-N 3.14Å; K66-Y69 WeakPolarHBondContact O-CB 3.09Å; K66-H70 PolarHBondContact O-CD2 3.38Å; K66-H70 PolarHBondContact O-N 3.06Å; K66-Y96 HydrophobicContact CB-CE2 4.35Å; K66-Y96 HydrophobicContact CG-CD1 4.26Å; K66-Y96 HydrophobicContact CG-CD2 4.05Å; K66-Y96 HydrophobicContact CG-CE1 3.98Å; K66-Y96 HydrophobicContact CG-CE2 3.75Å; K66-Y96 HydrophobicContact CG-CG 4.29Å
67	V	87.2	Confident	85	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-68.9	-46.8	175.6	176.9	0	0	0	0	110.4	V31 I38 V42 V63 A64 S65 Y69 H70 L71	V31-V67 HydrophobicContact CG2-CG2 3.75Å; I38-V67 HydrophobicContact CB-CG2 4.13Å; I38-V67 HydrophobicContact CG2-CG1 4.45Å; I38-V67 HydrophobicContact CG2-CG2 3.46Å; I38-V67 VanDerWaalsContact CG2-CG2 3.46Å; V42-V67 HydrophobicContact CG2-CB 4.07Å; V42-V67 HydrophobicContact CG2-CG1 3.63Å; V63-V67 VanDerWaalsContact O-CG2 3.31Å; V63-V67 WeakPolarHBondContact O-CG2 3.23Å; V63-V67 PolarHBondContact O-N 2.93Å; A64-V67 PolarHBondContact O-N 3.37Å; A64-V67 VanDerWaalsContact O-N 3.11Å; S65-V67 PolarHBondContact O-N 2.91Å; V67-Y69 VanDerWaalsContact C-N 3.27Å; V67-Y69 PolarHBondContact O-N 3.11Å; V67-H70 PolarHBondContact O-N 3.37Å; V67-L71 PolarHBondContact O-N 3.47Å
68	F	86.8	Confident	85.1	Confident	10 Å²	10	34.8 Å²	34.8	4%	0.044	18%	0.177	C	C	.	.	H	α-helix	trans	-63.8	-32.2	176.1	-75	-61.9	0	0	0	113	V42 E46 A64 S65 L71 G72 A73 E76 Y80	V42-F68 HydrophobicContact CG1-CE1 4.16Å; V42-F68 HydrophobicContact CG1-CE2 4.31Å; V42-F68 HydrophobicContact CG1-CZ 3.6Å; V42-F68 HydrophobicContact CG2-CE2 4.3Å; V42-F68 HydrophobicContact CG2-CZ 4.26Å; E46-F68 WeakPolarHBondContact OE1-CZ 3.38Å; A64-F68 HydrophobicContact CB-CD2 4.44Å; A64-F68 HydrophobicContact CB-CE2 4.36Å; A64-F68 WeakPolarHBondContact O-CD2 3.38Å; A64-F68 PolarHBondContact O-N 3.45Å; S65-F68 PolarHBondContact O-N 2.93Å; F68-L71 HydrophobicContact CD1-CD2 4.49Å; F68-L71 PolarHBondContact O-N 2.98Å; F68-G72 PolarHBondContact O-N 3.31Å; F68-G72 VanDerWaalsContact O-N 3.09Å; F68-A73 HydrophobicContact CB-CB 4.49Å; F68-A73 HydrophobicContact CD1-CB 4.01Å; F68-A73 PolarHBondContact O-N 3.17Å; F68-E76 HydrophobicContact CD1-CB 4.06Å; F68-E76 WeakPolarHBondContact CD1-OE2 3.38Å; F68-E76 HydrophobicContact CD2-CB 4.28Å; F68-E76 HydrophobicContact CE1-CB 4.29Å; F68-E76 VanDerWaalsContact CE1-OE2 3.23Å; F68-E76 WeakPolarHBondContact CE1-OE2 3.42Å; F68-E76 HydrophobicContact CG-CB 4.05Å; F68-Y80 AromaticContact CD2-CD2 3.62Å; F68-Y80 HydrophobicContact CD2-CD2 3.62Å; F68-Y80 AromaticContact CD2-CE2 3.88Å; F68-Y80 HydrophobicContact CD2-CE2 3.88Å; F68-Y80 AromaticContact CE2-CD2 3.55Å; F68-Y80 HydrophobicContact CE2-CD2 3.55Å; F68-Y80 AromaticContact CE2-CE2 3.31Å; F68-Y80 HydrophobicContact CE2-CE2 3.31Å; F68-Y80 HydrophobicContact CZ-CE2 4.08Å
69	Y	87.4	Confident	85.4	Confident	44 Å²	44	36.1 Å²	36.1	17%	0.173	19%	0.186	C	C	.	.	H	α-helix	trans	-58.8	-49.7	171.5	170.5	-100.6	0	0	0	111.8	S65 K66 V67 L71 G72 F74 Y96 T99 I100	S65-Y69 WeakPolarHBondContact O-CB 3.1Å; S65-Y69 PolarHBondContact O-N 3.5Å; K66-Y69 WeakPolarHBondContact O-CB 3.09Å; V67-Y69 VanDerWaalsContact C-N 3.27Å; V67-Y69 PolarHBondContact O-N 3.11Å; Y69-L71 VanDerWaalsContact C-N 3.31Å; Y69-L71 PolarHBondContact O-N 3.41Å; Y69-G72 PolarHBondContact O-N 2.74Å; Y69-G72 VanDerWaalsContact O-N 3.14Å; Y69-F74 HydrophobicContact CD2-CD1 4.27Å; Y69-F74 AromaticContact CD2-CE1 3.83Å; Y69-F74 HydrophobicContact CD2-CE1 3.83Å; Y69-F74 HydrophobicContact CE2-CE1 4.1Å; Y69-Y96 AromaticContact CD1-CD2 3.94Å; Y69-Y96 HydrophobicContact CD1-CD2 3.94Å; Y69-Y96 AromaticContact CD2-CD2 3.96Å; Y69-Y96 HydrophobicContact CD2-CD2 3.96Å; Y69-Y96 AromaticContact CG-CD2 3.62Å; Y69-Y96 HydrophobicContact CG-CD2 3.62Å; Y69-Y96 HydrophobicContact CG-CE2 4.17Å; Y69-T99 HydrophobicContact CE2-CG2 3.8Å; Y69-T99 PolarHBondContact OH-OG1 3.39Å; Y69-I100 HydrophobicContact CD2-CD1 4.41Å
70	H	84.9	Confident	85.5	Confident	59 Å²	59	36.2 Å²	36.2	27%	0.273	19%	0.186	S	C	.	.	H	α-helix	trans	-69.6	-28	177.1	-73.6	-61.7	0	0	0	112.9	N32 W35 K66 V67 G72	N32-H70 PolarHBondContact OD1-NE2 3.08Å; W35-H70 HydrophobicContact CB-CB 3.8Å; W35-H70 HydrophobicContact CD2-CB 3.9Å; W35-H70 HydrophobicContact CE3-CB 4.13Å; W35-H70 HydrophobicContact CG-CB 3.77Å; K66-H70 PolarHBondContact O-CD2 3.38Å; K66-H70 PolarHBondContact O-N 3.06Å; V67-H70 PolarHBondContact O-N 3.37Å; H70-G72 PolarHBondContact O-N 2.9Å
71	L	86.8	Confident	85.5	Confident	93 Å²	93	36.3 Å²	36.3	49%	0.487	19%	0.186	S	C	.	.	H	α-helix	trans	-70.3	-17.2	172.6	-144.5	92.7	0	0	0	113.1	S39 V67 F68 Y69 A73	S39-L71 VanDerWaalsContact CB-CD1 3.49Å; V67-L71 PolarHBondContact O-N 3.47Å; F68-L71 HydrophobicContact CD1-CD2 4.49Å; F68-L71 PolarHBondContact O-N 2.98Å; Y69-L71 VanDerWaalsContact C-N 3.31Å; Y69-L71 PolarHBondContact O-N 3.41Å; L71-A73 VanDerWaalsContact C-N 3.31Å; L71-A73 HydrophobicContact CD2-CB 4.38Å
72	G	85.1	Confident	85.3	Confident	40 Å²	40	36.9 Å²	36.9	41%	0.412	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.5	6.5	-173.2	0	0	0	0	0	114.6	F68 Y69 H70 F74	F68-G72 PolarHBondContact O-N 3.31Å; F68-G72 VanDerWaalsContact O-N 3.09Å; Y69-G72 PolarHBondContact O-N 2.74Å; Y69-G72 VanDerWaalsContact O-N 3.14Å; H70-G72 PolarHBondContact O-N 2.9Å; G72-F74 VanDerWaalsContact O-CD2 3.23Å; G72-F74 WeakPolarHBondContact O-CD2 3.31Å; G72-F74 WeakPolarHBondContact O-CE2 3.21Å; G72-F74 PolarHBondContact O-N 3.41Å
73	A	87.9	Confident	85.1	Confident	25 Å²	25	36.2 Å²	36.2	21%	0.207	19%	0.187	C	C	.	.			trans	-87.7	76	177.4	0	0	0	0	0	110.6	F68 L71 E75 E76 S77	F68-A73 HydrophobicContact CB-CB 4.49Å; F68-A73 HydrophobicContact CD1-CB 4.01Å; F68-A73 PolarHBondContact O-N 3.17Å; L71-A73 VanDerWaalsContact C-N 3.31Å; L71-A73 HydrophobicContact CD2-CB 4.38Å; A73-E75 PolarHBondContact O-N 3.16Å; A73-E76 WeakPolarHBondContact CB-OE2 3.48Å; A73-S77 WeakPolarHBondContact O-CB 3.29Å; A73-S77 PolarHBondContact O-N 3.19Å; A73-S77 VanDerWaalsContact O-N 3.1Å
74	F	84.8	Confident	84.7	Confident	67 Å²	67	36.2 Å²	36.2	29%	0.294	19%	0.187	S	C	.	.	H	α-helix	trans	-70.4	-26.6	-170.7	-59.6	-68.6	0	0	0	115.1	Y69 G72 L78 T99 K103	Y69-F74 HydrophobicContact CD2-CD1 4.27Å; Y69-F74 AromaticContact CD2-CE1 3.83Å; Y69-F74 HydrophobicContact CD2-CE1 3.83Å; Y69-F74 HydrophobicContact CE2-CE1 4.1Å; G72-F74 VanDerWaalsContact O-CD2 3.23Å; G72-F74 WeakPolarHBondContact O-CD2 3.31Å; G72-F74 WeakPolarHBondContact O-CE2 3.21Å; G72-F74 PolarHBondContact O-N 3.41Å; F74-L78 WeakPolarHBondContact O-CB 3.43Å; F74-L78 PolarHBondContact O-N 2.61Å; F74-T99 HydrophobicContact CE1-CG2 4.32Å; F74-K103 HydrophobicContact CB-CD 4.17Å; F74-K103 HydrophobicContact CB-CG 4.03Å; F74-K103 HydrophobicContact CD1-CG 4.44Å; F74-K103 HydrophobicContact CG-CD 4.39Å; F74-K103 HydrophobicContact CG-CG 4.25Å
75	E	83.9	Confident	84.3	Confident	137 Å²	137	37.8 Å²	37.8	64%	0.64	20%	0.203	S	C	*	.	H	α-helix	trans	-71.6	-42	179.3	-68.7	-177.7	175.8	0	0	111.7	A73 L78 N79	A73-E75 PolarHBondContact O-N 3.16Å; E75-L78 WeakPolarHBondContact O-CB 3.41Å; E75-L78 PolarHBondContact O-N 3.45Å; E75-N79 PolarHBondContact O-N 3.49Å; E75-N79 VanDerWaalsContact O-N 3.13Å; E75-N79 PolarHBondContact O-ND2 3.1Å
76	E	83.9	Confident	83.6	Confident	94 Å²	94	44.5 Å²	44.5	44%	0.439	24%	0.239	S	C	.	.	H	α-helix	trans	-67.3	-45.2	174	-69.6	164.5	175	0	0	110.1	F68 A73 L78 N79 Y80	F68-E76 HydrophobicContact CD1-CB 4.06Å; F68-E76 WeakPolarHBondContact CD1-OE2 3.38Å; F68-E76 HydrophobicContact CD2-CB 4.28Å; F68-E76 HydrophobicContact CE1-CB 4.29Å; F68-E76 VanDerWaalsContact CE1-OE2 3.23Å; F68-E76 WeakPolarHBondContact CE1-OE2 3.42Å; F68-E76 HydrophobicContact CG-CB 4.05Å; A73-E76 WeakPolarHBondContact CB-OE2 3.48Å; E76-L78 VanDerWaalsContact C-N 3.25Å; E76-L78 PolarHBondContact O-N 3.44Å; E76-N79 PolarHBondContact O-N 3.49Å; E76-N79 VanDerWaalsContact O-N 3.07Å; E76-Y80 HydrophobicContact CB-CE2 4.49Å; E76-Y80 WeakPolarHBondContact O-CD2 3.35Å; E76-Y80 PolarHBondContact O-N 2.99Å
77	S	85.8	Confident	83	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-52.9	-43.6	173.1	-173.8	0	0	0	0	111.9	S65 A73 Y80 A81 I100	S65-S77 WeakPolarHBondContact CB-O 3.43Å; S65-S77 PolarHBondContact O-OG 3.19Å; S65-S77 PolarHBondContact OG-O 3.35Å; S65-S77 PolarHBondContact OG-OG 2.7Å; A73-S77 WeakPolarHBondContact O-CB 3.29Å; A73-S77 PolarHBondContact O-N 3.19Å; A73-S77 VanDerWaalsContact O-N 3.1Å; S77-Y80 PolarHBondContact O-N 3.07Å; S77-A81 WeakPolarHBondContact O-CB 3.32Å; S77-A81 PolarHBondContact O-N 2.93Å; S77-I100 WeakPolarHBondContact OG-CD1 3.08Å
78	L	83.7	Confident	82.4	Confident	4 Å²	4	46.1 Å²	46.1	2%	0.021	25%	0.249	C	C	.	.	H	α-helix	trans	-60.8	-47.5	175.6	175.3	62.6	0	0	0	112.4	F74 E75 E76 Y80 A81 L82 C104 H107 L131	F74-L78 WeakPolarHBondContact O-CB 3.43Å; F74-L78 PolarHBondContact O-N 2.61Å; E75-L78 WeakPolarHBondContact O-CB 3.41Å; E75-L78 PolarHBondContact O-N 3.45Å; E76-L78 VanDerWaalsContact C-N 3.25Å; E76-L78 PolarHBondContact O-N 3.44Å; L78-Y80 VanDerWaalsContact C-N 3.33Å; L78-Y80 PolarHBondContact O-N 3.13Å; L78-A81 PolarHBondContact O-N 3.03Å; L78-L82 HydrophobicContact CD1-CD1 4.19Å; L78-L82 HydrophobicContact CD1-CG 4.23Å; L78-L82 HydrophobicContact CG-CD1 4.12Å; L78-L82 VanDerWaalsContact O-CG 3.28Å; L78-L82 WeakPolarHBondContact O-CG 3.23Å; L78-L82 PolarHBondContact O-N 3.49Å; L78-C104 HydrophobicContact CD1-CB 4.02Å; L78-C104 WeakPolarHBondContact CD1-SG 3.38Å; L78-H107 HydrophobicContact CD2-CB 3.76Å; L78-L131 HydrophobicContact CD1-CD1 4.21Å; L78-L131 HydrophobicContact CD2-CD1 4.5Å
79	N	85	Confident	81.5	Confident	92 Å²	92	47 Å²	47	49%	0.492	26%	0.256	S	S	.	.	H	α-helix	trans	-60.8	-42.8	-179.4	-68.7	-23	0	0	0	111.7	E75 E76 L82 G83	E75-N79 PolarHBondContact O-N 3.49Å; E75-N79 VanDerWaalsContact O-N 3.13Å; E75-N79 PolarHBondContact O-ND2 3.1Å; E76-N79 PolarHBondContact O-N 3.49Å; E76-N79 VanDerWaalsContact O-N 3.07Å; N79-L82 PolarHBondContact O-N 2.92Å; N79-G83 PolarHBondContact O-N 3.16Å
80	Y	85.3	Confident	80.5	Confident	35 Å²	35	45.5 Å²	45.5	14%	0.137	25%	0.252	C	S	.	.	H	α-helix	trans	-72.3	-32.9	176.1	-68.8	-69.6	0	0	0	112.6	E46 Y49 A61 A64 F68 E76 S77 L78 L82 G83 A84	E46-Y80 HydrophobicContact CG-CE1 4.48Å; E46-Y80 WeakPolarHBondContact CG-OH 3.31Å; E46-Y80 PolarHBondContact OE1-OH 2.92Å; Y49-Y80 AromaticContact CD1-CD1 3.84Å; Y49-Y80 HydrophobicContact CD1-CD1 3.84Å; Y49-Y80 AromaticContact CD1-CE1 3.51Å; Y49-Y80 HydrophobicContact CD1-CE1 3.51Å; Y49-Y80 HydrophobicContact CE1-CD1 4Å; Y49-Y80 AromaticContact CE1-CE1 3.9Å; Y49-Y80 HydrophobicContact CE1-CE1 3.9Å; Y49-Y80 HydrophobicContact CG-CD1 4.16Å; Y49-Y80 HydrophobicContact CG-CE1 4.1Å; A61-Y80 VanDerWaalsContact CB-O 3.29Å; A61-Y80 WeakPolarHBondContact CB-O 3.4Å; A61-Y80 WeakPolarHBondContact O-CB 3.08Å; A64-Y80 HydrophobicContact CB-CD1 4.16Å; A64-Y80 HydrophobicContact CB-CD2 4.36Å; A64-Y80 HydrophobicContact CB-CG 4.02Å; F68-Y80 AromaticContact CD2-CD2 3.62Å; F68-Y80 HydrophobicContact CD2-CD2 3.62Å; F68-Y80 AromaticContact CD2-CE2 3.88Å; F68-Y80 HydrophobicContact CD2-CE2 3.88Å; F68-Y80 AromaticContact CE2-CD2 3.55Å; F68-Y80 HydrophobicContact CE2-CD2 3.55Å; F68-Y80 AromaticContact CE2-CE2 3.31Å; F68-Y80 HydrophobicContact CE2-CE2 3.31Å; F68-Y80 HydrophobicContact CZ-CE2 4.08Å; E76-Y80 HydrophobicContact CB-CE2 4.49Å; E76-Y80 WeakPolarHBondContact O-CD2 3.35Å; E76-Y80 PolarHBondContact O-N 2.99Å; S77-Y80 PolarHBondContact O-N 3.07Å; L78-Y80 VanDerWaalsContact C-N 3.33Å; L78-Y80 PolarHBondContact O-N 3.13Å; Y80-L82 VanDerWaalsContact C-N 3.34Å; Y80-L82 PolarHBondContact O-N 3.43Å; Y80-G83 CarbonylContact O-C 3.57Å; Y80-G83 WeakPolarHBondContact O-CA 3.43Å; Y80-G83 PolarHBondContact O-N 3.26Å; Y80-G83 VanDerWaalsContact O-N 3.1Å; Y80-A84 PolarHBondContact O-N 3.36Å
81	A	82.9	Confident	79.6	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.008	27%	0.271	C	S	.	.	H	α-helix	trans	-63.9	-39.6	172.4	0	0	0	0	0	111.9	S77 L78 G83 A84 F88 I100	S77-A81 WeakPolarHBondContact O-CB 3.32Å; S77-A81 PolarHBondContact O-N 2.93Å; L78-A81 PolarHBondContact O-N 3.03Å; A81-G83 VanDerWaalsContact C-N 3.27Å; A81-G83 PolarHBondContact O-N 3.45Å; A81-A84 WeakPolarHBondContact O-CB 3.28Å; A81-A84 PolarHBondContact O-N 3.2Å; A81-F88 HydrophobicContact CB-CD2 4.31Å; A81-F88 HydrophobicContact CB-CE2 4.42Å; A81-I100 HydrophobicContact CB-CG2 3.97Å
82	L	80.4	Confident	79	Confident	12 Å²	12	47.6 Å²	47.6	6%	0.063	27%	0.269	C	S	.	.	H	α-helix	trans	-67.4	-29.2	172.1	-65.6	168.9	0	0	0	112.2	L78 N79 Y80 A84 R130 L131 I134	L78-L82 HydrophobicContact CD1-CD1 4.19Å; L78-L82 HydrophobicContact CD1-CG 4.23Å; L78-L82 HydrophobicContact CG-CD1 4.12Å; L78-L82 VanDerWaalsContact O-CG 3.28Å; L78-L82 WeakPolarHBondContact O-CG 3.23Å; L78-L82 PolarHBondContact O-N 3.49Å; N79-L82 PolarHBondContact O-N 2.92Å; Y80-L82 VanDerWaalsContact C-N 3.34Å; Y80-L82 PolarHBondContact O-N 3.43Å; L82-A84 VanDerWaalsContact C-N 3.33Å; L82-R130 HydrophobicContact CD2-CB 4.03Å; L82-R130 VanDerWaalsContact O-CD 3.3Å; L82-R130 WeakPolarHBondContact O-CD 3.4Å; L82-R130 PolarHBondContact O-NH1 3.34Å; L82-L131 HydrophobicContact CD1-CB 4.25Å; L82-L131 HydrophobicContact CD1-CD1 4.28Å; L82-L131 HydrophobicContact CD2-CB 4.08Å; L82-L131 HydrophobicContact CD2-CD1 4.22Å; L82-I134 HydrophobicContact CD2-CD1 3.57Å
83	G	79.9	Confident	78.3	Confident	4 Å²	4	52.3 Å²	52.3	4%	0.041	29%	0.285	C	S	.	.	H	α-helix	trans	-67.9	-28.8	171.8	0	0	0	0	0	114	Y49 N79 Y80 A81 G85	Y49-G83 VanDerWaalsContact OH-CA 3.31Å; Y49-G83 WeakPolarHBondContact OH-CA 3.33Å; N79-G83 PolarHBondContact O-N 3.16Å; Y80-G83 CarbonylContact O-C 3.57Å; Y80-G83 WeakPolarHBondContact O-CA 3.43Å; Y80-G83 PolarHBondContact O-N 3.26Å; Y80-G83 VanDerWaalsContact O-N 3.1Å; A81-G83 VanDerWaalsContact C-N 3.27Å; A81-G83 PolarHBondContact O-N 3.45Å; G83-G85 VanDerWaalsContact C-N 3.3Å; G83-G85 PolarHBondContact O-N 2.86Å
84	A	77.4	Confident	78	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-10.4	-178.6	0	0	0	0	0	114.5	E58 A61 L62 Y80 A81 L82 D86 L87 F88	E58-A84 WeakPolarHBondContact O-CB 3.31Å; A61-A84 HydrophobicContact CB-CB 4.07Å; L62-A84 HydrophobicContact CB-CB 4.2Å; Y80-A84 PolarHBondContact O-N 3.36Å; A81-A84 WeakPolarHBondContact O-CB 3.28Å; A81-A84 PolarHBondContact O-N 3.2Å; L82-A84 VanDerWaalsContact C-N 3.33Å; A84-D86 PolarHBondContact O-N 3.1Å; A84-L87 PolarHBondContact O-N 3.02Å; A84-L87 VanDerWaalsContact O-N 3.16Å; A84-F88 HydrophobicContact CB-CB 4.31Å
85	G	76.9	Confident	77.8	Confident	33 Å²	33	57.5 Å²	57.5	34%	0.34	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	56.4	-118.6	171	0	0	0	0	0	113.6	G83 L87 F88	G83-G85 VanDerWaalsContact C-N 3.3Å; G83-G85 PolarHBondContact O-N 2.86Å; G85-L87 VanDerWaalsContact C-N 3.33Å; G85-L87 PolarHBondContact O-N 3.41Å; G85-F88 PolarHBondContact O-N 3.42Å
86	D	72.9	Confident	77.8	Confident	140 Å²	140	52 Å²	52	75%	0.749	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-75.9	-17.8	-174.9	-70.5	-30.6	0	0	0	113.8	A84 F88	A84-D86 PolarHBondContact O-N 3.1Å; D86-F88 PolarHBondContact O-N 3.23Å
87	L	74.2	Confident	77.8	Confident	72 Å²	72	47.8 Å²	47.8	38%	0.377	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-73.1	-19.6	175.4	-65.7	175.8	0	0	0	112.6	E58 F59 A84 G85 S89	E58-L87 HydrophobicContact CB-CD1 3.58Å; E58-L87 HydrophobicContact CB-CG 4.31Å; F59-L87 HydrophobicContact CB-CD1 4.19Å; F59-L87 HydrophobicContact CD2-CD1 3.59Å; F59-L87 HydrophobicContact CD2-CD2 4.49Å; F59-L87 HydrophobicContact CE2-CD1 4.35Å; F59-L87 HydrophobicContact CG-CD1 4.26Å; A84-L87 PolarHBondContact O-N 3.02Å; A84-L87 VanDerWaalsContact O-N 3.16Å; G85-L87 VanDerWaalsContact C-N 3.33Å; G85-L87 PolarHBondContact O-N 3.41Å; L87-S89 PolarHBondContact O-N 3.45Å
88	F	74.9	Confident	77.7	Confident	7 Å²	7	54.7 Å²	54.7	3%	0.031	30%	0.298	C	S	.	.	S	Bend	trans	-92.7	95.5	171.9	-175.5	-100.8	0	0	0	109.7	A81 A84 G85 D86 Y96 V97 I100 I101 I134	A81-F88 HydrophobicContact CB-CD2 4.31Å; A81-F88 HydrophobicContact CB-CE2 4.42Å; A84-F88 HydrophobicContact CB-CB 4.31Å; G85-F88 PolarHBondContact O-N 3.42Å; D86-F88 PolarHBondContact O-N 3.23Å; F88-Y96 HydrophobicContact CD2-CE1 4.22Å; F88-Y96 AromaticContact CE2-CE1 3.93Å; F88-Y96 HydrophobicContact CE2-CE1 3.93Å; F88-V97 HydrophobicContact CE2-CG2 3.99Å; F88-V97 HydrophobicContact CZ-CG1 4.41Å; F88-I100 HydrophobicContact CE1-CG2 4.31Å; F88-I100 HydrophobicContact CE2-CB 4.21Å; F88-I100 HydrophobicContact CE2-CG2 3.92Å; F88-I100 HydrophobicContact CZ-CB 3.96Å; F88-I100 HydrophobicContact CZ-CG2 3.51Å; F88-I101 HydrophobicContact CZ-CG1 4.47Å; F88-I134 HydrophobicContact CD1-CD1 3.96Å; F88-I134 HydrophobicContact CE1-CD1 4.02Å
89	S	67.9	Low	77.7	Confident	28 Å²	28	56.5 Å²	56.5	20%	0.196	31%	0.309	C	S	.	.			trans	-95.4	137.9	-178.5	104.5	0	0	0	0	111.7	L87 T91 D92	L87-S89 PolarHBondContact O-N 3.45Å; S89-T91 PolarHBondContact O-N 3.47Å; S89-T91 PolarHBondContact OG-OG1 3.18Å; S89-D92 PolarHBondContact OG-OD1 3.01Å; S89-D92 PolarHBondContact OG-OD2 3.06Å
90	V	67.1	Low	77.7	Confident	13 Å²	13	52.1 Å²	52.1	8%	0.079	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-6.4	178.6	-173.8	0	0	0	0	111.3	I101 I134 K137 R141	V90-I101 HydrophobicContact CG1-CD1 3.81Å; V90-I134 HydrophobicContact CG2-CG2 4.1Å; V90-K137 HydrophobicContact CG2-CB 4.25Å; V90-K137 HydrophobicContact CG2-CD 4.37Å; V90-R141 PolarHBondContact O-NH1 2.99Å
91	T	65.8	Low	77.6	Confident	109 Å²	109	51.4 Å²	51.4	67%	0.669	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-12.8	-177.1	44.6	0	0	0	0	113.6	S89	S89-T91 PolarHBondContact O-N 3.47Å; S89-T91 PolarHBondContact OG-OG1 3.18Å
92	D	73.1	Confident	77.6	Confident	86 Å²	86	53.6 Å²	53.6	46%	0.46	30%	0.302	S	S	.	.			trans	-86	118.7	-177.7	-61.1	-34.7	0	0	0	110.9	S89 S94 V97	S89-D92 PolarHBondContact OG-OD1 3.01Å; S89-D92 PolarHBondContact OG-OD2 3.06Å; D92-S94 PolarHBondContact O-N 2.63Å; D92-V97 HydrophobicContact CB-CG2 4.39Å; D92-V97 WeakPolarHBondContact O-CB 3.46Å; D92-V97 WeakPolarHBondContact O-CG1 3.3Å
93	D	70.8	Confident	77.9	Confident	139 Å²	139	56.8 Å²	56.8	74%	0.743	32%	0.316	S	S	*	.			trans	-78.8	44.6	179.7	-66.4	-29.9	0	0	0	112.6	R141	D93-R141 IonicContact OD1-CZ 2.65Å; D93-R141 IonicContact OD1-NH1 2.69Å; D93-R141 IonicContact OD1-NH2 3.85Å; D93-R141 PolarHBondContact OD1-NH2 3.1Å
94	S	81.8	Confident	78.1	Confident	47 Å²	47	56.6 Å²	56.6	33%	0.329	31%	0.314	S	S	.	.			trans	-87.2	145	174.2	73.5	0	0	0	0	111.5	D92 Y96 V97 E98	D92-S94 PolarHBondContact O-N 2.63Å; S94-Y96 PolarHBondContact O-N 2.92Å; S94-Y96 VanDerWaalsContact O-N 3.17Å; S94-V97 PolarHBondContact O-N 3.03Å; S94-V97 WeakPolarHBondContact OG-CB 3.46Å; S94-V97 WeakPolarHBondContact OG-CG2 3.37Å; S94-V97 PolarHBondContact OG-N 3.01Å; S94-V97 VanDerWaalsContact OG-N 3.16Å; S94-E98 PolarHBondContact O-N 3Å
95	E	81	Confident	78.4	Confident	155 Å²	155	57.6 Å²	57.6	72%	0.724	32%	0.319	S	S	*	.	H	α-helix	trans	-54.5	-36.3	176.3	-65.2	-179.4	175	0	0	111.8	T99	E95-T99 WeakPolarHBondContact O-CB 3.46Å; E95-T99 PolarHBondContact O-N 2.92Å; E95-T99 PolarHBondContact O-OG1 3.39Å
96	Y	83.5	Confident	78.9	Confident	20 Å²	20	59.6 Å²	59.6	8%	0.078	32%	0.322	C	S	.	.	H	α-helix	trans	-60.1	-52.6	173.7	167.3	-103.9	0	0	0	111.9	L62 S65 K66 Y69 F88 S94 E98 T99 I100	L62-Y96 HydrophobicContact CD1-CE1 4.43Å; S65-Y96 WeakPolarHBondContact CB-OH 3.1Å; S65-Y96 PolarHBondContact OG-OH 3Å; K66-Y96 HydrophobicContact CB-CE2 4.35Å; K66-Y96 HydrophobicContact CG-CD1 4.26Å; K66-Y96 HydrophobicContact CG-CD2 4.05Å; K66-Y96 HydrophobicContact CG-CE1 3.98Å; K66-Y96 HydrophobicContact CG-CE2 3.75Å; K66-Y96 HydrophobicContact CG-CG 4.29Å; Y69-Y96 AromaticContact CD1-CD2 3.94Å; Y69-Y96 HydrophobicContact CD1-CD2 3.94Å; Y69-Y96 AromaticContact CD2-CD2 3.96Å; Y69-Y96 HydrophobicContact CD2-CD2 3.96Å; Y69-Y96 AromaticContact CG-CD2 3.62Å; Y69-Y96 HydrophobicContact CG-CD2 3.62Å; Y69-Y96 HydrophobicContact CG-CE2 4.17Å; F88-Y96 HydrophobicContact CD2-CE1 4.22Å; F88-Y96 AromaticContact CE2-CE1 3.93Å; F88-Y96 HydrophobicContact CE2-CE1 3.93Å; S94-Y96 PolarHBondContact O-N 2.92Å; S94-Y96 VanDerWaalsContact O-N 3.17Å; Y96-E98 PolarHBondContact O-N 3.46Å; Y96-T99 PolarHBondContact O-N 2.86Å; Y96-I100 HydrophobicContact CD2-CG1 3.92Å; Y96-I100 HydrophobicContact CE2-CD1 4.06Å; Y96-I100 HydrophobicContact CE2-CG1 3.61Å; Y96-I100 HydrophobicContact CG-CG1 4.5Å; Y96-I100 WeakPolarHBondContact O-CB 3.35Å; Y96-I100 VanDerWaalsContact O-CG1 3.23Å; Y96-I100 WeakPolarHBondContact O-CG1 3.42Å; Y96-I100 PolarHBondContact O-N 2.98Å
97	V	82.9	Confident	79.4	Confident	7 Å²	7	55.6 Å²	55.6	4%	0.042	30%	0.299	C	S	.	.	H	α-helix	trans	-63.1	-42.9	-179.3	169.4	0	0	0	0	111.2	F88 D92 S94 T99 I100 I101	F88-V97 HydrophobicContact CE2-CG2 3.99Å; F88-V97 HydrophobicContact CZ-CG1 4.41Å; D92-V97 HydrophobicContact CB-CG2 4.39Å; D92-V97 WeakPolarHBondContact O-CB 3.46Å; D92-V97 WeakPolarHBondContact O-CG1 3.3Å; S94-V97 PolarHBondContact O-N 3.03Å; S94-V97 WeakPolarHBondContact OG-CB 3.46Å; S94-V97 WeakPolarHBondContact OG-CG2 3.37Å; S94-V97 PolarHBondContact OG-N 3.01Å; S94-V97 VanDerWaalsContact OG-N 3.16Å; V97-T99 PolarHBondContact O-N 3.45Å; V97-I100 PolarHBondContact O-N 2.74Å; V97-I101 HydrophobicContact CG1-CD1 3.44Å; V97-I101 VanDerWaalsContact CG1-CD1 3.44Å; V97-I101 HydrophobicContact CG1-CG1 4.19Å; V97-I101 WeakPolarHBondContact O-CB 3.18Å; V97-I101 WeakPolarHBondContact O-CD1 3.46Å; V97-I101 WeakPolarHBondContact O-CG1 3.39Å; V97-I101 PolarHBondContact O-N 3.39Å
98	E	83.5	Confident	80	Confident	145 Å²	145	52.2 Å²	52.2	68%	0.678	28%	0.281	S	S	*	.	H	α-helix	trans	-60.3	-45.6	177.2	-173.1	176.2	-173.3	0	0	111.7	S94 Y96 I101 A102	S94-E98 PolarHBondContact O-N 3Å; Y96-E98 PolarHBondContact O-N 3.46Å; E98-I101 PolarHBondContact O-N 3.31Å; E98-A102 WeakPolarHBondContact O-CB 3.48Å; E98-A102 PolarHBondContact O-N 3.46Å
99	T	85.1	Confident	80.5	Confident	42 Å²	42	52.8 Å²	52.8	26%	0.258	29%	0.285	S	S	.	.	H	α-helix	trans	-67.7	-41.2	-179.8	-41.1	0	0	0	0	111.7	Y69 F74 E95 Y96 V97 A102 K103	Y69-T99 HydrophobicContact CE2-CG2 3.8Å; Y69-T99 PolarHBondContact OH-OG1 3.39Å; F74-T99 HydrophobicContact CE1-CG2 4.32Å; E95-T99 WeakPolarHBondContact O-CB 3.46Å; E95-T99 PolarHBondContact O-N 2.92Å; E95-T99 PolarHBondContact O-OG1 3.39Å; Y96-T99 PolarHBondContact O-N 2.86Å; V97-T99 PolarHBondContact O-N 3.45Å; T99-A102 PolarHBondContact O-N 2.65Å; T99-K103 WeakPolarHBondContact O-CG 3.23Å; T99-K103 PolarHBondContact O-N 3.4Å
100	I	83.8	Confident	81.3	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-66.3	-42.5	177.6	-65	-63.5	0	0	0	110.5	Y69 S77 A81 F88 Y96 V97 A102 K103 C104	Y69-I100 HydrophobicContact CD2-CD1 4.41Å; S77-I100 WeakPolarHBondContact OG-CD1 3.08Å; A81-I100 HydrophobicContact CB-CG2 3.97Å; F88-I100 HydrophobicContact CE1-CG2 4.31Å; F88-I100 HydrophobicContact CE2-CB 4.21Å; F88-I100 HydrophobicContact CE2-CG2 3.92Å; F88-I100 HydrophobicContact CZ-CB 3.96Å; F88-I100 HydrophobicContact CZ-CG2 3.51Å; Y96-I100 HydrophobicContact CD2-CG1 3.92Å; Y96-I100 HydrophobicContact CE2-CD1 4.06Å; Y96-I100 HydrophobicContact CE2-CG1 3.61Å; Y96-I100 HydrophobicContact CG-CG1 4.5Å; Y96-I100 WeakPolarHBondContact O-CB 3.35Å; Y96-I100 VanDerWaalsContact O-CG1 3.23Å; Y96-I100 WeakPolarHBondContact O-CG1 3.42Å; Y96-I100 PolarHBondContact O-N 2.98Å; V97-I100 PolarHBondContact O-N 2.74Å; I100-A102 VanDerWaalsContact C-N 3.35Å; I100-A102 PolarHBondContact O-N 3.21Å; I100-K103 CarbonylContact O-C 3.56Å; I100-K103 PolarHBondContact O-N 3.45Å; I100-C104 WeakPolarHBondContact O-CB 3.47Å; I100-C104 PolarHBondContact O-N 3.09Å; I100-C104 PolarHBondContact O-SG 2.92Å
101	I	83.2	Confident	82.1	Confident	19 Å²	19	58.7 Å²	58.7	10%	0.097	31%	0.307	C	S	.	.	H	α-helix	trans	-60.5	-44.4	175	-68.9	163.4	0	0	0	110.9	F88 V90 V97 E98 K103 C104 I105	F88-I101 HydrophobicContact CZ-CG1 4.47Å; V90-I101 HydrophobicContact CG1-CD1 3.81Å; V97-I101 HydrophobicContact CG1-CD1 3.44Å; V97-I101 VanDerWaalsContact CG1-CD1 3.44Å; V97-I101 HydrophobicContact CG1-CG1 4.19Å; V97-I101 WeakPolarHBondContact O-CB 3.18Å; V97-I101 WeakPolarHBondContact O-CD1 3.46Å; V97-I101 WeakPolarHBondContact O-CG1 3.39Å; V97-I101 PolarHBondContact O-N 3.39Å; E98-I101 PolarHBondContact O-N 3.31Å; I101-K103 VanDerWaalsContact C-N 3.31Å; I101-K103 PolarHBondContact O-N 3.23Å; I101-C104 WeakPolarHBondContact O-CB 3.39Å; I101-C104 PolarHBondContact O-N 3.41Å; I101-I105 HydrophobicContact CG2-CD1 3.81Å; I101-I105 HydrophobicContact CG2-CG1 4.42Å; I101-I105 WeakPolarHBondContact O-CG1 3.35Å; I101-I105 PolarHBondContact O-N 2.97Å
102	A	84.7	Confident	82.8	Confident	48 Å²	48	57 Å²	57	40%	0.397	29%	0.288	S	S	.	.	H	α-helix	trans	-58.3	-45.3	176.2	0	0	0	0	0	111.2	E98 T99 I100 I105 D106	E98-A102 WeakPolarHBondContact O-CB 3.48Å; E98-A102 PolarHBondContact O-N 3.46Å; T99-A102 PolarHBondContact O-N 2.65Å; I100-A102 VanDerWaalsContact C-N 3.35Å; I100-A102 PolarHBondContact O-N 3.21Å; A102-I105 PolarHBondContact O-N 3.44Å; A102-D106 WeakPolarHBondContact O-CB 3.33Å; A102-D106 VanDerWaalsContact O-CG 3.31Å; A102-D106 PolarHBondContact O-N 2.89Å
103	K	85.2	Confident	83.1	Confident	78 Å²	78	54.9 Å²	54.9	34%	0.339	28%	0.279	S	S	.	.	H	α-helix	trans	-67.7	-36	176	-67.5	-65.5	-179.2	-167.4	0	113.5	F74 T99 I100 I101 I105 D106 H107	F74-K103 HydrophobicContact CB-CD 4.17Å; F74-K103 HydrophobicContact CB-CG 4.03Å; F74-K103 HydrophobicContact CD1-CG 4.44Å; F74-K103 HydrophobicContact CG-CD 4.39Å; F74-K103 HydrophobicContact CG-CG 4.25Å; T99-K103 WeakPolarHBondContact O-CG 3.23Å; T99-K103 PolarHBondContact O-N 3.4Å; I100-K103 CarbonylContact O-C 3.56Å; I100-K103 PolarHBondContact O-N 3.45Å; I101-K103 VanDerWaalsContact C-N 3.31Å; I101-K103 PolarHBondContact O-N 3.23Å; K103-I105 VanDerWaalsContact C-N 3.34Å; K103-D106 PolarHBondContact O-N 2.92Å; K103-H107 VanDerWaalsContact O-CB 3.29Å; K103-H107 WeakPolarHBondContact O-CB 3.23Å; K103-H107 PolarHBondContact O-N 2.98Å
104	C	84.4	Confident	83.6	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-56.8	-50.4	172.2	-69.6	0	0	0	0	110.1	L78 I100 I101 H107 Y108 L131	L78-C104 HydrophobicContact CD1-CB 4.02Å; L78-C104 WeakPolarHBondContact CD1-SG 3.38Å; I100-C104 WeakPolarHBondContact O-CB 3.47Å; I100-C104 PolarHBondContact O-N 3.09Å; I100-C104 PolarHBondContact O-SG 2.92Å; I101-C104 WeakPolarHBondContact O-CB 3.39Å; I101-C104 PolarHBondContact O-N 3.41Å; C104-H107 PolarHBondContact O-N 3.2Å; C104-Y108 WeakPolarHBondContact O-CB 3.48Å; C104-Y108 PolarHBondContact O-N 3.11Å; C104-L131 HydrophobicContact CB-CD1 3.97Å
105	I	84	Confident	83.5	Confident	21 Å²	21	51 Å²	51	11%	0.108	25%	0.251	C	S	.	.	H	α-helix	trans	-66.4	-45.5	-178.2	-64.9	168.4	0	0	0	109.7	I101 A102 K103 H107 Y108 T109 V135 M138 I154	I101-I105 HydrophobicContact CG2-CD1 3.81Å; I101-I105 HydrophobicContact CG2-CG1 4.42Å; I101-I105 WeakPolarHBondContact O-CG1 3.35Å; I101-I105 PolarHBondContact O-N 2.97Å; A102-I105 PolarHBondContact O-N 3.44Å; K103-I105 VanDerWaalsContact C-N 3.34Å; I105-H107 VanDerWaalsContact C-N 3.35Å; I105-H107 PolarHBondContact O-N 3.43Å; I105-Y108 PolarHBondContact O-N 2.87Å; I105-T109 HydrophobicContact CG2-CG2 4.09Å; I105-T109 WeakPolarHBondContact O-CB 3.37Å; I105-T109 WeakPolarHBondContact O-CG2 3.29Å; I105-T109 PolarHBondContact O-N 3.44Å; I105-T109 PolarHBondContact O-OG1 3.4Å; I105-V135 HydrophobicContact CG1-CG2 4.45Å; I105-M138 HydrophobicContact CD1-CG 4.5Å; I105-I154 HydrophobicContact CG2-CG2 4.43Å
106	D	86.3	Confident	82.8	Confident	75 Å²	75	45.8 Å²	45.8	40%	0.401	24%	0.235	S	C	.	.	H	α-helix	trans	-58.6	-43.2	176	-75.4	-13.8	0	0	0	112.6	A102 K103 T109 K110	A102-D106 WeakPolarHBondContact O-CB 3.33Å; A102-D106 VanDerWaalsContact O-CG 3.31Å; A102-D106 PolarHBondContact O-N 2.89Å; K103-D106 PolarHBondContact O-N 2.92Å; D106-T109 WeakPolarHBondContact CA-OG1 3.49Å; D106-T109 PolarHBondContact O-OG1 3.35Å; D106-K110 WeakPolarHBondContact O-CB 3.34Å; D106-K110 VanDerWaalsContact O-CG 3.23Å; D106-K110 WeakPolarHBondContact O-CG 3.45Å; D106-K110 PolarHBondContact O-N 2.96Å; D106-K110 VanDerWaalsContact O-N 3.11Å
107	H	85.2	Confident	82.1	Confident	57 Å²	57	50.5 Å²	50.5	26%	0.264	26%	0.258	S	S	.	.	H	α-helix	trans	-71.7	-42.7	179.7	-173.6	-110.1	0	0	0	111.4	L78 K103 C104 I105 K110 L111	L78-H107 HydrophobicContact CD2-CB 3.76Å; K103-H107 VanDerWaalsContact O-CB 3.29Å; K103-H107 WeakPolarHBondContact O-CB 3.23Å; K103-H107 PolarHBondContact O-N 2.98Å; C104-H107 PolarHBondContact O-N 3.2Å; I105-H107 VanDerWaalsContact C-N 3.35Å; I105-H107 PolarHBondContact O-N 3.43Å; H107-K110 PolarHBondContact O-N 2.89Å; H107-L111 WeakPolarHBondContact O-CG 3.45Å; H107-L111 PolarHBondContact O-N 3.19Å
108	Y	86.4	Confident	81.4	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.1	-44.6	176.5	-177.8	-95.2	0	0	0	112	C104 I105 L111 R112 I127 L131 E132 V135 T158	C104-Y108 WeakPolarHBondContact O-CB 3.48Å; C104-Y108 PolarHBondContact O-N 3.11Å; I105-Y108 PolarHBondContact O-N 2.87Å; Y108-L111 PolarHBondContact O-N 3.45Å; Y108-R112 HydrophobicContact CD1-CG 4.05Å; Y108-R112 HydrophobicContact CE1-CG 3.7Å; Y108-R112 HydrophobicContact CE2-CG 4.48Å; Y108-R112 WeakPolarHBondContact O-CB 3.49Å; Y108-R112 WeakPolarHBondContact O-CG 3.46Å; Y108-R112 PolarHBondContact O-N 2.95Å; Y108-R112 PolarHBondContact OH-NE 3.36Å; Y108-R112 PolarHBondContact OH-NH2 3.36Å; Y108-R112 VanDerWaalsContact OH-NH2 3.09Å; Y108-I127 HydrophobicContact CD2-CG2 3.96Å; Y108-I127 HydrophobicContact CE2-CG2 3.67Å; Y108-L131 HydrophobicContact CD2-CD2 3.81Å; Y108-L131 HydrophobicContact CD2-CG 3.83Å; Y108-L131 HydrophobicContact CG-CD2 4.39Å; Y108-L131 HydrophobicContact CG-CG 4.44Å; Y108-E132 HydrophobicContact CE2-CB 4.1Å; Y108-E132 PolarHBondContact OH-OE1 2.9Å; Y108-V135 HydrophobicContact CD1-CG1 4.49Å; Y108-V135 HydrophobicContact CD1-CG2 4.26Å; Y108-V135 HydrophobicContact CD2-CG2 4.47Å; Y108-V135 HydrophobicContact CE1-CG1 4.36Å; Y108-V135 HydrophobicContact CG-CG2 4.11Å; Y108-T158 HydrophobicContact CD1-CG2 3.79Å; Y108-T158 HydrophobicContact CE1-CG2 3.87Å
109	T	85.2	Confident	80	Confident	19 Å²	19	49.4 Å²	49.4	12%	0.117	26%	0.262	C	S	.	.	H	α-helix	trans	-63.1	-45.1	177.4	52.1	0	0	0	0	111.1	I105 D106 L111 R112 V113 E157 T158	I105-T109 HydrophobicContact CG2-CG2 4.09Å; I105-T109 WeakPolarHBondContact O-CB 3.37Å; I105-T109 WeakPolarHBondContact O-CG2 3.29Å; I105-T109 PolarHBondContact O-N 3.44Å; I105-T109 PolarHBondContact O-OG1 3.4Å; D106-T109 WeakPolarHBondContact CA-OG1 3.49Å; D106-T109 PolarHBondContact O-OG1 3.35Å; T109-L111 PolarHBondContact O-N 3.45Å; T109-R112 PolarHBondContact O-N 2.88Å; T109-V113 WeakPolarHBondContact O-CB 3.48Å; T109-V113 WeakPolarHBondContact O-CG2 3.19Å; T109-V113 PolarHBondContact O-N 3.47Å; T109-E157 HydrophobicContact CG2-CB 3.99Å; T109-T158 HydrophobicContact CG2-CG2 3.81Å
110	K	84.4	Confident	78.4	Confident	131 Å²	131	56.2 Å²	56.2	57%	0.57	29%	0.291	S	S	*	.	H	α-helix	trans	-56.3	-50.4	174.2	-75.8	172.2	-175.4	177.8	0	112.6	D106 H107 R112 V113 E114	D106-K110 WeakPolarHBondContact O-CB 3.34Å; D106-K110 VanDerWaalsContact O-CG 3.23Å; D106-K110 WeakPolarHBondContact O-CG 3.45Å; D106-K110 PolarHBondContact O-N 2.96Å; D106-K110 VanDerWaalsContact O-N 3.11Å; H107-K110 PolarHBondContact O-N 2.89Å; K110-R112 VanDerWaalsContact C-N 3.31Å; K110-R112 PolarHBondContact O-N 3.46Å; K110-V113 PolarHBondContact O-N 3.43Å; K110-E114 WeakPolarHBondContact O-CG 3.35Å; K110-E114 PolarHBondContact O-N 3.48Å
111	L	83.5	Confident	76.7	Confident	34 Å²	34	63.8 Å²	63.8	18%	0.178	33%	0.331	C	S	.	.	H	α-helix	trans	-61.3	-39.8	178.3	-72.8	174.6	0	0	0	112.3	H107 Y108 T109 N115 K125	H107-L111 WeakPolarHBondContact O-CG 3.45Å; H107-L111 PolarHBondContact O-N 3.19Å; Y108-L111 PolarHBondContact O-N 3.45Å; T109-L111 PolarHBondContact O-N 3.45Å; L111-N115 VanDerWaalsContact O-CB 3.29Å; L111-N115 WeakPolarHBondContact O-CB 3.49Å; L111-N115 VanDerWaalsContact O-CG 3.29Å; L111-N115 PolarHBondContact O-N 3.48Å; L111-N115 PolarHBondContact O-ND2 3.01Å; L111-K125 HydrophobicContact CD2-CD 4.15Å
112	R	80.1	Confident	75.5	Confident	73 Å²	73	68.1 Å²	68.1	28%	0.275	35%	0.351	S	S	.	.	H	α-helix	trans	-68.5	-39.8	176.9	-78.3	-73.4	-169.9	-175.4	0	112.2	Y108 T109 K110 N115 A116 I127 E132	Y108-R112 HydrophobicContact CD1-CG 4.05Å; Y108-R112 HydrophobicContact CE1-CG 3.7Å; Y108-R112 HydrophobicContact CE2-CG 4.48Å; Y108-R112 WeakPolarHBondContact O-CB 3.49Å; Y108-R112 WeakPolarHBondContact O-CG 3.46Å; Y108-R112 PolarHBondContact O-N 2.95Å; Y108-R112 PolarHBondContact OH-NE 3.36Å; Y108-R112 PolarHBondContact OH-NH2 3.36Å; Y108-R112 VanDerWaalsContact OH-NH2 3.09Å; T109-R112 PolarHBondContact O-N 2.88Å; K110-R112 VanDerWaalsContact C-N 3.31Å; K110-R112 PolarHBondContact O-N 3.46Å; R112-N115 PolarHBondContact O-N 3.15Å; R112-A116 VanDerWaalsContact O-CB 3.25Å; R112-A116 WeakPolarHBondContact O-CB 3.46Å; R112-A116 PolarHBondContact O-N 2.88Å; R112-I127 VanDerWaalsContact CD-CD1 3.46Å; R112-I127 HydrophobicContact CG-CD1 3.89Å; R112-I127 VanDerWaalsContact NE-CD1 3.27Å; R112-E132 IonicContact NH2-OE1 3.66Å; R112-E132 PolarHBondContact NH2-OE1 3.19Å; R112-E132 IonicContact NH2-OE2 3.79Å
113	V	80.9	Confident	74.2	Confident	42 Å²	42	74.9 Å²	74.9	26%	0.255	37%	0.374	S	S	.	.	H	α-helix	trans	-62.8	-49	176.6	165.3	0	0	0	0	110.2	T109 K110 A116 E117	T109-V113 WeakPolarHBondContact O-CB 3.48Å; T109-V113 WeakPolarHBondContact O-CG2 3.19Å; T109-V113 PolarHBondContact O-N 3.47Å; K110-V113 PolarHBondContact O-N 3.43Å; V113-A116 PolarHBondContact O-N 2.84Å; V113-A116 VanDerWaalsContact O-N 3.17Å; V113-E117 WeakPolarHBondContact CG1-OE1 3.26Å; V113-E117 WeakPolarHBondContact O-CG 3.33Å; V113-E117 PolarHBondContact O-N 2.65Å
114	E	80.3	Confident	73.4	Confident	85 Å²	85	78.9 Å²	78.9	40%	0.397	39%	0.392	S	S	.	.	H	α-helix	trans	-57.8	-51.4	174.8	-72.5	-179.2	171.5	0	0	110.9	K110 A116 E117 L118 K125	K110-E114 WeakPolarHBondContact O-CG 3.35Å; K110-E114 PolarHBondContact O-N 3.48Å; E114-A116 PolarHBondContact O-N 3.05Å; E114-A116 VanDerWaalsContact O-N 3.11Å; E114-E117 PolarHBondContact O-N 3.41Å; E114-L118 WeakPolarHBondContact O-CG 3.47Å; E114-L118 PolarHBondContact O-N 3.28Å; E114-L118 VanDerWaalsContact O-N 3.09Å; E114-K125 IonicContact OE2-NZ 2.92Å; E114-K125 PolarHBondContact OE2-NZ 2.96Å
115	N	79.4	Confident	72.8	Confident	19 Å²	19	84 Å²	84	10%	0.102	41%	0.414	C	S	.	.	H	α-helix	trans	-60.7	-23.7	178.9	-80.8	-17.8	0	0	0	114.5	L111 R112 K125	L111-N115 VanDerWaalsContact O-CB 3.29Å; L111-N115 WeakPolarHBondContact O-CB 3.49Å; L111-N115 VanDerWaalsContact O-CG 3.29Å; L111-N115 PolarHBondContact O-N 3.48Å; L111-N115 PolarHBondContact O-ND2 3.01Å; R112-N115 PolarHBondContact O-N 3.15Å; N115-K125 PolarHBondContact ND2-O 3.16Å; N115-K125 WeakPolarHBondContact OD1-CB 3.38Å; N115-K125 PolarHBondContact OD1-N 3.14Å
116	A	67.6	Low	72.1	Confident	46 Å²	46	93 Å²	93	38%	0.38	45%	0.453	S	S	.	.	H	α-helix	trans	-90.2	-15.6	177.4	0	0	0	0	0	113.1	R112 V113 E114 R159	R112-A116 VanDerWaalsContact O-CB 3.25Å; R112-A116 WeakPolarHBondContact O-CB 3.46Å; R112-A116 PolarHBondContact O-N 2.88Å; V113-A116 PolarHBondContact O-N 2.84Å; V113-A116 VanDerWaalsContact O-N 3.17Å; E114-A116 PolarHBondContact O-N 3.05Å; E114-A116 VanDerWaalsContact O-N 3.11Å; A116-R159 VanDerWaalsContact CB-NH1 3.3Å
117	E	67.2	Low	71.6	Confident	119 Å²	119	90.9 Å²	90.9	56%	0.556	44%	0.441	S	S	*	.	H	α-helix	trans	-94.6	-20.4	176.8	-75.1	171.4	-167	0	0	112.8	V113 E114 R159	V113-E117 WeakPolarHBondContact CG1-OE1 3.26Å; V113-E117 WeakPolarHBondContact O-CG 3.33Å; V113-E117 PolarHBondContact O-N 2.65Å; E114-E117 PolarHBondContact O-N 3.41Å; E117-R159 IonicContact OE1-CZ 3.44Å; E117-R159 IonicContact OE1-NH1 2.82Å; E117-R159 IonicContact OE1-NH2 3.82Å; E117-R159 PolarHBondContact OE1-NH2 3.21Å
118	L	68.9	Low	71.2	Confident	58 Å²	58	91.4 Å²	91.4	30%	0.304	45%	0.445	S	S	.	.	S	Bend	trans	-64.9	140	171.7	-62.4	168.1	0	0	0	111.2	E114 E122	E114-L118 WeakPolarHBondContact O-CG 3.47Å; E114-L118 PolarHBondContact O-N 3.28Å; E114-L118 VanDerWaalsContact O-N 3.09Å; L118-E122 HydrophobicContact CB-CB 4.28Å; L118-E122 HydrophobicContact CD2-CB 4.42Å; L118-E122 WeakPolarHBondContact CD2-OE2 3.16Å
119	S	53.9	Low	70.8	Confident	72 Å²	72	96.3 Å²	96.3	50%	0.503	48%	0.477	S	S	.	.			trans	-64.6	155	170.9	31.8	0	0	0	0	111.5	D121 E122	S119-D121 PolarHBondContact O-N 3.31Å; S119-E122 PolarHBondContact O-N 3.24Å
120	E	51.9	Low	70.5	Confident	185 Å²	185	101.3 Å²	101.3	86%	0.864	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-16.1	-176.5	-67.8	-177	173.7	0	0	114.4
121	D	48.6	Very low	70.3	Confident	159 Å²	159	95.3 Å²	95.3	85%	0.85	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-10.3	179.8	-65	-42	0	0	0	115.1	S119	S119-D121 PolarHBondContact O-N 3.31Å
122	E	57.2	Low	70.2	Confident	109 Å²	109	96.3 Å²	96.3	51%	0.509	47%	0.472	S	S	.	.	S	Bend	trans	-98.5	135.7	178.4	-76.1	-179	142.6	0	0	112.2	L118 S119 K124	L118-E122 HydrophobicContact CB-CB 4.28Å; L118-E122 HydrophobicContact CD2-CB 4.42Å; L118-E122 WeakPolarHBondContact CD2-OE2 3.16Å; S119-E122 PolarHBondContact O-N 3.24Å; E122-K124 PolarHBondContact O-N 3.22Å; E122-K124 VanDerWaalsContact O-N 3.13Å
123	E	57.9	Low	70.2	Confident	190 Å²	190	94.1 Å²	94.1	89%	0.888	47%	0.472	S	S	*	.			trans	-62.7	115.5	-179.7	-73.8	-172	165.4	0	0	111	K125	E123-K125 PolarHBondContact O-N 3.1Å
124	K	67.1	Low	70.2	Confident	162 Å²	162	93 Å²	93	70%	0.704	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-54.6	128.7	174.3	-67.2	177.3	-179.1	174.6	0	110.1	E122 K126	E122-K124 PolarHBondContact O-N 3.22Å; E122-K124 VanDerWaalsContact O-N 3.13Å; K124-K126 PolarHBondContact O-N 3.45Å
125	K	71.8	Confident	70.3	Confident	107 Å²	107	89 Å²	89	47%	0.465	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-57.5	126.9	172.9	-66.7	-178.8	-179.1	176.2	0	108.8	L111 E114 N115 E123 I127	L111-K125 HydrophobicContact CD2-CD 4.15Å; E114-K125 IonicContact OE2-NZ 2.92Å; E114-K125 PolarHBondContact OE2-NZ 2.96Å; N115-K125 PolarHBondContact ND2-O 3.16Å; N115-K125 WeakPolarHBondContact OD1-CB 3.38Å; N115-K125 PolarHBondContact OD1-N 3.14Å; E123-K125 PolarHBondContact O-N 3.1Å; K125-I127 PolarHBondContact O-N 3.26Å
126	K	70.1	Confident	70.6	Confident	212 Å²	212	90.8 Å²	90.8	92%	0.922	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-64.3	117.6	178	-70.1	-179.1	-178.8	174.8	0	109.1	K124	K124-K126 PolarHBondContact O-N 3.45Å
127	I	76.3	Confident	71.3	Confident	30 Å²	30	93.6 Å²	93.6	15%	0.154	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-85.6	131.9	174	-61.2	174.9	0	0	0	107.8	Y108 R112 K125 P129	Y108-I127 HydrophobicContact CD2-CG2 3.96Å; Y108-I127 HydrophobicContact CE2-CG2 3.67Å; R112-I127 VanDerWaalsContact CD-CD1 3.46Å; R112-I127 HydrophobicContact CG-CD1 3.89Å; R112-I127 VanDerWaalsContact NE-CD1 3.27Å; K125-I127 PolarHBondContact O-N 3.26Å; I127-P129 WeakPolarHBondContact O-CD 3.09Å
128	D	75.9	Confident	71.9	Confident	67 Å²	67	90 Å²	90	36%	0.358	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-63.9	125.5	176.5	-168.7	-33.8	0	0	0	110.4	R130 L131 E132	D128-R130 PolarHBondContact O-N 3.45Å; D128-R130 VanDerWaalsContact O-N 3.16Å; D128-R130 WeakPolarHBondContact OD1-CB 3.37Å; D128-R130 WeakPolarHBondContact OD1-CG 3.46Å; D128-R130 PolarHBondContact OD1-N 3.19Å; D128-L131 HydrophobicContact CB-CB 4.33Å; D128-L131 WeakPolarHBondContact O-CB 3.21Å; D128-L131 PolarHBondContact O-N 3Å; D128-L131 VanDerWaalsContact O-N 3.15Å; D128-E132 PolarHBondContact O-N 3.48Å
129	P	78.5	Confident	72.6	Confident	103 Å²	103	87.5 Å²	87.5	67%	0.669	43%	0.43	S	S	*	.	H	α-helix	trans	-55.1	-28.6	175.4	-25.2	33.6	0	0	0	114.3	I127 E132 G133	I127-P129 WeakPolarHBondContact O-CD 3.09Å; P129-E132 PolarHBondContact O-N 2.75Å; P129-G133 PolarHBondContact O-N 2.81Å
130	R	79.3	Confident	74	Confident	125 Å²	125	88.9 Å²	88.9	47%	0.472	43%	0.431	S	S	.	.	H	α-helix	trans	-69.6	-40.6	179.1	-60.2	-179.8	-172	-178.3	6.2	111.6	L82 D128 E132 G133 I134	L82-R130 HydrophobicContact CD2-CB 4.03Å; L82-R130 VanDerWaalsContact O-CD 3.3Å; L82-R130 WeakPolarHBondContact O-CD 3.4Å; L82-R130 PolarHBondContact O-NH1 3.34Å; D128-R130 PolarHBondContact O-N 3.45Å; D128-R130 VanDerWaalsContact O-N 3.16Å; D128-R130 WeakPolarHBondContact OD1-CB 3.37Å; D128-R130 WeakPolarHBondContact OD1-CG 3.46Å; D128-R130 PolarHBondContact OD1-N 3.19Å; R130-E132 VanDerWaalsContact C-N 3.32Å; R130-G133 WeakPolarHBondContact O-CA 3.37Å; R130-G133 PolarHBondContact O-N 2.96Å; R130-G133 VanDerWaalsContact O-N 3.14Å; R130-I134 PolarHBondContact O-N 2.94Å
131	L	79	Confident	75.5	Confident	4 Å²	4	83.9 Å²	83.9	2%	0.021	40%	0.404	C	S	.	.	H	α-helix	trans	-63.8	-42.4	176.2	-175.4	66.1	0	0	0	110.3	L78 L82 C104 Y108 D128 G133 I134 V135	L78-L131 HydrophobicContact CD1-CD1 4.21Å; L78-L131 HydrophobicContact CD2-CD1 4.5Å; L82-L131 HydrophobicContact CD1-CB 4.25Å; L82-L131 HydrophobicContact CD1-CD1 4.28Å; L82-L131 HydrophobicContact CD2-CB 4.08Å; L82-L131 HydrophobicContact CD2-CD1 4.22Å; C104-L131 HydrophobicContact CB-CD1 3.97Å; Y108-L131 HydrophobicContact CD2-CD2 3.81Å; Y108-L131 HydrophobicContact CD2-CG 3.83Å; Y108-L131 HydrophobicContact CG-CD2 4.39Å; Y108-L131 HydrophobicContact CG-CG 4.44Å; D128-L131 HydrophobicContact CB-CB 4.33Å; D128-L131 WeakPolarHBondContact O-CB 3.21Å; D128-L131 PolarHBondContact O-N 3Å; D128-L131 VanDerWaalsContact O-N 3.15Å; L131-G133 VanDerWaalsContact C-N 3.32Å; L131-G133 PolarHBondContact O-N 3.49Å; L131-I134 PolarHBondContact O-N 2.82Å; L131-V135 WeakPolarHBondContact O-CG2 3.33Å; L131-V135 PolarHBondContact O-N 2.82Å
132	E	81.6	Confident	77	Confident	55 Å²	55	76.4 Å²	76.4	26%	0.257	36%	0.364	S	S	.	.	H	α-helix	trans	-64	-36.8	172.6	179.8	151.6	-121.3	0	0	112.6	Y108 R112 D128 P129 R130 V135 N136 R160	Y108-E132 HydrophobicContact CE2-CB 4.1Å; Y108-E132 PolarHBondContact OH-OE1 2.9Å; R112-E132 IonicContact NH2-OE1 3.66Å; R112-E132 PolarHBondContact NH2-OE1 3.19Å; R112-E132 IonicContact NH2-OE2 3.79Å; D128-E132 PolarHBondContact O-N 3.48Å; P129-E132 PolarHBondContact O-N 2.75Å; R130-E132 VanDerWaalsContact C-N 3.32Å; E132-V135 PolarHBondContact O-N 3.06Å; E132-N136 WeakPolarHBondContact O-CB 2.98Å; E132-N136 PolarHBondContact O-N 3.09Å; E132-N136 PolarHBondContact O-ND2 2.77Å; E132-R160 IonicContact OE1-NH1 3.14Å; E132-R160 PolarHBondContact OE1-NH1 3.26Å; E132-R160 VanDerWaalsContact OE1-NH1 3.12Å
133	G	81.8	Confident	78.3	Confident	28 Å²	28	72 Å²	72	29%	0.289	34%	0.344	S	S	.	.	H	α-helix	trans	-61.2	-45.2	175.2	0	0	0	0	0	113.6	P129 R130 L131 N136 K137	P129-G133 PolarHBondContact O-N 2.81Å; R130-G133 WeakPolarHBondContact O-CA 3.37Å; R130-G133 PolarHBondContact O-N 2.96Å; R130-G133 VanDerWaalsContact O-N 3.14Å; L131-G133 VanDerWaalsContact C-N 3.32Å; L131-G133 PolarHBondContact O-N 3.49Å; G133-N136 PolarHBondContact O-N 3.4Å; G133-K137 WeakPolarHBondContact O-CG 3.35Å; G133-K137 PolarHBondContact O-N 3.25Å
134	I	80.3	Confident	79.6	Confident	17 Å²	17	68.8 Å²	68.8	9%	0.087	33%	0.333	C	S	.	.	H	α-helix	trans	-64.1	-45.4	177.1	-67.1	174.8	0	0	0	110.7	L82 F88 V90 R130 L131 N136 K137 M138	L82-I134 HydrophobicContact CD2-CD1 3.57Å; F88-I134 HydrophobicContact CD1-CD1 3.96Å; F88-I134 HydrophobicContact CE1-CD1 4.02Å; V90-I134 HydrophobicContact CG2-CG2 4.1Å; R130-I134 PolarHBondContact O-N 2.94Å; L131-I134 PolarHBondContact O-N 2.82Å; I134-N136 VanDerWaalsContact C-N 3.32Å; I134-N136 PolarHBondContact O-N 2.97Å; I134-K137 PolarHBondContact O-N 2.99Å; I134-M138 PolarHBondContact O-N 3.12Å
135	V	82.8	Confident	80.4	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.012	32%	0.319	C	S	.	.	H	α-helix	trans	-60.2	-43.9	177.2	170.2	0	0	0	0	110.6	I105 Y108 L131 E132 K137 M138 F139 T158	I105-V135 HydrophobicContact CG1-CG2 4.45Å; Y108-V135 HydrophobicContact CD1-CG1 4.49Å; Y108-V135 HydrophobicContact CD1-CG2 4.26Å; Y108-V135 HydrophobicContact CD2-CG2 4.47Å; Y108-V135 HydrophobicContact CE1-CG1 4.36Å; Y108-V135 HydrophobicContact CG-CG2 4.11Å; L131-V135 WeakPolarHBondContact O-CG2 3.33Å; L131-V135 PolarHBondContact O-N 2.82Å; E132-V135 PolarHBondContact O-N 3.06Å; V135-K137 PolarHBondContact O-N 3.46Å; V135-M138 PolarHBondContact O-N 3.09Å; V135-F139 HydrophobicContact CG1-CD2 3.75Å; V135-F139 HydrophobicContact CG1-CE2 3.33Å; V135-F139 HydrophobicContact CG1-CZ 4.44Å; V135-F139 WeakPolarHBondContact O-CD2 3.29Å; V135-F139 PolarHBondContact O-N 3.05Å; V135-T158 HydrophobicContact CG1-CG2 4.47Å
136	N	84.4	Confident	81	Confident	56 Å²	56	65.6 Å²	65.6	30%	0.299	33%	0.325	S	S	.	.	H	α-helix	trans	-61.4	-41.7	174.8	-73.4	-26.5	0	0	0	113	E132 G133 I134 M138 F139 L140 R160	E132-N136 WeakPolarHBondContact O-CB 2.98Å; E132-N136 PolarHBondContact O-N 3.09Å; E132-N136 PolarHBondContact O-ND2 2.77Å; G133-N136 PolarHBondContact O-N 3.4Å; I134-N136 VanDerWaalsContact C-N 3.32Å; I134-N136 PolarHBondContact O-N 2.97Å; N136-M138 VanDerWaalsContact C-N 3.29Å; N136-M138 PolarHBondContact O-N 3.46Å; N136-F139 WeakPolarHBondContact O-CB 3.5Å; N136-F139 PolarHBondContact O-N 3.21Å; N136-L140 WeakPolarHBondContact O-CG 3.48Å; N136-L140 PolarHBondContact O-N 3.25Å; N136-R160 PolarHBondContact OD1-NH1 2.87Å; N136-R160 PolarHBondContact OD1-NH2 2.98Å
137	K	82.3	Confident	81.7	Confident	106 Å²	106	60.2 Å²	60.2	46%	0.461	30%	0.301	S	S	.	.	H	α-helix	trans	-61.6	-38.6	174.8	-75.8	178.5	-179.1	178	0	111.3	V90 G133 I134 V135 L140 R141	V90-K137 HydrophobicContact CG2-CB 4.25Å; V90-K137 HydrophobicContact CG2-CD 4.37Å; G133-K137 WeakPolarHBondContact O-CG 3.35Å; G133-K137 PolarHBondContact O-N 3.25Å; I134-K137 PolarHBondContact O-N 2.99Å; V135-K137 PolarHBondContact O-N 3.46Å; K137-L140 PolarHBondContact O-N 2.99Å; K137-R141 PolarHBondContact O-N 3.11Å
138	M	81.1	Confident	82.1	Confident	42 Å²	42	60 Å²	60	21%	0.207	30%	0.298	C	S	.	.	H	α-helix	trans	-67.4	-38.2	174.9	-178.9	43.6	179.2	0	0	112.2	I105 I134 V135 N136 L140 R141 C142	I105-M138 HydrophobicContact CD1-CG 4.5Å; I134-M138 PolarHBondContact O-N 3.12Å; V135-M138 PolarHBondContact O-N 3.09Å; N136-M138 VanDerWaalsContact C-N 3.29Å; N136-M138 PolarHBondContact O-N 3.46Å; M138-L140 VanDerWaalsContact C-N 3.33Å; M138-L140 PolarHBondContact O-N 2.99Å; M138-R141 PolarHBondContact O-N 3.13Å; M138-R141 HydrophobicContact SD-CB 4.15Å; M138-C142 WeakPolarHBondContact CE-SG 3.29Å; M138-C142 PolarHBondContact O-N 3.44Å; M138-C142 PolarHBondContact O-SG 3.36Å
139	F	82.7	Confident	82.5	Confident	7 Å²	7	63.3 Å²	63.3	3%	0.031	31%	0.31	C	S	.	.	H	α-helix	trans	-60.1	-43.7	172.1	-78.6	-67.3	0	0	0	112.3	V135 N136 R141 C142 L143 I154 A155 T158 I163	V135-F139 HydrophobicContact CG1-CD2 3.75Å; V135-F139 HydrophobicContact CG1-CE2 3.33Å; V135-F139 HydrophobicContact CG1-CZ 4.44Å; V135-F139 WeakPolarHBondContact O-CD2 3.29Å; V135-F139 PolarHBondContact O-N 3.05Å; N136-F139 WeakPolarHBondContact O-CB 3.5Å; N136-F139 PolarHBondContact O-N 3.21Å; F139-R141 PolarHBondContact O-N 3.37Å; F139-C142 WeakPolarHBondContact O-CB 3.37Å; F139-C142 PolarHBondContact O-N 2.97Å; F139-L143 VanDerWaalsContact O-CG 3.25Å; F139-L143 WeakPolarHBondContact O-CG 3.37Å; F139-L143 PolarHBondContact O-N 2.92Å; F139-I154 HydrophobicContact CE1-CB 3.67Å; F139-I154 HydrophobicContact CE1-CG2 3.7Å; F139-I154 HydrophobicContact CE2-CG2 4.07Å; F139-I154 HydrophobicContact CZ-CB 3.8Å; F139-I154 HydrophobicContact CZ-CG2 3.32Å; F139-A155 HydrophobicContact CE1-CB 4.15Å; F139-A155 HydrophobicContact CZ-CB 4.44Å; F139-T158 HydrophobicContact CZ-CG2 4.44Å; F139-I163 HydrophobicContact CB-CG2 4.44Å; F139-I163 HydrophobicContact CD1-CD1 4.1Å; F139-I163 HydrophobicContact CD1-CG2 3.6Å; F139-I163 HydrophobicContact CD2-CD1 3.32Å; F139-I163 HydrophobicContact CD2-CG1 4.38Å; F139-I163 HydrophobicContact CE1-CD1 3.89Å; F139-I163 HydrophobicContact CE1-CG2 3.86Å; F139-I163 HydrophobicContact CE2-CD1 3.08Å; F139-I163 HydrophobicContact CE2-CG1 4.45Å; F139-I163 HydrophobicContact CG-CD1 3.84Å; F139-I163 HydrophobicContact CG-CG2 3.96Å; F139-I163 HydrophobicContact CZ-CD1 3.38Å; F139-I163 HydrophobicContact CZ-CG2 4.44Å
140	L	83.4	Confident	82.8	Confident	100 Å²	100	63.6 Å²	63.6	52%	0.524	30%	0.302	S	S	.	.	H	α-helix	trans	-60.4	-44.5	175.1	-68.4	169.7	0	0	0	111.6	N136 K137 M138 C142 L143 D144	N136-L140 WeakPolarHBondContact O-CG 3.48Å; N136-L140 PolarHBondContact O-N 3.25Å; K137-L140 PolarHBondContact O-N 2.99Å; M138-L140 VanDerWaalsContact C-N 3.33Å; M138-L140 PolarHBondContact O-N 2.99Å; L140-C142 VanDerWaalsContact C-N 3.32Å; L140-C142 PolarHBondContact O-N 3.22Å; L140-L143 PolarHBondContact O-N 3.44Å; L140-L143 VanDerWaalsContact O-N 3.1Å; L140-D144 WeakPolarHBondContact O-CB 3.25Å; L140-D144 VanDerWaalsContact O-CG 3.28Å; L140-D144 PolarHBondContact O-N 2.85Å
141	R	82.7	Confident	83	Confident	80 Å²	80	57.6 Å²	57.6	30%	0.302	28%	0.279	S	S	.	.	H	α-helix	trans	-57.2	-44.2	174.3	-175	178.3	-179	174.3	-0.8	112	V90 D93 K137 M138 F139 L143 D144 D145	V90-R141 PolarHBondContact O-NH1 2.99Å; D93-R141 IonicContact OD1-CZ 2.65Å; D93-R141 IonicContact OD1-NH1 2.69Å; D93-R141 IonicContact OD1-NH2 3.85Å; D93-R141 PolarHBondContact OD1-NH2 3.1Å; K137-R141 PolarHBondContact O-N 3.11Å; M138-R141 PolarHBondContact O-N 3.13Å; M138-R141 HydrophobicContact SD-CB 4.15Å; F139-R141 PolarHBondContact O-N 3.37Å; R141-L143 VanDerWaalsContact C-N 3.3Å; R141-L143 PolarHBondContact O-N 3.47Å; R141-D144 PolarHBondContact O-N 3.2Å; R141-D145 VanDerWaalsContact O-CB 3.29Å; R141-D145 WeakPolarHBondContact O-CB 3.48Å; R141-D145 PolarHBondContact O-N 3.44Å
142	C	81.8	Confident	83.3	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.014	28%	0.278	C	S	.	.	H	α-helix	trans	-64.6	-34.2	177.4	-73.1	0	0	0	0	113.2	M138 F139 L140 H146 K147 A151	M138-C142 WeakPolarHBondContact CE-SG 3.29Å; M138-C142 PolarHBondContact O-N 3.44Å; M138-C142 PolarHBondContact O-SG 3.36Å; F139-C142 WeakPolarHBondContact O-CB 3.37Å; F139-C142 PolarHBondContact O-N 2.97Å; L140-C142 VanDerWaalsContact C-N 3.32Å; L140-C142 PolarHBondContact O-N 3.22Å; C142-H146 PolarHBondContact O-N 3.26Å; C142-K147 PolarHBondContact O-N 2.95Å; C142-A151 HydrophobicContact CB-CB 4.09Å
143	L	82.8	Confident	83.4	Confident	16 Å²	16	55.9 Å²	55.9	8%	0.084	28%	0.278	C	S	.	.	H	α-helix	trans	-72.9	-43.7	177.4	-67.8	166.9	0	0	0	110.8	F139 L140 R141 D145 H146 Y148 T167 E170	F139-L143 VanDerWaalsContact O-CG 3.25Å; F139-L143 WeakPolarHBondContact O-CG 3.37Å; F139-L143 PolarHBondContact O-N 2.92Å; L140-L143 PolarHBondContact O-N 3.44Å; L140-L143 VanDerWaalsContact O-N 3.1Å; R141-L143 VanDerWaalsContact C-N 3.3Å; R141-L143 PolarHBondContact O-N 3.47Å; L143-D145 VanDerWaalsContact C-N 3.34Å; L143-D145 PolarHBondContact O-N 3.46Å; L143-H146 PolarHBondContact O-N 2.93Å; L143-H146 VanDerWaalsContact O-N 3.08Å; L143-Y148 HydrophobicContact CD2-CD1 4.08Å; L143-Y148 HydrophobicContact CD2-CE1 4.13Å; L143-T167 HydrophobicContact CD2-CG2 4.04Å; L143-E170 WeakPolarHBondContact CD1-OE2 3.47Å
144	D	85.2	Confident	83.5	Confident	124 Å²	124	55.7 Å²	55.7	66%	0.663	27%	0.27	S	S	*	.	H	α-helix	trans	-63.3	-38.2	175.6	-67.9	-23.1	0	0	0	111.9	L140 R141 H146	L140-D144 WeakPolarHBondContact O-CB 3.25Å; L140-D144 VanDerWaalsContact O-CG 3.28Å; L140-D144 PolarHBondContact O-N 2.85Å; R141-D144 PolarHBondContact O-N 3.2Å; D144-H146 PolarHBondContact O-N 3.5Å
145	D	85.1	Confident	83.7	Confident	78 Å²	78	54.9 Å²	54.9	42%	0.417	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-2.9	175.3	-84.6	8.3	0	0	0	113.5	R141 L143 K147	R141-D145 VanDerWaalsContact O-CB 3.29Å; R141-D145 WeakPolarHBondContact O-CB 3.48Å; R141-D145 PolarHBondContact O-N 3.44Å; L143-D145 VanDerWaalsContact C-N 3.34Å; L143-D145 PolarHBondContact O-N 3.46Å; D145-K147 HydrophobicContact CB-CD 4.29Å; D145-K147 HydrophobicContact CB-CG 4.13Å; D145-K147 PolarHBondContact O-N 3.5Å; D145-K147 IonicContact OD2-NZ 3.27Å; D145-K147 PolarHBondContact OD2-NZ 2.95Å; D145-K147 VanDerWaalsContact OD2-NZ 3.1Å
146	H	83.8	Confident	83.6	Confident	124 Å²	124	55 Å²	55	57%	0.574	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	26.3	-172.5	-57.8	-60.4	0	0	0	114.6	C142 L143 D144 Y148	C142-H146 PolarHBondContact O-N 3.26Å; L143-H146 PolarHBondContact O-N 2.93Å; L143-H146 VanDerWaalsContact O-N 3.08Å; D144-H146 PolarHBondContact O-N 3.5Å; H146-Y148 VanDerWaalsContact C-N 3.34Å; H146-Y148 HydrophobicContact CB-CE2 3.93Å; H146-Y148 AromaticContact ND1-CZ 3.89Å; H146-Y148 PolarHBondContact ND1-OH 3.26Å; H146-Y148 VanDerWaalsContact ND1-OH 3.15Å; H146-Y148 VanDerWaalsContact O-CD2 3.32Å; H146-Y148 WeakPolarHBondContact O-CD2 3.5Å; H146-Y148 PolarHBondContact O-N 3.46Å
147	K	85.8	Confident	83.4	Confident	98 Å²	98	57.3 Å²	57.3	43%	0.426	28%	0.275	S	S	.	.			trans	-92.7	59.4	178.9	-67.7	-179	-165.7	146.3	0	111.8	C142 D145 K149 Q150 A151	C142-K147 PolarHBondContact O-N 2.95Å; D145-K147 HydrophobicContact CB-CD 4.29Å; D145-K147 HydrophobicContact CB-CG 4.13Å; D145-K147 PolarHBondContact O-N 3.5Å; D145-K147 IonicContact OD2-NZ 3.27Å; D145-K147 PolarHBondContact OD2-NZ 2.95Å; D145-K147 VanDerWaalsContact OD2-NZ 3.1Å; K147-K149 VanDerWaalsContact C-N 3.27Å; K147-K149 PolarHBondContact O-N 3.02Å; K147-K149 VanDerWaalsContact O-N 3.16Å; K147-Q150 HydrophobicContact CB-CB 4.46Å; K147-Q150 PolarHBondContact O-N 2.91Å; K147-Q150 VanDerWaalsContact O-N 3.09Å; K147-A151 PolarHBondContact O-N 3.36Å
148	Y	84.4	Confident	83.4	Confident	26 Å²	26	52.2 Å²	52.2	10%	0.102	25%	0.253	C	S	.	.	H	α-helix	trans	-59.5	-30.6	-175.5	-53.6	-79.9	0	0	0	114.6	L143 H146 Q150 A151 I152 T167 E170 L177	L143-Y148 HydrophobicContact CD2-CD1 4.08Å; L143-Y148 HydrophobicContact CD2-CE1 4.13Å; H146-Y148 VanDerWaalsContact C-N 3.34Å; H146-Y148 HydrophobicContact CB-CE2 3.93Å; H146-Y148 AromaticContact ND1-CZ 3.89Å; H146-Y148 PolarHBondContact ND1-OH 3.26Å; H146-Y148 VanDerWaalsContact ND1-OH 3.15Å; H146-Y148 VanDerWaalsContact O-CD2 3.32Å; H146-Y148 WeakPolarHBondContact O-CD2 3.5Å; H146-Y148 PolarHBondContact O-N 3.46Å; Y148-Q150 VanDerWaalsContact C-N 3.33Å; Y148-Q150 PolarHBondContact O-N 3.42Å; Y148-A151 PolarHBondContact O-N 3.5Å; Y148-I152 WeakPolarHBondContact O-CG1 3.33Å; Y148-I152 PolarHBondContact O-N 2.86Å; Y148-T167 HydrophobicContact CD1-CG2 4.08Å; Y148-E170 HydrophobicContact CE1-CB 4.39Å; Y148-E170 PolarHBondContact OH-O 3.34Å; Y148-L177 HydrophobicContact CG-CD2 4.4Å
149	K	83.6	Confident	83.4	Confident	137 Å²	137	52.7 Å²	52.7	60%	0.596	25%	0.252	S	S	*	.	H	α-helix	trans	-64.7	-36.8	177.4	-67.2	-179.4	-177.1	174.7	0	112.7	K147 G153 Y180	K147-K149 VanDerWaalsContact C-N 3.27Å; K147-K149 PolarHBondContact O-N 3.02Å; K147-K149 VanDerWaalsContact O-N 3.16Å; K149-G153 PolarHBondContact O-N 3Å; K149-Y180 HydrophobicContact CB-CE1 4.26Å; K149-Y180 HydrophobicContact CG-CD1 4.47Å; K149-Y180 HydrophobicContact CG-CE1 4.3Å
150	Q	84.7	Confident	83.3	Confident	108 Å²	108	54 Å²	54	51%	0.505	26%	0.257	S	S	.	.	H	α-helix	trans	-73.7	-43.3	176.1	-69.3	178	-20.1	0	0	110.3	K147 Y148 I152 G153 I154	K147-Q150 HydrophobicContact CB-CB 4.46Å; K147-Q150 PolarHBondContact O-N 2.91Å; K147-Q150 VanDerWaalsContact O-N 3.09Å; Y148-Q150 VanDerWaalsContact C-N 3.33Å; Y148-Q150 PolarHBondContact O-N 3.42Å; Q150-I152 VanDerWaalsContact C-N 3.29Å; Q150-I152 PolarHBondContact O-N 3.28Å; Q150-G153 WeakPolarHBondContact O-CA 3.43Å; Q150-G153 PolarHBondContact O-N 3.15Å; Q150-I154 WeakPolarHBondContact O-CG1 3.43Å; Q150-I154 PolarHBondContact O-N 3.45Å
151	A	84.8	Confident	83.3	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-56.7	-41.8	174.9	0	0	0	0	0	112.2	C142 K147 Y148 I154 A155 T167	C142-A151 HydrophobicContact CB-CB 4.09Å; K147-A151 PolarHBondContact O-N 3.36Å; Y148-A151 PolarHBondContact O-N 3.5Å; A151-I154 PolarHBondContact O-N 3.45Å; A151-A155 WeakPolarHBondContact O-CB 3.38Å; A151-A155 PolarHBondContact O-N 3.47Å; A151-T167 HydrophobicContact CB-CG2 3.57Å
152	I	83.8	Confident	83.4	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.2	-45.9	172.1	-75.1	177.2	0	0	0	111.5	Y148 Q150 I154 A155 L156 F164 T167 I168 L177 Y180	Y148-I152 WeakPolarHBondContact O-CG1 3.33Å; Y148-I152 PolarHBondContact O-N 2.86Å; Q150-I152 VanDerWaalsContact C-N 3.29Å; Q150-I152 PolarHBondContact O-N 3.28Å; I152-I154 PolarHBondContact O-N 2.89Å; I152-A155 PolarHBondContact O-N 2.88Å; I152-L156 HydrophobicContact CG2-CD1 3.65Å; I152-L156 HydrophobicContact CG2-CG 4.12Å; I152-L156 WeakPolarHBondContact O-CB 3.25Å; I152-L156 WeakPolarHBondContact O-CG 3.34Å; I152-L156 PolarHBondContact O-N 2.68Å; I152-F164 HydrophobicContact CG1-CD2 4.39Å; I152-F164 HydrophobicContact CG1-CE2 4.4Å; I152-F164 HydrophobicContact CG2-CD2 4.36Å; I152-F164 HydrophobicContact CG2-CE2 4.05Å; I152-T167 HydrophobicContact CG1-CG2 4.1Å; I152-I168 HydrophobicContact CD1-CG1 4.47Å; I152-L177 HydrophobicContact CD1-CB 4.48Å; I152-L177 HydrophobicContact CD1-CD2 3.37Å; I152-L177 HydrophobicContact CD1-CG 3.98Å; I152-L177 HydrophobicContact CG1-CD2 4.29Å; I152-Y180 HydrophobicContact CG2-CE1 4.47Å
153	G	83.8	Confident	83.5	Confident	23 Å²	23	53.2 Å²	53.2	24%	0.237	26%	0.259	C	S	.	.	H	α-helix	trans	-55.6	-51.6	178.4	0	0	0	0	0	111.9	K149 Q150 A155 L156 E157	K149-G153 PolarHBondContact O-N 3Å; Q150-G153 WeakPolarHBondContact O-CA 3.43Å; Q150-G153 PolarHBondContact O-N 3.15Å; G153-A155 PolarHBondContact O-N 3.43Å; G153-L156 PolarHBondContact O-N 3.31Å; G153-E157 WeakPolarHBondContact O-CG 3.38Å; G153-E157 PolarHBondContact O-N 2.99Å
154	I	83.4	Confident	83.6	Confident	24 Å²	24	52.6 Å²	52.6	12%	0.123	26%	0.255	C	S	.	.	H	α-helix	trans	-66.2	-39	179.4	-53.5	165.9	0	0	0	110.6	I105 F139 Q150 A151 I152 L156 E157 T158	I105-I154 HydrophobicContact CG2-CG2 4.43Å; F139-I154 HydrophobicContact CE1-CB 3.67Å; F139-I154 HydrophobicContact CE1-CG2 3.7Å; F139-I154 HydrophobicContact CE2-CG2 4.07Å; F139-I154 HydrophobicContact CZ-CB 3.8Å; F139-I154 HydrophobicContact CZ-CG2 3.32Å; Q150-I154 WeakPolarHBondContact O-CG1 3.43Å; Q150-I154 PolarHBondContact O-N 3.45Å; A151-I154 PolarHBondContact O-N 3.45Å; I152-I154 PolarHBondContact O-N 2.89Å; I154-L156 VanDerWaalsContact C-N 3.29Å; I154-L156 PolarHBondContact O-N 2.92Å; I154-E157 PolarHBondContact O-N 2.73Å; I154-T158 HydrophobicContact CG2-CG2 4.14Å; I154-T158 WeakPolarHBondContact O-CB 3.43Å; I154-T158 VanDerWaalsContact O-CG2 3.26Å; I154-T158 WeakPolarHBondContact O-CG2 3.25Å; I154-T158 PolarHBondContact O-N 3.37Å; I154-T158 PolarHBondContact O-OG1 3.32Å
155	A	84.5	Confident	83.6	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.6	-38.4	177.5	0	0	0	0	0	112.1	F139 A151 I152 G153 T158 R159 R160 I163 F164	F139-A155 HydrophobicContact CE1-CB 4.15Å; F139-A155 HydrophobicContact CZ-CB 4.44Å; A151-A155 WeakPolarHBondContact O-CB 3.38Å; A151-A155 PolarHBondContact O-N 3.47Å; I152-A155 PolarHBondContact O-N 2.88Å; G153-A155 PolarHBondContact O-N 3.43Å; A155-T158 WeakPolarHBondContact CA-OG1 3.08Å; A155-T158 PolarHBondContact O-OG1 3.35Å; A155-R159 PolarHBondContact O-N 3.3Å; A155-R160 PolarHBondContact O-N 3.35Å; A155-I163 HydrophobicContact CB-CB 4.28Å; A155-I163 HydrophobicContact CB-CG2 4.34Å; A155-F164 HydrophobicContact CB-CB 4.15Å
156	L	82.1	Confident	83.6	Confident	5 Å²	5	53 Å²	53	3%	0.026	25%	0.249	C	C	.	.	H	α-helix	trans	-71.6	-41	176.8	-72.7	179	0	0	0	112.1	I152 G153 I154 R159 F164 V184 M189 V198	I152-L156 HydrophobicContact CG2-CD1 3.65Å; I152-L156 HydrophobicContact CG2-CG 4.12Å; I152-L156 WeakPolarHBondContact O-CB 3.25Å; I152-L156 WeakPolarHBondContact O-CG 3.34Å; I152-L156 PolarHBondContact O-N 2.68Å; G153-L156 PolarHBondContact O-N 3.31Å; I154-L156 VanDerWaalsContact C-N 3.29Å; I154-L156 PolarHBondContact O-N 2.92Å; L156-R159 PolarHBondContact O-N 3.4Å; L156-F164 HydrophobicContact CD2-CD2 4.04Å; L156-F164 HydrophobicContact CD2-CE2 3.99Å; L156-F164 HydrophobicContact CG-CD2 4.34Å; L156-F164 HydrophobicContact CG-CE2 4.37Å; L156-V184 HydrophobicContact CD1-CB 4.27Å; L156-V184 HydrophobicContact CD1-CG1 3.56Å; L156-M189 HydrophobicContact CB-CE 3.54Å; L156-M189 HydrophobicContact CD1-CE 4.15Å; L156-M189 HydrophobicContact CD2-CE 3.93Å; L156-M189 HydrophobicContact CG-CE 4.06Å; L156-V198 HydrophobicContact CD2-CG1 4.27Å; L156-V198 HydrophobicContact CD2-CG2 4.31Å
157	E	80.3	Confident	83.6	Confident	103 Å²	103	47 Å²	47	48%	0.481	22%	0.221	S	C	.	.	H	α-helix	trans	-64.3	-41.6	174.6	-74	171	-173.8	0	0	112.2	T109 G153 I154 R159	T109-E157 HydrophobicContact CG2-CB 3.99Å; G153-E157 WeakPolarHBondContact O-CG 3.38Å; G153-E157 PolarHBondContact O-N 2.99Å; I154-E157 PolarHBondContact O-N 2.73Å; E157-R159 PolarHBondContact O-N 3.16Å
158	T	81.3	Confident	83.4	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-3.5	177.7	56.8	0	0	0	0	113.9	Y108 T109 V135 F139 I154 A155 R160	Y108-T158 HydrophobicContact CD1-CG2 3.79Å; Y108-T158 HydrophobicContact CE1-CG2 3.87Å; T109-T158 HydrophobicContact CG2-CG2 3.81Å; V135-T158 HydrophobicContact CG1-CG2 4.47Å; F139-T158 HydrophobicContact CZ-CG2 4.44Å; I154-T158 HydrophobicContact CG2-CG2 4.14Å; I154-T158 WeakPolarHBondContact O-CB 3.43Å; I154-T158 VanDerWaalsContact O-CG2 3.26Å; I154-T158 WeakPolarHBondContact O-CG2 3.25Å; I154-T158 PolarHBondContact O-N 3.37Å; I154-T158 PolarHBondContact O-OG1 3.32Å; A155-T158 WeakPolarHBondContact CA-OG1 3.08Å; A155-T158 PolarHBondContact O-OG1 3.35Å; T158-R160 PolarHBondContact O-N 3.04Å
159	R	81.3	Confident	83.4	Confident	52 Å²	52	46.8 Å²	46.8	20%	0.196	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	52	35.1	-175.5	-60.6	-171.9	-179.2	174.1	5.4	113.4	A116 E117 A155 L156 E157 F194	A116-R159 VanDerWaalsContact CB-NH1 3.3Å; E117-R159 IonicContact OE1-CZ 3.44Å; E117-R159 IonicContact OE1-NH1 2.82Å; E117-R159 IonicContact OE1-NH2 3.82Å; E117-R159 PolarHBondContact OE1-NH2 3.21Å; A155-R159 PolarHBondContact O-N 3.3Å; L156-R159 PolarHBondContact O-N 3.4Å; E157-R159 PolarHBondContact O-N 3.16Å; R159-F194 VanDerWaalsContact CA-CZ 3.5Å; R159-F194 HydrophobicContact CB-CD2 4.08Å; R159-F194 HydrophobicContact CB-CE1 4.45Å; R159-F194 HydrophobicContact CB-CE2 3.58Å; R159-F194 HydrophobicContact CB-CZ 3.81Å; R159-F194 HydrophobicContact CG-CD1 4.26Å; R159-F194 HydrophobicContact CG-CD2 4.18Å; R159-F194 HydrophobicContact CG-CE1 4.04Å; R159-F194 HydrophobicContact CG-CE2 3.97Å; R159-F194 HydrophobicContact CG-CG 4.33Å; R159-F194 HydrophobicContact CG-CZ 3.91Å
160	R	81.4	Confident	83.3	Confident	35 Å²	35	45.2 Å²	45.2	13%	0.132	22%	0.221	C	C	.	.			trans	-104.3	105.8	-178.3	-87.2	-177.7	50.6	177.1	-16.3	112.3	E132 N136 A155 T158 I163 F164	E132-R160 IonicContact OE1-NH1 3.14Å; E132-R160 PolarHBondContact OE1-NH1 3.26Å; E132-R160 VanDerWaalsContact OE1-NH1 3.12Å; N136-R160 PolarHBondContact OD1-NH1 2.87Å; N136-R160 PolarHBondContact OD1-NH2 2.98Å; A155-R160 PolarHBondContact O-N 3.35Å; T158-R160 PolarHBondContact O-N 3.04Å; R160-I163 HydrophobicContact CB-CD1 3.97Å; R160-I163 HydrophobicContact CB-CG1 4.42Å; R160-F164 PolarHBondContact O-N 2.76Å
161	L	82.5	Confident	82.9	Confident	41 Å²	41	40.5 Å²	40.5	22%	0.215	20%	0.199	C	C	.	.	H	α-helix	trans	-68.5	-35.2	179.6	-59.5	174.2	0	0	0	112.6	I163 F164 E165 F194 E197 V198 V201	L161-I163 VanDerWaalsContact C-N 3.35Å; L161-I163 PolarHBondContact O-N 3.09Å; L161-F164 WeakPolarHBondContact O-CB 3.28Å; L161-F164 PolarHBondContact O-N 3.06Å; L161-E165 PolarHBondContact O-N 3.17Å; L161-F194 HydrophobicContact CD2-CE2 4.17Å; L161-E197 HydrophobicContact CD1-CB 4.09Å; L161-V198 HydrophobicContact CD2-CB 4.31Å; L161-V198 HydrophobicContact CD2-CG2 3.58Å; L161-V201 HydrophobicContact CB-CG2 4.45Å; L161-V201 HydrophobicContact CD1-CG2 4.3Å; L161-V201 HydrophobicContact CD2-CG2 4.39Å
162	D	84.1	Confident	82.4	Confident	115 Å²	115	47.7 Å²	47.7	62%	0.615	24%	0.238	S	C	*	.	H	α-helix	trans	-63.1	-39	-176.5	-50	-15.5	0	0	0	112.7	K166	D162-K166 VanDerWaalsContact O-CG 3.32Å; D162-K166 WeakPolarHBondContact O-CG 3.29Å; D162-K166 PolarHBondContact O-N 2.98Å
163	I	84.1	Confident	82.1	Confident	9 Å²	9	52.1 Å²	52.1	5%	0.046	26%	0.261	C	S	.	.	H	α-helix	trans	-75	-38.9	176.6	-55.8	161.2	0	0	0	110.3	F139 A155 R160 L161 E165 K166 T167	F139-I163 HydrophobicContact CB-CG2 4.44Å; F139-I163 HydrophobicContact CD1-CD1 4.1Å; F139-I163 HydrophobicContact CD1-CG2 3.6Å; F139-I163 HydrophobicContact CD2-CD1 3.32Å; F139-I163 HydrophobicContact CD2-CG1 4.38Å; F139-I163 HydrophobicContact CE1-CD1 3.89Å; F139-I163 HydrophobicContact CE1-CG2 3.86Å; F139-I163 HydrophobicContact CE2-CD1 3.08Å; F139-I163 HydrophobicContact CE2-CG1 4.45Å; F139-I163 HydrophobicContact CG-CD1 3.84Å; F139-I163 HydrophobicContact CG-CG2 3.96Å; F139-I163 HydrophobicContact CZ-CD1 3.38Å; F139-I163 HydrophobicContact CZ-CG2 4.44Å; A155-I163 HydrophobicContact CB-CB 4.28Å; A155-I163 HydrophobicContact CB-CG2 4.34Å; R160-I163 HydrophobicContact CB-CD1 3.97Å; R160-I163 HydrophobicContact CB-CG1 4.42Å; L161-I163 VanDerWaalsContact C-N 3.35Å; L161-I163 PolarHBondContact O-N 3.09Å; I163-E165 VanDerWaalsContact C-N 3.26Å; I163-E165 PolarHBondContact O-N 3.04Å; I163-K166 PolarHBondContact O-N 3.26Å; I163-T167 WeakPolarHBondContact CG2-OG1 3.45Å; I163-T167 VanDerWaalsContact O-CB 3.32Å; I163-T167 WeakPolarHBondContact O-CB 3.32Å; I163-T167 PolarHBondContact O-N 3.38Å; I163-T167 PolarHBondContact O-OG1 3.33Å
164	F	85.9	Confident	81.9	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.009	26%	0.261	C	S	.	.	H	α-helix	trans	-56.9	-45.5	178.3	177.5	-97.8	0	0	0	110.5	I152 A155 L156 R160 L161 T167 I168 V198 V201 L202	I152-F164 HydrophobicContact CG1-CD2 4.39Å; I152-F164 HydrophobicContact CG1-CE2 4.4Å; I152-F164 HydrophobicContact CG2-CD2 4.36Å; I152-F164 HydrophobicContact CG2-CE2 4.05Å; A155-F164 HydrophobicContact CB-CB 4.15Å; L156-F164 HydrophobicContact CD2-CD2 4.04Å; L156-F164 HydrophobicContact CD2-CE2 3.99Å; L156-F164 HydrophobicContact CG-CD2 4.34Å; L156-F164 HydrophobicContact CG-CE2 4.37Å; R160-F164 PolarHBondContact O-N 2.76Å; L161-F164 WeakPolarHBondContact O-CB 3.28Å; L161-F164 PolarHBondContact O-N 3.06Å; F164-T167 PolarHBondContact O-N 2.6Å; F164-I168 HydrophobicContact CD1-CD1 3.84Å; F164-I168 HydrophobicContact CD2-CD1 4.43Å; F164-I168 HydrophobicContact CE1-CD1 3.46Å; F164-I168 VanDerWaalsContact CE1-CD1 3.46Å; F164-I168 HydrophobicContact CE2-CD1 4.11Å; F164-I168 HydrophobicContact CG-CD1 4.33Å; F164-I168 HydrophobicContact CZ-CD1 3.64Å; F164-I168 WeakPolarHBondContact O-CD1 3.18Å; F164-I168 VanDerWaalsContact O-CG1 3.31Å; F164-I168 WeakPolarHBondContact O-CG1 3.34Å; F164-I168 PolarHBondContact O-N 3.26Å; F164-V198 HydrophobicContact CE1-CG1 3.99Å; F164-V198 HydrophobicContact CZ-CG1 3.96Å; F164-V201 HydrophobicContact CD1-CG1 4.37Å; F164-L202 HydrophobicContact CE1-CD2 3.69Å; F164-L202 HydrophobicContact CE1-CG 3.91Å; F164-L202 HydrophobicContact CZ-CD1 4.27Å; F164-L202 HydrophobicContact CZ-CD2 3.71Å; F164-L202 HydrophobicContact CZ-CG 4.07Å
165	E	85	Confident	81.5	Confident	80 Å²	80	55.3 Å²	55.3	37%	0.374	28%	0.28	S	S	.	.	H	α-helix	trans	-61.7	-49	175.5	-164.2	176.8	175.6	0	0	112.1	L161 I163 T167 I168 L169 V201 L205	L161-E165 PolarHBondContact O-N 3.17Å; I163-E165 VanDerWaalsContact C-N 3.26Å; I163-E165 PolarHBondContact O-N 3.04Å; E165-T167 PolarHBondContact O-N 3.22Å; E165-I168 PolarHBondContact O-N 3.21Å; E165-L169 HydrophobicContact CG-CD1 4.34Å; E165-L169 WeakPolarHBondContact O-CG 3.47Å; E165-L169 PolarHBondContact O-N 3.22Å; E165-L169 VanDerWaalsContact O-N 3.16Å; E165-V201 HydrophobicContact CB-CG1 4.4Å; E165-V201 HydrophobicContact CG-CG1 4.46Å; E165-L205 HydrophobicContact CG-CD1 4.26Å; E165-L205 HydrophobicContact CG-CD2 3.86Å; E165-L205 HydrophobicContact CG-CG 4.35Å
166	K	84.3	Confident	81.2	Confident	130 Å²	130	56.8 Å²	56.8	57%	0.565	30%	0.296	S	S	*	.	H	α-helix	trans	-60.2	-43.7	178.4	-73.1	178.6	-178	-174.5	0	113.1	D162 I163 I168 L169 E170	D162-K166 VanDerWaalsContact O-CG 3.32Å; D162-K166 WeakPolarHBondContact O-CG 3.29Å; D162-K166 PolarHBondContact O-N 2.98Å; I163-K166 PolarHBondContact O-N 3.26Å; K166-I168 PolarHBondContact O-N 3.46Å; K166-L169 PolarHBondContact O-N 3.08Å; K166-E170 PolarHBondContact O-N 2.91Å
167	T	84.1	Confident	81.2	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-61.3	-34.9	-178.9	-54.9	0	0	0	0	111.4	L143 Y148 A151 I152 I163 F164 E165	L143-T167 HydrophobicContact CD2-CG2 4.04Å; Y148-T167 HydrophobicContact CD1-CG2 4.08Å; A151-T167 HydrophobicContact CB-CG2 3.57Å; I152-T167 HydrophobicContact CG1-CG2 4.1Å; I163-T167 WeakPolarHBondContact CG2-OG1 3.45Å; I163-T167 VanDerWaalsContact O-CB 3.32Å; I163-T167 WeakPolarHBondContact O-CB 3.32Å; I163-T167 PolarHBondContact O-N 3.38Å; I163-T167 PolarHBondContact O-OG1 3.33Å; F164-T167 PolarHBondContact O-N 2.6Å; E165-T167 PolarHBondContact O-N 3.22Å
168	I	82.4	Confident	81.2	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-73.7	-43.7	178.3	-66.2	164.9	0	0	0	110.4	I152 F164 E165 K166 E170 S171 V174 L178 L202 L205	I152-I168 HydrophobicContact CD1-CG1 4.47Å; F164-I168 HydrophobicContact CD1-CD1 3.84Å; F164-I168 HydrophobicContact CD2-CD1 4.43Å; F164-I168 HydrophobicContact CE1-CD1 3.46Å; F164-I168 VanDerWaalsContact CE1-CD1 3.46Å; F164-I168 HydrophobicContact CE2-CD1 4.11Å; F164-I168 HydrophobicContact CG-CD1 4.33Å; F164-I168 HydrophobicContact CZ-CD1 3.64Å; F164-I168 WeakPolarHBondContact O-CD1 3.18Å; F164-I168 VanDerWaalsContact O-CG1 3.31Å; F164-I168 WeakPolarHBondContact O-CG1 3.34Å; F164-I168 PolarHBondContact O-N 3.26Å; E165-I168 PolarHBondContact O-N 3.21Å; K166-I168 PolarHBondContact O-N 3.46Å; I168-E170 PolarHBondContact O-N 2.92Å; I168-S171 PolarHBondContact O-N 3.45Å; I168-S171 PolarHBondContact O-OG 2.85Å; I168-V174 HydrophobicContact CG2-CG1 3.85Å; I168-L178 HydrophobicContact CD1-CD2 4.06Å; I168-L178 HydrophobicContact CG2-CD2 3.87Å; I168-L178 HydrophobicContact CG2-CG 4.04Å; I168-L202 HydrophobicContact CD1-CD2 4.2Å; I168-L205 HydrophobicContact CB-CD1 4.3Å; I168-L205 HydrophobicContact CD1-CD1 3.6Å; I168-L205 HydrophobicContact CG2-CD1 4.23Å
169	L	83.3	Confident	81.1	Confident	117 Å²	117	54.7 Å²	54.7	61%	0.613	30%	0.295	S	S	*	.	H	α-helix	trans	-66.8	-33.7	-178.8	-69.3	172.1	0	0	0	113.5	E165 K166 S171 L205	E165-L169 HydrophobicContact CG-CD1 4.34Å; E165-L169 WeakPolarHBondContact O-CG 3.47Å; E165-L169 PolarHBondContact O-N 3.22Å; E165-L169 VanDerWaalsContact O-N 3.16Å; K166-L169 PolarHBondContact O-N 3.08Å; L169-S171 VanDerWaalsContact C-N 3.28Å; L169-S171 PolarHBondContact O-N 3.47Å; L169-L205 HydrophobicContact CD2-CD2 4.15Å; L169-L205 HydrophobicContact CG-CD2 4.33Å
170	E	82.2	Confident	81.1	Confident	105 Å²	105	56.5 Å²	56.5	49%	0.491	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-3.1	179.6	-71	180	-176	0	0	113.8	L143 Y148 K166 I168	L143-E170 WeakPolarHBondContact CD1-OE2 3.47Å; Y148-E170 HydrophobicContact CE1-CB 4.39Å; Y148-E170 PolarHBondContact OH-O 3.34Å; K166-E170 PolarHBondContact O-N 2.91Å; I168-E170 PolarHBondContact O-N 2.92Å
171	S	75.3	Confident	81.2	Confident	8 Å²	8	54.9 Å²	54.9	6%	0.056	30%	0.296	C	S	.	.			trans	-85.3	142.2	-175.9	73.2	0	0	0	0	113.1	I168 L169 D173 V174	I168-S171 PolarHBondContact O-N 3.45Å; I168-S171 PolarHBondContact O-OG 2.85Å; L169-S171 VanDerWaalsContact C-N 3.28Å; L169-S171 PolarHBondContact O-N 3.47Å; S171-D173 VanDerWaalsContact C-N 3.3Å; S171-D173 PolarHBondContact O-N 2.79Å; S171-V174 WeakPolarHBondContact O-CG2 3.3Å
172	N	74.9	Confident	81.1	Confident	151 Å²	151	53.7 Å²	53.7	81%	0.807	29%	0.29	S	S	*	.	S	Bend	trans	-72.7	-20.6	176.2	-66.1	-22.5	0	0	0	113.3
173	D	78.8	Confident	80.8	Confident	93 Å²	93	55.6 Å²	55.6	50%	0.497	29%	0.293	S	S	.	.			trans	-125.3	77.1	179.4	178.1	18.6	0	0	0	110.5	S171 G176 L177	S171-D173 VanDerWaalsContact C-N 3.3Å; S171-D173 PolarHBondContact O-N 2.79Å; D173-G176 PolarHBondContact OD1-N 3.25Å; D173-L177 WeakPolarHBondContact O-CB 3.37Å; D173-L177 WeakPolarHBondContact O-CD1 3.27Å; D173-L177 PolarHBondContact O-N 2.92Å
174	V	79.8	Confident	80.7	Confident	38 Å²	38	56.1 Å²	56.1	23%	0.23	30%	0.296	C	S	.	.	H	α-helix	trans	-66.5	-38.6	-176.3	-173.6	0	0	0	0	111.7	I168 S171 L178 L209	I168-V174 HydrophobicContact CG2-CG1 3.85Å; S171-V174 WeakPolarHBondContact O-CG2 3.3Å; V174-L178 HydrophobicContact CG1-CD1 3.8Å; V174-L178 HydrophobicContact CG1-CG 4.28Å; V174-L178 WeakPolarHBondContact O-CB 3.46Å; V174-L178 WeakPolarHBondContact O-CD1 3.32Å; V174-L178 WeakPolarHBondContact O-CG 3.5Å; V174-L178 PolarHBondContact O-N 3.29Å; V174-L209 HydrophobicContact CB-CD2 4.48Å; V174-L209 HydrophobicContact CG1-CD2 3.77Å
175	S	74.6	Confident	80.3	Confident	76 Å²	76	56 Å²	56	53%	0.531	30%	0.296	S	S	.	.	H	α-helix	trans	-68.2	-46.1	-177.4	-178.2	0	0	0	0	112.1	L177 L178 A179	S175-L177 PolarHBondContact O-N 2.98Å; S175-L178 PolarHBondContact O-N 3.28Å; S175-A179 PolarHBondContact O-N 2.73Å
176	G	78.3	Confident	79.8	Confident	32 Å²	32	53.9 Å²	53.9	33%	0.33	29%	0.286	S	S	.	.	H	α-helix	trans	-64.8	-38.8	177	0	0	0	0	0	112.9	D173 Y180	D173-G176 PolarHBondContact OD1-N 3.25Å; G176-Y180 WeakPolarHBondContact O-CB 3.33Å; G176-Y180 PolarHBondContact O-N 3.23Å
177	L	82.1	Confident	79.3	Confident	14 Å²	14	51.9 Å²	51.9	7%	0.073	29%	0.289	C	S	.	.	H	α-helix	trans	-66.6	-40.8	177.1	-109	92.1	0	0	0	112.8	Y148 I152 D173 S175 Y180 S181	Y148-L177 HydrophobicContact CG-CD2 4.4Å; I152-L177 HydrophobicContact CD1-CB 4.48Å; I152-L177 HydrophobicContact CD1-CD2 3.37Å; I152-L177 HydrophobicContact CD1-CG 3.98Å; I152-L177 HydrophobicContact CG1-CD2 4.29Å; D173-L177 WeakPolarHBondContact O-CB 3.37Å; D173-L177 WeakPolarHBondContact O-CD1 3.27Å; D173-L177 PolarHBondContact O-N 2.92Å; S175-L177 PolarHBondContact O-N 2.98Å; L177-Y180 PolarHBondContact O-N 2.65Å; L177-S181 WeakPolarHBondContact O-CB 3.2Å; L177-S181 PolarHBondContact O-N 3.45Å; L177-S181 PolarHBondContact O-OG 2.93Å
178	L	80.8	Confident	78.9	Confident	0 Å²	0	57 Å²	57	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-66.6	-38	178.8	-75.6	170.2	0	0	0	112.2	I168 V174 S175 S181 L182 L202 L205 Y206 L209	I168-L178 HydrophobicContact CD1-CD2 4.06Å; I168-L178 HydrophobicContact CG2-CD2 3.87Å; I168-L178 HydrophobicContact CG2-CG 4.04Å; V174-L178 HydrophobicContact CG1-CD1 3.8Å; V174-L178 HydrophobicContact CG1-CG 4.28Å; V174-L178 WeakPolarHBondContact O-CB 3.46Å; V174-L178 WeakPolarHBondContact O-CD1 3.32Å; V174-L178 WeakPolarHBondContact O-CG 3.5Å; V174-L178 PolarHBondContact O-N 3.29Å; S175-L178 PolarHBondContact O-N 3.28Å; L178-S181 WeakPolarHBondContact CA-OG 3.21Å; L178-S181 PolarHBondContact O-OG 3.15Å; L178-L182 WeakPolarHBondContact O-CG 3.32Å; L178-L182 PolarHBondContact O-N 2.99Å; L178-L182 VanDerWaalsContact O-N 3.09Å; L178-L202 HydrophobicContact CD2-CD2 3.47Å; L178-L202 VanDerWaalsContact CD2-CD2 3.47Å; L178-L205 HydrophobicContact CD2-CB 4.32Å; L178-L205 HydrophobicContact CD2-CD1 4.47Å; L178-Y206 VanDerWaalsContact C-OH 3.3Å; L178-Y206 HydrophobicContact CB-CE1 3.82Å; L178-Y206 HydrophobicContact CB-CE2 4.18Å; L178-Y206 VanDerWaalsContact CB-OH 3.29Å; L178-Y206 WeakPolarHBondContact CB-OH 3.49Å; L178-Y206 HydrophobicContact CD1-CD1 3.85Å; L178-Y206 HydrophobicContact CD1-CE1 3.7Å; L178-Y206 HydrophobicContact CD1-CG 4.37Å; L178-Y206 HydrophobicContact CD2-CE2 4.27Å; L178-Y206 HydrophobicContact CG-CE1 4.31Å; L178-Y206 PolarHBondContact O-OH 2.97Å; L178-L209 HydrophobicContact CD1-CD1 3.82Å
179	A	77.6	Confident	78.3	Confident	50 Å²	50	58.6 Å²	58.6	41%	0.413	32%	0.324	S	S	.	.	H	α-helix	trans	-66.8	-40.1	173	0	0	0	0	0	111.7	S175 K183	S175-A179 PolarHBondContact O-N 2.73Å; A179-K183 PolarHBondContact O-N 3.31Å; A179-K183 VanDerWaalsContact O-N 3.1Å
180	Y	82.8	Confident	77.7	Confident	90 Å²	90	58 Å²	58	35%	0.353	32%	0.318	S	S	.	.	H	α-helix	trans	-63.3	-45.6	175.1	175.6	-104.8	0	0	0	111.7	K149 I152 G176 L177 L182 K183 V184	K149-Y180 HydrophobicContact CB-CE1 4.26Å; K149-Y180 HydrophobicContact CG-CD1 4.47Å; K149-Y180 HydrophobicContact CG-CE1 4.3Å; I152-Y180 HydrophobicContact CG2-CE1 4.47Å; G176-Y180 WeakPolarHBondContact O-CB 3.33Å; G176-Y180 PolarHBondContact O-N 3.23Å; L177-Y180 PolarHBondContact O-N 2.65Å; Y180-L182 PolarHBondContact O-N 2.99Å; Y180-K183 WeakPolarHBondContact O-CB 3.32Å; Y180-K183 PolarHBondContact O-N 3.23Å; Y180-V184 HydrophobicContact CD1-CG2 4.22Å; Y180-V184 HydrophobicContact CD2-CG2 4.24Å; Y180-V184 HydrophobicContact CE1-CG2 3.78Å; Y180-V184 HydrophobicContact CE2-CG2 3.8Å; Y180-V184 HydrophobicContact CG-CG2 4.44Å; Y180-V184 WeakPolarHBondContact O-CG2 3.45Å; Y180-V184 PolarHBondContact O-N 3.04Å
181	S	82.8	Confident	77.3	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-63.7	-40.5	-179.5	68.5	0	0	0	0	111.6	L177 L178 K183 V184 C185 L202	L177-S181 WeakPolarHBondContact O-CB 3.2Å; L177-S181 PolarHBondContact O-N 3.45Å; L177-S181 PolarHBondContact O-OG 2.93Å; L178-S181 WeakPolarHBondContact CA-OG 3.21Å; L178-S181 PolarHBondContact O-OG 3.15Å; S181-K183 PolarHBondContact O-N 3.09Å; S181-V184 PolarHBondContact O-N 2.7Å; S181-C185 WeakPolarHBondContact O-CB 3.32Å; S181-C185 PolarHBondContact O-N 2.91Å; S181-C185 PolarHBondContact O-SG 3.16Å; S181-L202 WeakPolarHBondContact OG-CD2 3.49Å
182	L	79.6	Confident	77.3	Confident	17 Å²	17	56.2 Å²	56.2	9%	0.089	31%	0.309	C	S	.	.	H	α-helix	trans	-59.2	-47.2	171.7	-75.3	176.7	0	0	0	112.1	L178 Y180 V184 C185 M186 L199 L202 Y206 N216 C220	L178-L182 WeakPolarHBondContact O-CG 3.32Å; L178-L182 PolarHBondContact O-N 2.99Å; L178-L182 VanDerWaalsContact O-N 3.09Å; Y180-L182 PolarHBondContact O-N 2.99Å; L182-V184 VanDerWaalsContact C-N 3.31Å; L182-V184 PolarHBondContact O-N 3.35Å; L182-C185 PolarHBondContact O-N 2.68Å; L182-M186 WeakPolarHBondContact O-CB 3.38Å; L182-M186 VanDerWaalsContact O-CG 3.27Å; L182-M186 WeakPolarHBondContact O-CG 3.48Å; L182-M186 PolarHBondContact O-N 2.81Å; L182-L199 HydrophobicContact CD2-CD2 3.73Å; L182-L202 HydrophobicContact CD2-CD1 3.48Å; L182-L202 VanDerWaalsContact CD2-CD1 3.48Å; L182-L202 HydrophobicContact CG-CD1 4.08Å; L182-Y206 HydrophobicContact CD1-CE2 3.83Å; L182-Y206 VanDerWaalsContact CD1-OH 3.25Å; L182-Y206 WeakPolarHBondContact CD1-OH 3.4Å; L182-Y206 HydrophobicContact CG-CE2 4.38Å; L182-N216 HydrophobicContact CD1-CB 3.97Å; L182-C220 WeakPolarHBondContact CD2-SG 3.4Å
183	K	79.3	Confident	77.6	Confident	155 Å²	155	54.8 Å²	54.8	67%	0.674	30%	0.295	S	S	*	.	H	α-helix	trans	-60.1	-42	178.2	-173.4	178.9	179.3	-178.7	0	112	A179 Y180 S181 M186 S187	A179-K183 PolarHBondContact O-N 3.31Å; A179-K183 VanDerWaalsContact O-N 3.1Å; Y180-K183 WeakPolarHBondContact O-CB 3.32Å; Y180-K183 PolarHBondContact O-N 3.23Å; S181-K183 PolarHBondContact O-N 3.09Å; K183-M186 PolarHBondContact O-N 2.86Å; K183-S187 WeakPolarHBondContact O-CB 3.46Å; K183-S187 PolarHBondContact O-N 2.88Å; K183-S187 VanDerWaalsContact O-N 3.08Å; K183-S187 PolarHBondContact O-OG 3.3Å
184	V	80.7	Confident	77.7	Confident	19 Å²	19	50.9 Å²	50.9	12%	0.115	27%	0.274	C	S	.	.	H	α-helix	trans	-67.1	-44	176.9	176.3	0	0	0	0	110.7	L156 Y180 S181 L182 M186 S187 L188	L156-V184 HydrophobicContact CD1-CB 4.27Å; L156-V184 HydrophobicContact CD1-CG1 3.56Å; Y180-V184 HydrophobicContact CD1-CG2 4.22Å; Y180-V184 HydrophobicContact CD2-CG2 4.24Å; Y180-V184 HydrophobicContact CE1-CG2 3.78Å; Y180-V184 HydrophobicContact CE2-CG2 3.8Å; Y180-V184 HydrophobicContact CG-CG2 4.44Å; Y180-V184 WeakPolarHBondContact O-CG2 3.45Å; Y180-V184 PolarHBondContact O-N 3.04Å; S181-V184 PolarHBondContact O-N 2.7Å; L182-V184 VanDerWaalsContact C-N 3.31Å; L182-V184 PolarHBondContact O-N 3.35Å; V184-M186 PolarHBondContact O-N 3.07Å; V184-S187 PolarHBondContact O-N 3.29Å; V184-S187 PolarHBondContact O-OG 2.96Å; V184-L188 HydrophobicContact CG1-CB 4.22Å; V184-L188 HydrophobicContact CG1-CD2 4.19Å; V184-L188 WeakPolarHBondContact O-CB 3.38Å; V184-L188 PolarHBondContact O-N 3.41Å
185	C	78.1	Confident	77.8	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.3	-36.5	176.2	-69.1	0	0	0	0	112.1	S181 L182 M189 V198	S181-C185 WeakPolarHBondContact O-CB 3.32Å; S181-C185 PolarHBondContact O-N 2.91Å; S181-C185 PolarHBondContact O-SG 3.16Å; L182-C185 PolarHBondContact O-N 2.68Å; C185-M189 VanDerWaalsContact O-CB 3.26Å; C185-M189 WeakPolarHBondContact O-CB 3.32Å; C185-V198 WeakPolarHBondContact SG-CG1 3.35Å
186	M	74.4	Confident	78.3	Confident	35 Å²	35	48 Å²	48	17%	0.172	25%	0.25	C	C	.	.	H	α-helix	trans	-80.5	-25.9	-178.9	-69.1	-54.6	-60.7	0	0	114.2	L182 K183 V184 F223	L182-M186 WeakPolarHBondContact O-CB 3.38Å; L182-M186 VanDerWaalsContact O-CG 3.27Å; L182-M186 WeakPolarHBondContact O-CG 3.48Å; L182-M186 PolarHBondContact O-N 2.81Å; K183-M186 PolarHBondContact O-N 2.86Å; V184-M186 PolarHBondContact O-N 3.07Å; M186-F223 HydrophobicContact CE-CD1 3.9Å; M186-F223 HydrophobicContact CE-CD2 4.18Å; M186-F223 HydrophobicContact CE-CE1 3.29Å; M186-F223 HydrophobicContact CE-CE2 3.63Å; M186-F223 HydrophobicContact CE-CG 4.33Å; M186-F223 HydrophobicContact CE-CZ 3.16Å; M186-F223 HydrophobicContact SD-CD1 4.36Å; M186-F223 HydrophobicContact SD-CD2 3.9Å; M186-F223 HydrophobicContact SD-CE1 4.22Å; M186-F223 HydrophobicContact SD-CE2 3.76Å; M186-F223 HydrophobicContact SD-CG 4.23Å; M186-F223 HydrophobicContact SD-CZ 3.95Å
187	S	74.5	Confident	78.6	Confident	88 Å²	88	50 Å²	50	62%	0.615	25%	0.25	S	S	*	.	H	α-helix	trans	-98.7	-37.7	-176.3	53.7	0	0	0	0	114	K183 V184	K183-S187 WeakPolarHBondContact O-CB 3.46Å; K183-S187 PolarHBondContact O-N 2.88Å; K183-S187 VanDerWaalsContact O-N 3.08Å; K183-S187 PolarHBondContact O-OG 3.3Å; V184-S187 PolarHBondContact O-N 3.29Å; V184-S187 PolarHBondContact O-OG 2.96Å
188	L	74.1	Confident	78.8	Confident	109 Å²	109	49.3 Å²	49.3	57%	0.571	25%	0.247	S	C	*	.	H	α-helix	trans	-97.9	-30.2	-171.5	-163.4	72.2	0	0	0	112.9	V184 Q190	V184-L188 HydrophobicContact CG1-CB 4.22Å; V184-L188 HydrophobicContact CG1-CD2 4.19Å; V184-L188 WeakPolarHBondContact O-CB 3.38Å; V184-L188 PolarHBondContact O-N 3.41Å; L188-Q190 PolarHBondContact O-N 3.22Å
189	M	70.7	Confident	78.9	Confident	33 Å²	33	49.3 Å²	49.3	16%	0.163	25%	0.247	C	C	.	.			trans	-81.5	110.5	-172.6	-61.9	-65.6	163.2	0	0	112.3	L156 C185 F194 R195	L156-M189 HydrophobicContact CB-CE 3.54Å; L156-M189 HydrophobicContact CD1-CE 4.15Å; L156-M189 HydrophobicContact CD2-CE 3.93Å; L156-M189 HydrophobicContact CG-CE 4.06Å; C185-M189 VanDerWaalsContact O-CB 3.26Å; C185-M189 WeakPolarHBondContact O-CB 3.32Å; M189-F194 HydrophobicContact CE-CD1 4.42Å; M189-F194 HydrophobicContact CE-CE1 3.85Å; M189-F194 HydrophobicContact SD-CD1 3.7Å; M189-F194 HydrophobicContact SD-CE1 3.75Å; M189-R195 HydrophobicContact CB-CB 4.29Å; M189-R195 HydrophobicContact CB-CG 4.45Å
190	Q	69.7	Low	79.3	Confident	104 Å²	104	53.1 Å²	53.1	49%	0.486	25%	0.25	S	S	.	.			trans	-82.6	-31.4	176.5	-63.1	-178.4	-3	0	0	112.6	L188	L188-Q190 PolarHBondContact O-N 3.22Å
191	N	75.1	Confident	79.4	Confident	34 Å²	34	49.8 Å²	49.8	18%	0.182	24%	0.239	C	C	.	.			trans	-86.8	122.9	-177.6	-169.5	-31.1	0	0	0	111.5	K193 R195	N191-K193 PolarHBondContact OD1-N 3.35Å; N191-R195 VanDerWaalsContact O-CB 3.31Å; N191-R195 WeakPolarHBondContact O-CB 3.43Å; N191-R195 PolarHBondContact O-N 3.25Å; N191-R195 VanDerWaalsContact O-N 3.14Å
192	K	74.6	Confident	79.5	Confident	43 Å²	43	49.8 Å²	49.8	19%	0.187	24%	0.239	C	C	.	.	H	α-helix	trans	-65.7	-40.1	179.9	-173.9	-179.8	175.1	-173.2	0	113.1	R195 N196 M561	K192-R195 PolarHBondContact O-N 3.26Å; K192-N196 WeakPolarHBondContact O-CB 3.27Å; K192-N196 PolarHBondContact O-N 3.4Å; K192-N196 PolarHBondContact O-OD1 3.28Å; K192-M561 HydrophobicContact CB-SD 3.99Å
193	K	80.9	Confident	79.7	Confident	120 Å²	120	49.6 Å²	49.6	52%	0.522	24%	0.239	S	C	.	.	H	α-helix	trans	-62.5	-52.4	-176.1	-173.2	177.9	179.4	-179.5	0	110.6	N191 R195 N196 E197	N191-K193 PolarHBondContact OD1-N 3.35Å; K193-R195 PolarHBondContact O-N 3.03Å; K193-N196 PolarHBondContact O-N 2.81Å; K193-E197 PolarHBondContact O-N 3.4Å; K193-E197 VanDerWaalsContact O-N 3.13Å
194	F	81.3	Confident	79.9	Confident	12 Å²	12	48.9 Å²	48.9	5%	0.053	24%	0.236	C	C	.	.	H	α-helix	trans	-64.7	-41.3	177.9	-178.2	-113.8	0	0	0	112.3	R159 L161 M189 N196 E197 V198	R159-F194 VanDerWaalsContact CA-CZ 3.5Å; R159-F194 HydrophobicContact CB-CD2 4.08Å; R159-F194 HydrophobicContact CB-CE1 4.45Å; R159-F194 HydrophobicContact CB-CE2 3.58Å; R159-F194 HydrophobicContact CB-CZ 3.81Å; R159-F194 HydrophobicContact CG-CD1 4.26Å; R159-F194 HydrophobicContact CG-CD2 4.18Å; R159-F194 HydrophobicContact CG-CE1 4.04Å; R159-F194 HydrophobicContact CG-CE2 3.97Å; R159-F194 HydrophobicContact CG-CG 4.33Å; R159-F194 HydrophobicContact CG-CZ 3.91Å; L161-F194 HydrophobicContact CD2-CE2 4.17Å; M189-F194 HydrophobicContact CE-CD1 4.42Å; M189-F194 HydrophobicContact CE-CE1 3.85Å; M189-F194 HydrophobicContact SD-CD1 3.7Å; M189-F194 HydrophobicContact SD-CE1 3.75Å; F194-N196 VanDerWaalsContact C-N 3.28Å; F194-N196 PolarHBondContact O-N 3.43Å; F194-E197 PolarHBondContact O-N 3.34Å; F194-V198 HydrophobicContact CD1-CG2 4.26Å; F194-V198 HydrophobicContact CD2-CG2 4.36Å; F194-V198 HydrophobicContact CE1-CG2 3.77Å; F194-V198 HydrophobicContact CE2-CG2 3.87Å; F194-V198 HydrophobicContact CZ-CG2 3.53Å; F194-V198 WeakPolarHBondContact O-CG2 3.22Å; F194-V198 PolarHBondContact O-N 3.28Å
195	R	82.4	Confident	80	Confident	26 Å²	26	48.4 Å²	48.4	10%	0.098	23%	0.232	C	C	.	.	H	α-helix	trans	-56.6	-43.8	175	-172.5	-175.6	70.6	-172.5	4.6	111.6	M189 N191 K192 K193 V198 L199	M189-R195 HydrophobicContact CB-CB 4.29Å; M189-R195 HydrophobicContact CB-CG 4.45Å; N191-R195 VanDerWaalsContact O-CB 3.31Å; N191-R195 WeakPolarHBondContact O-CB 3.43Å; N191-R195 PolarHBondContact O-N 3.25Å; N191-R195 VanDerWaalsContact O-N 3.14Å; K192-R195 PolarHBondContact O-N 3.26Å; K193-R195 PolarHBondContact O-N 3.03Å; R195-V198 PolarHBondContact O-N 3.2Å; R195-L199 HydrophobicContact CG-CD1 4.06Å; R195-L199 HydrophobicContact CG-CG 4.46Å; R195-L199 WeakPolarHBondContact O-CB 3.41Å; R195-L199 VanDerWaalsContact O-CG 3.23Å; R195-L199 WeakPolarHBondContact O-CG 3.35Å; R195-L199 PolarHBondContact O-N 3.17Å
196	N	84.3	Confident	80.1	Confident	27 Å²	27	48.5 Å²	48.5	14%	0.144	23%	0.233	C	C	.	.	H	α-helix	trans	-66	-38.2	179.4	-70.4	8.1	0	0	0	111.8	K192 K193 F194 L199 R200 L224	K192-N196 WeakPolarHBondContact O-CB 3.27Å; K192-N196 PolarHBondContact O-N 3.4Å; K192-N196 PolarHBondContact O-OD1 3.28Å; K193-N196 PolarHBondContact O-N 2.81Å; F194-N196 VanDerWaalsContact C-N 3.28Å; F194-N196 PolarHBondContact O-N 3.43Å; N196-L199 PolarHBondContact O-N 3.19Å; N196-R200 WeakPolarHBondContact O-CG 3.32Å; N196-R200 PolarHBondContact O-N 3.05Å; N196-L224 HydrophobicContact CB-CD2 4.26Å
197	E	84.4	Confident	80.3	Confident	73 Å²	73	50.5 Å²	50.5	34%	0.341	24%	0.243	S	C	.	.	H	α-helix	trans	-63.1	-45.9	174.6	-70	173.5	-175.7	0	0	112.3	L161 K193 F194 L199 R200 V201	L161-E197 HydrophobicContact CD1-CB 4.09Å; K193-E197 PolarHBondContact O-N 3.4Å; K193-E197 VanDerWaalsContact O-N 3.13Å; F194-E197 PolarHBondContact O-N 3.34Å; E197-L199 VanDerWaalsContact C-N 3.35Å; E197-L199 PolarHBondContact O-N 3.49Å; E197-R200 PolarHBondContact O-N 3.25Å; E197-V201 PolarHBondContact O-N 3.39Å
198	V	86.1	Confident	80.7	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.5	-42.7	176.6	179.6	0	0	0	0	111.1	L156 L161 F164 C185 F194 R195 R200 V201 L202	L156-V198 HydrophobicContact CD2-CG1 4.27Å; L156-V198 HydrophobicContact CD2-CG2 4.31Å; L161-V198 HydrophobicContact CD2-CB 4.31Å; L161-V198 HydrophobicContact CD2-CG2 3.58Å; F164-V198 HydrophobicContact CE1-CG1 3.99Å; F164-V198 HydrophobicContact CZ-CG1 3.96Å; C185-V198 WeakPolarHBondContact SG-CG1 3.35Å; F194-V198 HydrophobicContact CD1-CG2 4.26Å; F194-V198 HydrophobicContact CD2-CG2 4.36Å; F194-V198 HydrophobicContact CE1-CG2 3.77Å; F194-V198 HydrophobicContact CE2-CG2 3.87Å; F194-V198 HydrophobicContact CZ-CG2 3.53Å; F194-V198 WeakPolarHBondContact O-CG2 3.22Å; F194-V198 PolarHBondContact O-N 3.28Å; R195-V198 PolarHBondContact O-N 3.2Å; V198-R200 VanDerWaalsContact C-N 3.33Å; V198-R200 PolarHBondContact O-N 3.07Å; V198-V201 PolarHBondContact O-N 3.36Å; V198-L202 HydrophobicContact CG1-CD1 4.1Å; V198-L202 HydrophobicContact CG1-CG 4.45Å; V198-L202 WeakPolarHBondContact O-CG 3.42Å; V198-L202 PolarHBondContact O-N 2.89Å
199	L	84.6	Confident	80.9	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62	-38	177.3	-72.3	170.5	0	0	0	112.2	L182 R195 N196 E197 V201 L202 V203 C220 F223 L224	L182-L199 HydrophobicContact CD2-CD2 3.73Å; R195-L199 HydrophobicContact CG-CD1 4.06Å; R195-L199 HydrophobicContact CG-CG 4.46Å; R195-L199 WeakPolarHBondContact O-CB 3.41Å; R195-L199 VanDerWaalsContact O-CG 3.23Å; R195-L199 WeakPolarHBondContact O-CG 3.35Å; R195-L199 PolarHBondContact O-N 3.17Å; N196-L199 PolarHBondContact O-N 3.19Å; E197-L199 VanDerWaalsContact C-N 3.35Å; E197-L199 PolarHBondContact O-N 3.49Å; L199-V201 VanDerWaalsContact C-N 3.33Å; L199-V201 PolarHBondContact O-N 3.48Å; L199-L202 PolarHBondContact O-N 2.78Å; L199-V203 WeakPolarHBondContact O-CG2 3.45Å; L199-V203 PolarHBondContact O-N 2.78Å; L199-C220 HydrophobicContact CD2-CB 4.22Å; L199-F223 HydrophobicContact CD1-CB 3.59Å; L199-F223 HydrophobicContact CD1-CG 4.41Å; L199-L224 HydrophobicContact CB-CD1 3.71Å; L199-L224 HydrophobicContact CB-CG 4.14Å
200	R	85.7	Confident	80.8	Confident	130 Å²	130	58 Å²	58	49%	0.491	27%	0.27	S	S	.	.	H	α-helix	trans	-62.5	-40.6	174.9	-73.7	176.6	-177.1	156.4	-0.7	112.1	N196 E197 V198 V203 K204 L224	N196-R200 WeakPolarHBondContact O-CG 3.32Å; N196-R200 PolarHBondContact O-N 3.05Å; E197-R200 PolarHBondContact O-N 3.25Å; V198-R200 VanDerWaalsContact C-N 3.33Å; V198-R200 PolarHBondContact O-N 3.07Å; R200-V203 PolarHBondContact O-N 3.4Å; R200-K204 WeakPolarHBondContact O-CG 3.39Å; R200-K204 PolarHBondContact O-N 3.38Å; R200-L224 HydrophobicContact CG-CD1 4.12Å; R200-L224 HydrophobicContact CG-CD2 3.42Å; R200-L224 VanDerWaalsContact CG-CD2 3.42Å; R200-L224 HydrophobicContact CG-CG 4.43Å
201	V	85.3	Confident	80.8	Confident	20 Å²	20	61.9 Å²	61.9	12%	0.121	29%	0.286	C	S	.	.	H	α-helix	trans	-65.7	-43	176.2	176.2	0	0	0	0	110.2	L161 F164 E165 E197 V198 L199 V203 K204 L205	L161-V201 HydrophobicContact CB-CG2 4.45Å; L161-V201 HydrophobicContact CD1-CG2 4.3Å; L161-V201 HydrophobicContact CD2-CG2 4.39Å; F164-V201 HydrophobicContact CD1-CG1 4.37Å; E165-V201 HydrophobicContact CB-CG1 4.4Å; E165-V201 HydrophobicContact CG-CG1 4.46Å; E197-V201 PolarHBondContact O-N 3.39Å; V198-V201 PolarHBondContact O-N 3.36Å; L199-V201 VanDerWaalsContact C-N 3.33Å; L199-V201 PolarHBondContact O-N 3.48Å; V201-V203 PolarHBondContact O-N 3.03Å; V201-K204 PolarHBondContact O-N 2.89Å; V201-L205 HydrophobicContact CG1-CD1 4.07Å; V201-L205 HydrophobicContact CG1-CG 4.46Å; V201-L205 WeakPolarHBondContact O-CG 3.38Å; V201-L205 PolarHBondContact O-N 3.47Å
202	L	83.7	Confident	80.6	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-60	-43.9	176.5	-74.4	172.3	0	0	0	112.4	F164 I168 L178 S181 L182 V198 L199 K204 L205 Y206	F164-L202 HydrophobicContact CE1-CD2 3.69Å; F164-L202 HydrophobicContact CE1-CG 3.91Å; F164-L202 HydrophobicContact CZ-CD1 4.27Å; F164-L202 HydrophobicContact CZ-CD2 3.71Å; F164-L202 HydrophobicContact CZ-CG 4.07Å; I168-L202 HydrophobicContact CD1-CD2 4.2Å; L178-L202 HydrophobicContact CD2-CD2 3.47Å; L178-L202 VanDerWaalsContact CD2-CD2 3.47Å; S181-L202 WeakPolarHBondContact OG-CD2 3.49Å; L182-L202 HydrophobicContact CD2-CD1 3.48Å; L182-L202 VanDerWaalsContact CD2-CD1 3.48Å; L182-L202 HydrophobicContact CG-CD1 4.08Å; V198-L202 HydrophobicContact CG1-CD1 4.1Å; V198-L202 HydrophobicContact CG1-CG 4.45Å; V198-L202 WeakPolarHBondContact O-CG 3.42Å; V198-L202 PolarHBondContact O-N 2.89Å; L199-L202 PolarHBondContact O-N 2.78Å; L202-K204 VanDerWaalsContact C-N 3.33Å; L202-K204 PolarHBondContact O-N 3.47Å; L202-L205 PolarHBondContact O-N 2.75Å; L202-Y206 HydrophobicContact CB-CD2 4.48Å; L202-Y206 HydrophobicContact CB-CE2 4.48Å; L202-Y206 WeakPolarHBondContact O-CD2 3.45Å; L202-Y206 PolarHBondContact O-N 3.43Å
203	V	83.6	Confident	80.5	Confident	14 Å²	14	62.7 Å²	62.7	9%	0.085	29%	0.294	C	S	.	.	H	α-helix	trans	-58.2	-45.2	176.2	170.2	0	0	0	0	111.4	L199 R200 V201 L205 Y206 M207 V217 C220 L221 L224	L199-V203 WeakPolarHBondContact O-CG2 3.45Å; L199-V203 PolarHBondContact O-N 2.78Å; R200-V203 PolarHBondContact O-N 3.4Å; V201-V203 PolarHBondContact O-N 3.03Å; V203-L205 VanDerWaalsContact C-N 3.34Å; V203-L205 PolarHBondContact O-N 3.15Å; V203-Y206 PolarHBondContact O-N 2.93Å; V203-M207 HydrophobicContact CG1-CE 4.12Å; V203-M207 HydrophobicContact CG1-SD 4.42Å; V203-M207 WeakPolarHBondContact O-CG 3.18Å; V203-M207 PolarHBondContact O-N 3.49Å; V203-V217 HydrophobicContact CG1-CG1 4.12Å; V203-C220 HydrophobicContact CG2-CB 3.35Å; V203-L221 HydrophobicContact CG2-CG 4.4Å; V203-L224 HydrophobicContact CG2-CD1 4.23Å
204	K	83.9	Confident	80	Confident	139 Å²	139	58.5 Å²	58.5	60%	0.604	28%	0.276	S	S	*	.	H	α-helix	trans	-61.1	-43.5	176.8	-69.5	176.3	-179	-178.4	0	111.8	R200 V201 L202 M207 N208	R200-K204 WeakPolarHBondContact O-CG 3.39Å; R200-K204 PolarHBondContact O-N 3.38Å; V201-K204 PolarHBondContact O-N 2.89Å; L202-K204 VanDerWaalsContact C-N 3.33Å; L202-K204 PolarHBondContact O-N 3.47Å; K204-M207 PolarHBondContact O-N 3.33Å; K204-N208 VanDerWaalsContact O-CG 3.29Å; K204-N208 PolarHBondContact O-N 3.29Å; K204-N208 PolarHBondContact O-ND2 3.25Å
205	L	82.6	Confident	79.7	Confident	9 Å²	9	59.9 Å²	59.9	5%	0.047	28%	0.284	C	S	.	.	H	α-helix	trans	-63.5	-44.3	178.1	-74.3	173	0	0	0	112.1	E165 I168 L169 L178 V201 L202 V203 M207 N208	E165-L205 HydrophobicContact CG-CD1 4.26Å; E165-L205 HydrophobicContact CG-CD2 3.86Å; E165-L205 HydrophobicContact CG-CG 4.35Å; I168-L205 HydrophobicContact CB-CD1 4.3Å; I168-L205 HydrophobicContact CD1-CD1 3.6Å; I168-L205 HydrophobicContact CG2-CD1 4.23Å; L169-L205 HydrophobicContact CD2-CD2 4.15Å; L169-L205 HydrophobicContact CG-CD2 4.33Å; L178-L205 HydrophobicContact CD2-CB 4.32Å; L178-L205 HydrophobicContact CD2-CD1 4.47Å; V201-L205 HydrophobicContact CG1-CD1 4.07Å; V201-L205 HydrophobicContact CG1-CG 4.46Å; V201-L205 WeakPolarHBondContact O-CG 3.38Å; V201-L205 PolarHBondContact O-N 3.47Å; L202-L205 PolarHBondContact O-N 2.75Å; V203-L205 VanDerWaalsContact C-N 3.34Å; V203-L205 PolarHBondContact O-N 3.15Å; L205-M207 VanDerWaalsContact C-N 3.32Å; L205-M207 PolarHBondContact O-N 3.13Å; L205-N208 PolarHBondContact O-N 3.32Å
206	Y	80.3	Confident	79.4	Confident	2 Å²	2	60 Å²	60	1%	0.008	29%	0.286	C	S	.	.	H	α-helix	trans	-63.2	-35.8	176.6	-83.4	-68.8	0	0	0	113.1	L178 L182 L202 V203 N208 L209 D213 N216 V217	L178-Y206 VanDerWaalsContact C-OH 3.3Å; L178-Y206 HydrophobicContact CB-CE1 3.82Å; L178-Y206 HydrophobicContact CB-CE2 4.18Å; L178-Y206 VanDerWaalsContact CB-OH 3.29Å; L178-Y206 WeakPolarHBondContact CB-OH 3.49Å; L178-Y206 HydrophobicContact CD1-CD1 3.85Å; L178-Y206 HydrophobicContact CD1-CE1 3.7Å; L178-Y206 HydrophobicContact CD1-CG 4.37Å; L178-Y206 HydrophobicContact CD2-CE2 4.27Å; L178-Y206 HydrophobicContact CG-CE1 4.31Å; L178-Y206 PolarHBondContact O-OH 2.97Å; L182-Y206 HydrophobicContact CD1-CE2 3.83Å; L182-Y206 VanDerWaalsContact CD1-OH 3.25Å; L182-Y206 WeakPolarHBondContact CD1-OH 3.4Å; L182-Y206 HydrophobicContact CG-CE2 4.38Å; L202-Y206 HydrophobicContact CB-CD2 4.48Å; L202-Y206 HydrophobicContact CB-CE2 4.48Å; L202-Y206 WeakPolarHBondContact O-CD2 3.45Å; L202-Y206 PolarHBondContact O-N 3.43Å; V203-Y206 PolarHBondContact O-N 2.93Å; Y206-N208 VanDerWaalsContact C-N 3.32Å; Y206-L209 HydrophobicContact CD1-CD1 4.04Å; Y206-D213 HydrophobicContact CD1-CB 4.06Å; Y206-D213 HydrophobicContact CE1-CB 4.18Å; Y206-N216 HydrophobicContact CD1-CB 4.46Å; Y206-N216 HydrophobicContact CE1-CB 3.84Å; Y206-N216 HydrophobicContact CE2-CB 3.97Å; Y206-N216 PolarHBondContact OH-ND2 3.3Å; Y206-V217 HydrophobicContact CD2-CG2 4.43Å; Y206-V217 HydrophobicContact CG-CG2 4.01Å
207	M	79.5	Confident	79.1	Confident	77 Å²	77	58.7 Å²	58.7	38%	0.379	28%	0.279	S	S	.	.	H	α-helix	trans	-69.6	-28.4	177.1	-74.7	-173.1	170.8	0	0	113.3	V203 K204 L205 L209 V217 I233	V203-M207 HydrophobicContact CG1-CE 4.12Å; V203-M207 HydrophobicContact CG1-SD 4.42Å; V203-M207 WeakPolarHBondContact O-CG 3.18Å; V203-M207 PolarHBondContact O-N 3.49Å; K204-M207 PolarHBondContact O-N 3.33Å; L205-M207 VanDerWaalsContact C-N 3.32Å; L205-M207 PolarHBondContact O-N 3.13Å; M207-L209 VanDerWaalsContact C-N 3.31Å; M207-V217 HydrophobicContact CE-CG1 4.34Å; M207-I233 HydrophobicContact CE-CD1 3.47Å; M207-I233 VanDerWaalsContact CE-CD1 3.47Å; M207-I233 HydrophobicContact CE-CG1 3.68Å
208	N	83.1	Confident	78.6	Confident	131 Å²	131	55.4 Å²	55.4	70%	0.701	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-0.5	-178.4	-68.8	-18.7	0	0	0	113.5	K204 L205 Y206	K204-N208 VanDerWaalsContact O-CG 3.29Å; K204-N208 PolarHBondContact O-N 3.29Å; K204-N208 PolarHBondContact O-ND2 3.25Å; L205-N208 PolarHBondContact O-N 3.32Å; Y206-N208 VanDerWaalsContact C-N 3.32Å
209	L	77.9	Confident	78	Confident	53 Å²	53	57.6 Å²	57.6	28%	0.277	27%	0.274	S	S	.	.	S	Bend	trans	-75	150.1	175.6	-66.9	173.5	0	0	0	111.8	V174 L178 Y206 M207 K211	V174-L209 HydrophobicContact CB-CD2 4.48Å; V174-L209 HydrophobicContact CG1-CD2 3.77Å; L178-L209 HydrophobicContact CD1-CD1 3.82Å; Y206-L209 HydrophobicContact CD1-CD1 4.04Å; M207-L209 VanDerWaalsContact C-N 3.31Å; L209-K211 PolarHBondContact O-N 3.24Å
210	E	69.1	Low	77.7	Confident	204 Å²	204	57.6 Å²	57.6	95%	0.953	28%	0.275	S	S	*	.	S	Bend	trans	-57.4	-31.4	176	-65.5	-176.5	170.6	0	0	113.1
211	K	68.8	Low	77.4	Confident	186 Å²	186	51.6 Å²	51.6	81%	0.809	25%	0.252	S	S	*	.	S	Bend	trans	-126.4	100.4	169.8	-69.7	-177.2	-179.2	176.9	0	108.1	L209 D213	L209-K211 PolarHBondContact O-N 3.24Å; K211-D213 PolarHBondContact O-N 3.43Å
212	P	69.9	Low	77.2	Confident	42 Å²	42	51 Å²	51	27%	0.273	25%	0.248	S	C	.	.			trans	-63.3	128.8	178.9	-20.2	31.2	0	0	0	110.5	F214	P212-F214 HydrophobicContact CB-CD1 4.5Å; P212-F214 HydrophobicContact CB-CD2 4.25Å; P212-F214 HydrophobicContact CB-CE1 4.05Å; P212-F214 HydrophobicContact CB-CE2 3.8Å; P212-F214 HydrophobicContact CB-CZ 3.71Å; P212-F214 HydrophobicContact CG-CE2 4.28Å; P212-F214 HydrophobicContact CG-CZ 4.01Å; P212-F214 VanDerWaalsContact O-CD2 3.22Å; P212-F214 WeakPolarHBondContact O-CD2 3.27Å; P212-F214 PolarHBondContact O-N 2.93Å
213	D	72.6	Confident	76.9	Confident	52 Å²	52	52.1 Å²	52.1	28%	0.278	25%	0.253	S	S	.	.			trans	-86.7	89	171.4	-171.6	-13.6	0	0	0	109.5	Y206 K211 I215 N216 V217	Y206-D213 HydrophobicContact CD1-CB 4.06Å; Y206-D213 HydrophobicContact CE1-CB 4.18Å; K211-D213 PolarHBondContact O-N 3.43Å; D213-I215 PolarHBondContact O-N 3.48Å; D213-I215 PolarHBondContact OD1-N 3.27Å; D213-N216 PolarHBondContact O-N 3.46Å; D213-N216 PolarHBondContact OD2-ND2 3.41Å; D213-V217 WeakPolarHBondContact O-CG2 3.45Å; D213-V217 PolarHBondContact O-N 3.13Å
214	F	71.4	Confident	76.7	Confident	31 Å²	31	52.1 Å²	52.1	14%	0.136	25%	0.253	C	S	.	.	H	α-helix	trans	-65.8	-21.6	-176.4	-62.2	-82.1	0	0	0	113.6	P212 C218 I233 L237 M245 I249	P212-F214 HydrophobicContact CB-CD1 4.5Å; P212-F214 HydrophobicContact CB-CD2 4.25Å; P212-F214 HydrophobicContact CB-CE1 4.05Å; P212-F214 HydrophobicContact CB-CE2 3.8Å; P212-F214 HydrophobicContact CB-CZ 3.71Å; P212-F214 HydrophobicContact CG-CE2 4.28Å; P212-F214 HydrophobicContact CG-CZ 4.01Å; P212-F214 VanDerWaalsContact O-CD2 3.22Å; P212-F214 WeakPolarHBondContact O-CD2 3.27Å; P212-F214 PolarHBondContact O-N 2.93Å; F214-C218 WeakPolarHBondContact O-CB 3.25Å; F214-C218 PolarHBondContact O-N 3.26Å; F214-C218 PolarHBondContact O-SG 3.3Å; F214-I233 HydrophobicContact CD1-CG2 3.51Å; F214-I233 HydrophobicContact CE1-CG2 3.87Å; F214-L237 HydrophobicContact CD1-CD1 4.22Å; F214-L237 HydrophobicContact CD1-CD2 4.48Å; F214-L237 HydrophobicContact CD2-CD2 4.13Å; F214-L237 HydrophobicContact CE1-CD1 4.46Å; F214-L237 HydrophobicContact CE1-CD2 4.08Å; F214-L237 HydrophobicContact CE1-CG 4.32Å; F214-L237 HydrophobicContact CE2-CD2 3.67Å; F214-L237 HydrophobicContact CG-CD1 4.29Å; F214-L237 HydrophobicContact CG-CD2 4.48Å; F214-L237 HydrophobicContact CZ-CD2 3.63Å; F214-L237 HydrophobicContact CZ-CG 4.35Å; F214-M245 HydrophobicContact CD2-CE 3.85Å; F214-M245 HydrophobicContact CD2-CG 4.34Å; F214-M245 HydrophobicContact CD2-SD 3.21Å; F214-M245 WeakPolarHBondContact CD2-SD 3.43Å; F214-M245 HydrophobicContact CE2-CE 4.41Å; F214-M245 HydrophobicContact CE2-SD 3.61Å; F214-M245 HydrophobicContact CG-SD 4.15Å; F214-I249 HydrophobicContact CB-CD1 3.58Å; F214-I249 HydrophobicContact CB-CG1 4.35Å; F214-I249 HydrophobicContact CG-CD1 4.32Å
215	I	74.2	Confident	76.6	Confident	41 Å²	41	49 Å²	49	21%	0.21	24%	0.242	C	C	.	.	H	α-helix	trans	-67.9	-50.7	179.1	-61.9	175.2	0	0	0	109.4	D213 V217 C218 Q219 K914	D213-I215 PolarHBondContact O-N 3.48Å; D213-I215 PolarHBondContact OD1-N 3.27Å; I215-V217 VanDerWaalsContact C-N 3.32Å; I215-V217 PolarHBondContact O-N 3.35Å; I215-C218 PolarHBondContact O-N 3.24Å; I215-Q219 WeakPolarHBondContact O-CG 3.39Å; I215-Q219 PolarHBondContact O-N 3.4Å; I215-K914 HydrophobicContact CD1-CD 4.29Å; I215-K914 HydrophobicContact CD1-CG 4.31Å
216	N	76.6	Confident	76.6	Confident	28 Å²	28	51.3 Å²	51.3	15%	0.15	26%	0.255	C	S	.	.	H	α-helix	trans	-66.8	-35.9	179	-71.3	-30.7	0	0	0	111.6	L182 Y206 D213 Q219 C220	L182-N216 HydrophobicContact CD1-CB 3.97Å; Y206-N216 HydrophobicContact CD1-CB 4.46Å; Y206-N216 HydrophobicContact CE1-CB 3.84Å; Y206-N216 HydrophobicContact CE2-CB 3.97Å; Y206-N216 PolarHBondContact OH-ND2 3.3Å; D213-N216 PolarHBondContact O-N 3.46Å; D213-N216 PolarHBondContact OD2-ND2 3.41Å; N216-Q219 PolarHBondContact O-N 3.08Å; N216-C220 PolarHBondContact O-N 3.04Å; N216-C220 PolarHBondContact O-SG 3.49Å
217	V	77.6	Confident	76.8	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.006	26%	0.264	C	S	.	.	H	α-helix	trans	-60.7	-46.5	172.9	172.9	0	0	0	0	111.1	V203 Y206 M207 D213 I215 Q219 C220 L221 I233	V203-V217 HydrophobicContact CG1-CG1 4.12Å; Y206-V217 HydrophobicContact CD2-CG2 4.43Å; Y206-V217 HydrophobicContact CG-CG2 4.01Å; M207-V217 HydrophobicContact CE-CG1 4.34Å; D213-V217 WeakPolarHBondContact O-CG2 3.45Å; D213-V217 PolarHBondContact O-N 3.13Å; I215-V217 VanDerWaalsContact C-N 3.32Å; I215-V217 PolarHBondContact O-N 3.35Å; V217-Q219 VanDerWaalsContact C-N 3.34Å; V217-Q219 PolarHBondContact O-N 2.85Å; V217-C220 WeakPolarHBondContact O-CB 3.45Å; V217-C220 PolarHBondContact O-N 3.42Å; V217-L221 HydrophobicContact CG1-CD1 3.64Å; V217-L221 HydrophobicContact CG1-CG 4.28Å; V217-L221 WeakPolarHBondContact O-CB 3.39Å; V217-L221 VanDerWaalsContact O-CG 3.3Å; V217-L221 WeakPolarHBondContact O-CG 3.3Å; V217-L221 PolarHBondContact O-N 3.38Å; V217-I233 HydrophobicContact CG1-CD1 3.57Å
218	C	73.4	Confident	77.1	Confident	3 Å²	3	55.5 Å²	55.5	2%	0.02	28%	0.276	C	S	.	.	H	α-helix	trans	-64.3	-39.5	178.8	-68.9	0	0	0	0	111.7	F214 I215 C220 L221 I222 I249	F214-C218 WeakPolarHBondContact O-CB 3.25Å; F214-C218 PolarHBondContact O-N 3.26Å; F214-C218 PolarHBondContact O-SG 3.3Å; I215-C218 PolarHBondContact O-N 3.24Å; C218-C220 VanDerWaalsContact C-N 3.34Å; C218-C220 PolarHBondContact O-N 3.48Å; C218-L221 PolarHBondContact O-N 3.41Å; C218-I222 VanDerWaalsContact O-CG1 3.23Å; C218-I222 WeakPolarHBondContact O-CG1 3.17Å; C218-I222 PolarHBondContact O-N 3.1Å; C218-I249 HydrophobicContact CB-CG2 4.38Å; C218-I249 WeakPolarHBondContact SG-CG2 3.42Å
219	Q	74.8	Confident	77.2	Confident	46 Å²	46	50.8 Å²	50.8	22%	0.215	26%	0.255	C	S	.	.	H	α-helix	trans	-58.7	-45.8	173.1	-71.3	178.1	6.2	0	0	111.9	I215 N216 V217 L221 I222 F223	I215-Q219 WeakPolarHBondContact O-CG 3.39Å; I215-Q219 PolarHBondContact O-N 3.4Å; N216-Q219 PolarHBondContact O-N 3.08Å; V217-Q219 VanDerWaalsContact C-N 3.34Å; V217-Q219 PolarHBondContact O-N 2.85Å; Q219-L221 VanDerWaalsContact C-N 3.34Å; Q219-L221 PolarHBondContact O-N 2.7Å; Q219-I222 PolarHBondContact O-N 2.83Å; Q219-F223 WeakPolarHBondContact O-CD2 3.38Å; Q219-F223 PolarHBondContact O-N 3.1Å
220	C	78.6	Confident	77.5	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.007	24%	0.242	C	C	.	.	H	α-helix	trans	-60.5	-45.5	176.4	-63.2	0	0	0	0	111.6	L182 L199 V203 N216 V217 C218 I222 F223 L224	L182-C220 WeakPolarHBondContact CD2-SG 3.4Å; L199-C220 HydrophobicContact CD2-CB 4.22Å; V203-C220 HydrophobicContact CG2-CB 3.35Å; N216-C220 PolarHBondContact O-N 3.04Å; N216-C220 PolarHBondContact O-SG 3.49Å; V217-C220 WeakPolarHBondContact O-CB 3.45Å; V217-C220 PolarHBondContact O-N 3.42Å; C218-C220 VanDerWaalsContact C-N 3.34Å; C218-C220 PolarHBondContact O-N 3.48Å; C220-I222 VanDerWaalsContact C-N 3.31Å; C220-I222 PolarHBondContact O-N 2.88Å; C220-F223 PolarHBondContact O-N 3.36Å; C220-F223 VanDerWaalsContact O-N 3.09Å; C220-L224 WeakPolarHBondContact O-CD1 3.33Å; C220-L224 PolarHBondContact O-N 3.43Å
221	L	79.5	Confident	78.1	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-64	-34.5	-178.6	-73.2	169	0	0	0	112.9	V203 V217 C218 Q219 L224 D225 D226 A229 V230 I233	V203-L221 HydrophobicContact CG2-CG 4.4Å; V217-L221 HydrophobicContact CG1-CD1 3.64Å; V217-L221 HydrophobicContact CG1-CG 4.28Å; V217-L221 WeakPolarHBondContact O-CB 3.39Å; V217-L221 VanDerWaalsContact O-CG 3.3Å; V217-L221 WeakPolarHBondContact O-CG 3.3Å; V217-L221 PolarHBondContact O-N 3.38Å; C218-L221 PolarHBondContact O-N 3.41Å; Q219-L221 VanDerWaalsContact C-N 3.34Å; Q219-L221 PolarHBondContact O-N 2.7Å; L221-L224 PolarHBondContact O-N 3.05Å; L221-D225 PolarHBondContact O-N 3.22Å; L221-D225 VanDerWaalsContact O-N 3.07Å; L221-D226 HydrophobicContact CD2-CB 4.26Å; L221-D226 PolarHBondContact O-N 2.96Å; L221-A229 HydrophobicContact CD1-CB 4.36Å; L221-A229 HydrophobicContact CD2-CB 3.64Å; L221-V230 HydrophobicContact CB-CG2 3.57Å; L221-V230 HydrophobicContact CD1-CG2 3.55Å; L221-V230 HydrophobicContact CG-CG2 4.11Å; L221-I233 HydrophobicContact CD1-CD1 3.41Å; L221-I233 VanDerWaalsContact CD1-CD1 3.41Å
222	I	80.2	Confident	78.9	Confident	7 Å²	7	34 Å²	34	4%	0.036	18%	0.182	C	C	.	.	H	α-helix	trans	-62.9	-42.7	172.1	-65.8	163.6	0	0	0	110.5	C218 Q219 C220 L224 D225 L253 A257	C218-I222 VanDerWaalsContact O-CG1 3.23Å; C218-I222 WeakPolarHBondContact O-CG1 3.17Å; C218-I222 PolarHBondContact O-N 3.1Å; Q219-I222 PolarHBondContact O-N 2.83Å; C220-I222 VanDerWaalsContact C-N 3.31Å; C220-I222 PolarHBondContact O-N 2.88Å; I222-L224 VanDerWaalsContact C-N 3.26Å; I222-L224 PolarHBondContact O-N 3.37Å; I222-D225 PolarHBondContact O-N 3.09Å; I222-L253 HydrophobicContact CD1-CD2 4.06Å; I222-L253 HydrophobicContact CG1-CD2 4Å; I222-A257 HydrophobicContact CD1-CB 4.41Å; I222-A257 HydrophobicContact CG1-CB 4.18Å; I222-A257 HydrophobicContact CG2-CB 4.43Å
223	F	77.2	Confident	79.5	Confident	24 Å²	24	32.1 Å²	32.1	11%	0.105	17%	0.17	C	C	.	.	H	α-helix	trans	-71	-24.3	178	-69.7	-60.8	0	0	0	113.9	M186 L199 Q219 C220 D225 H755	M186-F223 HydrophobicContact CE-CD1 3.9Å; M186-F223 HydrophobicContact CE-CD2 4.18Å; M186-F223 HydrophobicContact CE-CE1 3.29Å; M186-F223 HydrophobicContact CE-CE2 3.63Å; M186-F223 HydrophobicContact CE-CG 4.33Å; M186-F223 HydrophobicContact CE-CZ 3.16Å; M186-F223 HydrophobicContact SD-CD1 4.36Å; M186-F223 HydrophobicContact SD-CD2 3.9Å; M186-F223 HydrophobicContact SD-CE1 4.22Å; M186-F223 HydrophobicContact SD-CE2 3.76Å; M186-F223 HydrophobicContact SD-CG 4.23Å; M186-F223 HydrophobicContact SD-CZ 3.95Å; L199-F223 HydrophobicContact CD1-CB 3.59Å; L199-F223 HydrophobicContact CD1-CG 4.41Å; Q219-F223 WeakPolarHBondContact O-CD2 3.38Å; Q219-F223 PolarHBondContact O-N 3.1Å; C220-F223 PolarHBondContact O-N 3.36Å; C220-F223 VanDerWaalsContact O-N 3.09Å; F223-D225 VanDerWaalsContact C-N 3.34Å; F223-H755 AromaticContact CD1-ND1 3.75Å; F223-H755 HydrophobicContact CE1-CB 4.33Å; F223-H755 AromaticContact CE1-ND1 3.17Å; F223-H755 WeakPolarHBondContact CE1-ND1 3.5Å; F223-H755 HydrophobicContact CZ-CB 4.17Å; F223-H755 AromaticContact CZ-ND1 3.81Å
224	L	80.8	Confident	79.9	Confident	13 Å²	13	29.7 Å²	29.7	7%	0.068	16%	0.157	C	C	.	.	H	α-helix	trans	-80.7	-15.1	175.4	-86.1	149.5	0	0	0	113.1	N196 L199 R200 V203 C220 L221 I222 D226	N196-L224 HydrophobicContact CB-CD2 4.26Å; L199-L224 HydrophobicContact CB-CD1 3.71Å; L199-L224 HydrophobicContact CB-CG 4.14Å; R200-L224 HydrophobicContact CG-CD1 4.12Å; R200-L224 HydrophobicContact CG-CD2 3.42Å; R200-L224 VanDerWaalsContact CG-CD2 3.42Å; R200-L224 HydrophobicContact CG-CG 4.43Å; V203-L224 HydrophobicContact CG2-CD1 4.23Å; C220-L224 WeakPolarHBondContact O-CD1 3.33Å; C220-L224 PolarHBondContact O-N 3.43Å; L221-L224 PolarHBondContact O-N 3.05Å; I222-L224 VanDerWaalsContact C-N 3.26Å; I222-L224 PolarHBondContact O-N 3.37Å; L224-D226 HydrophobicContact CB-CB 4.37Å; L224-D226 PolarHBondContact O-N 2.75Å
225	D	80.4	Confident	80.4	Confident	73 Å²	73	31.3 Å²	31.3	39%	0.39	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	36.3	-173	-70	-40	0	0	0	112.4	L221 I222 F223 P227	L221-D225 PolarHBondContact O-N 3.22Å; L221-D225 VanDerWaalsContact O-N 3.07Å; I222-D225 PolarHBondContact O-N 3.09Å; F223-D225 VanDerWaalsContact C-N 3.34Å; D225-P227 WeakPolarHBondContact O-CD 3.31Å
226	D	83.3	Confident	80.9	Confident	59 Å²	59	35.2 Å²	35.2	32%	0.316	18%	0.18	S	C	.	.			trans	-102.8	87.6	-178	-74.6	-30.6	0	0	0	112.3	L221 L224 Q228	L221-D226 HydrophobicContact CD2-CB 4.26Å; L221-D226 PolarHBondContact O-N 2.96Å; L224-D226 HydrophobicContact CB-CB 4.37Å; L224-D226 PolarHBondContact O-N 2.75Å; D226-Q228 PolarHBondContact O-N 3.33Å
227	P	84.7	Confident	81.1	Confident	29 Å²	29	33.9 Å²	33.9	19%	0.188	17%	0.173	C	C	.	.	H	α-helix	trans	-71.7	-28.8	-173.5	27.3	-35.7	0	0	0	113.9	D225 V230 S231 F261 V265	D225-P227 WeakPolarHBondContact O-CD 3.31Å; P227-V230 PolarHBondContact O-N 2.97Å; P227-S231 PolarHBondContact O-N 3.26Å; P227-S231 VanDerWaalsContact O-N 3.14Å; P227-S231 PolarHBondContact O-OG 3.37Å; P227-F261 HydrophobicContact CB-CD2 4.11Å; P227-F261 HydrophobicContact CB-CE2 3.86Å; P227-F261 HydrophobicContact CB-CZ 4.2Å; P227-V265 HydrophobicContact CB-CG2 3.8Å
228	Q	85.5	Confident	81.3	Confident	137 Å²	137	34.7 Å²	34.7	64%	0.64	18%	0.178	S	C	*	.	H	α-helix	trans	-65.5	-44	-178.6	-69.4	179.8	-23.1	0	0	112	D226 V230 S231 D232	D226-Q228 PolarHBondContact O-N 3.33Å; Q228-V230 VanDerWaalsContact C-N 3.27Å; Q228-V230 PolarHBondContact O-N 3.2Å; Q228-S231 WeakPolarHBondContact CA-OG 3.46Å; Q228-S231 PolarHBondContact O-N 2.84Å; Q228-S231 PolarHBondContact O-OG 2.92Å; Q228-D232 VanDerWaalsContact O-CG 3.22Å; Q228-D232 PolarHBondContact O-N 3.36Å
229	A	84.2	Confident	81.8	Confident	32 Å²	32	41.3 Å²	41.3	26%	0.264	21%	0.206	S	C	.	.	H	α-helix	trans	-64.2	-33.4	179.2	0	0	0	0	0	112.2	L221 I233	L221-A229 HydrophobicContact CD1-CB 4.36Å; L221-A229 HydrophobicContact CD2-CB 3.64Å; A229-I233 WeakPolarHBondContact O-CD1 3.42Å; A229-I233 WeakPolarHBondContact O-CG1 3.49Å; A229-I233 PolarHBondContact O-N 3.18Å; A229-I233 VanDerWaalsContact O-N 3.16Å
230	V	84.4	Confident	82	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68.4	-44	174.4	174.3	0	0	0	0	111.4	L221 P227 Q228 D232 I233 L234 L253 F261	L221-V230 HydrophobicContact CB-CG2 3.57Å; L221-V230 HydrophobicContact CD1-CG2 3.55Å; L221-V230 HydrophobicContact CG-CG2 4.11Å; P227-V230 PolarHBondContact O-N 2.97Å; Q228-V230 VanDerWaalsContact C-N 3.27Å; Q228-V230 PolarHBondContact O-N 3.2Å; V230-D232 VanDerWaalsContact C-N 3.3Å; V230-D232 PolarHBondContact O-N 3.1Å; V230-I233 PolarHBondContact O-N 2.93Å; V230-L234 HydrophobicContact CG1-CD1 4.1Å; V230-L234 HydrophobicContact CG1-CG 4.44Å; V230-L234 WeakPolarHBondContact O-CG 3.39Å; V230-L234 PolarHBondContact O-N 3Å; V230-L253 HydrophobicContact CG1-CD1 3.56Å; V230-L253 HydrophobicContact CG1-CD2 4.08Å; V230-L253 HydrophobicContact CG1-CG 4.47Å; V230-F261 HydrophobicContact CB-CZ 4.28Å; V230-F261 HydrophobicContact CG2-CE1 4.22Å; V230-F261 HydrophobicContact CG2-CZ 3.73Å
231	S	83.1	Confident	81.9	Confident	8 Å²	8	50.4 Å²	50.4	6%	0.056	25%	0.252	C	S	.	.	H	α-helix	trans	-61	-40	176.4	48	0	0	0	0	112	P227 Q228 I233 L234 E235	P227-S231 PolarHBondContact O-N 3.26Å; P227-S231 VanDerWaalsContact O-N 3.14Å; P227-S231 PolarHBondContact O-OG 3.37Å; Q228-S231 WeakPolarHBondContact CA-OG 3.46Å; Q228-S231 PolarHBondContact O-N 2.84Å; Q228-S231 PolarHBondContact O-OG 2.92Å; S231-I233 VanDerWaalsContact C-N 3.33Å; S231-I233 PolarHBondContact O-N 3.48Å; S231-L234 PolarHBondContact O-N 2.98Å; S231-E235 WeakPolarHBondContact O-CB 3.35Å; S231-E235 PolarHBondContact O-N 3.29Å
232	D	84.4	Confident	81.9	Confident	82 Å²	82	54 Å²	54	44%	0.439	27%	0.272	S	S	.	.	H	α-helix	trans	-65.2	-36.9	178.3	-63.7	-12.8	0	0	0	112	Q228 V230 K236	Q228-D232 VanDerWaalsContact O-CG 3.22Å; Q228-D232 PolarHBondContact O-N 3.36Å; V230-D232 VanDerWaalsContact C-N 3.3Å; V230-D232 PolarHBondContact O-N 3.1Å; D232-K236 WeakPolarHBondContact O-CG 3.47Å; D232-K236 PolarHBondContact O-N 3.39Å; D232-K236 VanDerWaalsContact O-N 3.07Å
233	I	82.3	Confident	81.9	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-67.6	-46.9	175.5	-69.8	164.5	0	0	0	110.8	M207 F214 V217 L221 A229 V230 S231 E235 K236 L237	M207-I233 HydrophobicContact CE-CD1 3.47Å; M207-I233 VanDerWaalsContact CE-CD1 3.47Å; M207-I233 HydrophobicContact CE-CG1 3.68Å; F214-I233 HydrophobicContact CD1-CG2 3.51Å; F214-I233 HydrophobicContact CE1-CG2 3.87Å; V217-I233 HydrophobicContact CG1-CD1 3.57Å; L221-I233 HydrophobicContact CD1-CD1 3.41Å; L221-I233 VanDerWaalsContact CD1-CD1 3.41Å; A229-I233 WeakPolarHBondContact O-CD1 3.42Å; A229-I233 WeakPolarHBondContact O-CG1 3.49Å; A229-I233 PolarHBondContact O-N 3.18Å; A229-I233 VanDerWaalsContact O-N 3.16Å; V230-I233 PolarHBondContact O-N 2.93Å; S231-I233 VanDerWaalsContact C-N 3.33Å; S231-I233 PolarHBondContact O-N 3.48Å; I233-E235 VanDerWaalsContact C-N 3.26Å; I233-E235 PolarHBondContact O-N 3Å; I233-K236 PolarHBondContact O-N 3.43Å; I233-L237 HydrophobicContact CG2-CD1 4.09Å; I233-L237 WeakPolarHBondContact O-CG 3.4Å; I233-L237 PolarHBondContact O-N 3.23Å
234	L	81.6	Confident	82	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-59.3	-41.2	177.6	-73.6	173.3	0	0	0	110.7	V230 S231 L237 V238 A246 I249 L253 V265 L269	V230-L234 HydrophobicContact CG1-CD1 4.1Å; V230-L234 HydrophobicContact CG1-CG 4.44Å; V230-L234 WeakPolarHBondContact O-CG 3.39Å; V230-L234 PolarHBondContact O-N 3Å; S231-L234 PolarHBondContact O-N 2.98Å; L234-L237 PolarHBondContact O-N 3.41Å; L234-V238 WeakPolarHBondContact O-CG2 3.46Å; L234-V238 PolarHBondContact O-N 2.72Å; L234-A246 HydrophobicContact CD2-CB 4.41Å; L234-I249 HydrophobicContact CD2-CB 4.24Å; L234-I249 HydrophobicContact CD2-CG2 3.83Å; L234-L253 HydrophobicContact CD1-CD1 4.26Å; L234-V265 HydrophobicContact CD1-CG1 4.34Å; L234-L269 HydrophobicContact CD1-CD1 4.4Å
235	E	82.4	Confident	82	Confident	65 Å²	65	56.6 Å²	56.6	30%	0.304	29%	0.286	S	S	.	.	H	α-helix	trans	-64.3	-41.6	176.6	-163.9	-165.9	165.8	0	0	112.5	S231 I233 L237 V238 K239	S231-E235 WeakPolarHBondContact O-CB 3.35Å; S231-E235 PolarHBondContact O-N 3.29Å; I233-E235 VanDerWaalsContact C-N 3.26Å; I233-E235 PolarHBondContact O-N 3Å; E235-L237 VanDerWaalsContact C-N 3.34Å; E235-L237 PolarHBondContact O-N 2.88Å; E235-V238 PolarHBondContact O-N 3.27Å; E235-K239 VanDerWaalsContact CD-NZ 3.3Å; E235-K239 WeakPolarHBondContact O-CG 3.44Å; E235-K239 PolarHBondContact O-N 3.29Å; E235-K239 WeakPolarHBondContact OE1-CE 3.3Å; E235-K239 IonicContact OE1-NZ 3.71Å; E235-K239 PolarHBondContact OE1-NZ 3.41Å; E235-K239 IonicContact OE2-NZ 2.7Å
236	K	83.4	Confident	82.1	Confident	122 Å²	122	53.1 Å²	53.1	53%	0.53	27%	0.267	S	S	.	.	H	α-helix	trans	-60.7	-43.5	174.8	-74.4	176.2	-173.6	177.7	0	111.7	D232 I233 V238 K239 E240	D232-K236 WeakPolarHBondContact O-CG 3.47Å; D232-K236 PolarHBondContact O-N 3.39Å; D232-K236 VanDerWaalsContact O-N 3.07Å; I233-K236 PolarHBondContact O-N 3.43Å; K236-V238 VanDerWaalsContact C-N 3.3Å; K236-V238 PolarHBondContact O-N 3.08Å; K236-K239 PolarHBondContact O-N 3.45Å; K236-E240 WeakPolarHBondContact O-CG 3.46Å; K236-E240 PolarHBondContact O-N 2.91Å
237	L	81.3	Confident	82.2	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-64.9	-34	178.3	-71.2	172.7	0	0	0	112.8	F214 I233 L234 E235 E240 D241 N242 M245 A246 I249	F214-L237 HydrophobicContact CD1-CD1 4.22Å; F214-L237 HydrophobicContact CD1-CD2 4.48Å; F214-L237 HydrophobicContact CD2-CD2 4.13Å; F214-L237 HydrophobicContact CE1-CD1 4.46Å; F214-L237 HydrophobicContact CE1-CD2 4.08Å; F214-L237 HydrophobicContact CE1-CG 4.32Å; F214-L237 HydrophobicContact CE2-CD2 3.67Å; F214-L237 HydrophobicContact CG-CD1 4.29Å; F214-L237 HydrophobicContact CG-CD2 4.48Å; F214-L237 HydrophobicContact CZ-CD2 3.63Å; F214-L237 HydrophobicContact CZ-CG 4.35Å; I233-L237 HydrophobicContact CG2-CD1 4.09Å; I233-L237 WeakPolarHBondContact O-CG 3.4Å; I233-L237 PolarHBondContact O-N 3.23Å; L234-L237 PolarHBondContact O-N 3.41Å; E235-L237 VanDerWaalsContact C-N 3.34Å; E235-L237 PolarHBondContact O-N 2.88Å; L237-E240 PolarHBondContact O-N 3.24Å; L237-D241 PolarHBondContact O-N 3.44Å; L237-N242 HydrophobicContact CD2-CB 4.36Å; L237-N242 PolarHBondContact O-N 3.32Å; L237-M245 HydrophobicContact CD1-CG 4.45Å; L237-M245 HydrophobicContact CD2-CG 4.5Å; L237-M245 HydrophobicContact CD2-SD 3.91Å; L237-A246 HydrophobicContact CB-CB 4.39Å; L237-I249 HydrophobicContact CD1-CD1 3.31Å
238	V	82.3	Confident	82	Confident	17 Å²	17	49.3 Å²	49.3	10%	0.103	25%	0.245	C	C	.	.	H	α-helix	trans	-69.2	-41.2	173.8	173.6	0	0	0	0	110.8	L234 E235 K236 E240 D241 M326	L234-V238 WeakPolarHBondContact O-CG2 3.46Å; L234-V238 PolarHBondContact O-N 2.72Å; E235-V238 PolarHBondContact O-N 3.27Å; K236-V238 VanDerWaalsContact C-N 3.3Å; K236-V238 PolarHBondContact O-N 3.08Å; V238-E240 PolarHBondContact O-N 2.83Å; V238-D241 PolarHBondContact O-N 3.38Å; V238-D241 VanDerWaalsContact O-N 3.16Å; V238-M326 HydrophobicContact CG2-CE 3.46Å; V238-M326 VanDerWaalsContact CG2-CE 3.46Å; V238-M326 HydrophobicContact CG2-SD 3.81Å
239	K	82.5	Confident	81.9	Confident	142 Å²	142	42.8 Å²	42.8	62%	0.617	22%	0.215	S	C	*	.	H	α-helix	trans	-64.3	-28.5	175.5	-73.3	172	-177.7	165.1	0	113.2	E235 K236 D241	E235-K239 VanDerWaalsContact CD-NZ 3.3Å; E235-K239 WeakPolarHBondContact O-CG 3.44Å; E235-K239 PolarHBondContact O-N 3.29Å; E235-K239 WeakPolarHBondContact OE1-CE 3.3Å; E235-K239 IonicContact OE1-NZ 3.71Å; E235-K239 PolarHBondContact OE1-NZ 3.41Å; E235-K239 IonicContact OE2-NZ 2.7Å; K236-K239 PolarHBondContact O-N 3.45Å; K239-D241 VanDerWaalsContact C-N 3.33Å
240	E	80.4	Confident	82	Confident	118 Å²	118	41.3 Å²	41.3	55%	0.551	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	6.8	176.9	-69.3	178.2	-176.2	0	0	113.6	K236 L237 V238 N242	K236-E240 WeakPolarHBondContact O-CG 3.46Å; K236-E240 PolarHBondContact O-N 2.91Å; L237-E240 PolarHBondContact O-N 3.24Å; V238-E240 PolarHBondContact O-N 2.83Å; E240-N242 PolarHBondContact O-N 2.92Å; E240-N242 VanDerWaalsContact O-N 3.11Å
241	D	75.7	Confident	82	Confident	120 Å²	120	41.6 Å²	41.6	64%	0.642	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.5	19.3	-176.6	-73.3	-37.8	0	0	0	114.8	L237 V238 K239 L243	L237-D241 PolarHBondContact O-N 3.44Å; V238-D241 PolarHBondContact O-N 3.38Å; V238-D241 VanDerWaalsContact O-N 3.16Å; K239-D241 VanDerWaalsContact C-N 3.33Å; D241-L243 VanDerWaalsContact C-N 3.29Å; D241-L243 PolarHBondContact O-N 3.08Å
242	N	79.9	Confident	82	Confident	81 Å²	81	41.9 Å²	41.9	43%	0.433	20%	0.204	S	C	.	.			trans	-86.8	57	180	-83.4	-36.2	0	0	0	112.7	L237 E240 L244 M245 A246	L237-N242 HydrophobicContact CD2-CB 4.36Å; L237-N242 PolarHBondContact O-N 3.32Å; E240-N242 PolarHBondContact O-N 2.92Å; E240-N242 VanDerWaalsContact O-N 3.11Å; N242-L244 PolarHBondContact O-N 3.5Å; N242-M245 PolarHBondContact O-N 2.82Å; N242-A246 PolarHBondContact O-N 3.18Å
243	L	80.1	Confident	82	Confident	20 Å²	20	38 Å²	38	11%	0.105	18%	0.183	C	C	.	.	H	α-helix	trans	-61.3	-35.7	-173.8	-62.2	176.1	0	0	0	114.6	D241 M245 A246 Y247 Q322	D241-L243 VanDerWaalsContact C-N 3.29Å; D241-L243 PolarHBondContact O-N 3.08Å; L243-M245 VanDerWaalsContact C-N 3.28Å; L243-M245 PolarHBondContact O-N 3.46Å; L243-A246 PolarHBondContact O-N 3.19Å; L243-Y247 HydrophobicContact CB-CE2 4.42Å; L243-Y247 VanDerWaalsContact O-CG 3.29Å; L243-Y247 PolarHBondContact O-N 3.33Å; L243-Q322 HydrophobicContact CD1-CG 4.28Å; L243-Q322 HydrophobicContact CD2-CB 4.26Å; L243-Q322 HydrophobicContact CD2-CG 4.1Å
244	L	79.6	Confident	82.1	Confident	33 Å²	33	40 Å²	40	17%	0.173	19%	0.191	C	C	.	.	H	α-helix	trans	-63.1	-38.5	-178.9	-81.4	71.6	0	0	0	111.5	N242 Q248 K794 I923 K925	N242-L244 PolarHBondContact O-N 3.5Å; L244-Q248 PolarHBondContact O-N 3.27Å; L244-Q248 VanDerWaalsContact O-N 3.15Å; L244-K794 HydrophobicContact CD1-CB 4.5Å; L244-K794 HydrophobicContact CD1-CD 4.22Å; L244-K794 HydrophobicContact CD1-CG 3.99Å; L244-I923 HydrophobicContact CB-CG2 4.06Å; L244-I923 HydrophobicContact CD2-CG2 3.97Å; L244-I923 HydrophobicContact CG-CG2 3.81Å; L244-K925 HydrophobicContact CD2-CB 4.21Å; L244-K925 HydrophobicContact CD2-CG 4.38Å
245	M	80.2	Confident	82	Confident	45 Å²	45	42.6 Å²	42.6	22%	0.222	20%	0.203	C	C	.	.	H	α-helix	trans	-72.1	-41.1	178.4	-172.5	174.8	-106.6	0	0	110.7	F214 L237 N242 L243 Y247 Q248 I249 F913	F214-M245 HydrophobicContact CD2-CE 3.85Å; F214-M245 HydrophobicContact CD2-CG 4.34Å; F214-M245 HydrophobicContact CD2-SD 3.21Å; F214-M245 WeakPolarHBondContact CD2-SD 3.43Å; F214-M245 HydrophobicContact CE2-CE 4.41Å; F214-M245 HydrophobicContact CE2-SD 3.61Å; F214-M245 HydrophobicContact CG-SD 4.15Å; L237-M245 HydrophobicContact CD1-CG 4.45Å; L237-M245 HydrophobicContact CD2-CG 4.5Å; L237-M245 HydrophobicContact CD2-SD 3.91Å; N242-M245 PolarHBondContact O-N 2.82Å; L243-M245 VanDerWaalsContact C-N 3.28Å; L243-M245 PolarHBondContact O-N 3.46Å; M245-Y247 PolarHBondContact O-N 3.48Å; M245-Q248 PolarHBondContact O-N 3.28Å; M245-I249 HydrophobicContact CG-CD1 4.18Å; M245-I249 WeakPolarHBondContact O-CD1 3.38Å; M245-I249 VanDerWaalsContact O-CG1 3.29Å; M245-I249 WeakPolarHBondContact O-CG1 3.31Å; M245-I249 PolarHBondContact O-N 2.91Å; M245-F913 HydrophobicContact CB-CE1 4.02Å; M245-F913 HydrophobicContact CB-CZ 4.17Å; M245-F913 HydrophobicContact CE-CE1 3.74Å; M245-F913 HydrophobicContact CE-CZ 3.81Å; M245-F913 HydrophobicContact CG-CE1 4.09Å; M245-F913 HydrophobicContact CG-CZ 4.5Å
246	A	83.4	Confident	81.9	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.1	-43.9	173.5	0	0	0	0	0	112	L234 L237 N242 L243 I249 C250 M326	L234-A246 HydrophobicContact CD2-CB 4.41Å; L237-A246 HydrophobicContact CB-CB 4.39Å; N242-A246 PolarHBondContact O-N 3.18Å; L243-A246 PolarHBondContact O-N 3.19Å; A246-I249 PolarHBondContact O-N 3.35Å; A246-C250 PolarHBondContact O-N 3.4Å; A246-C250 PolarHBondContact O-SG 3.16Å; A246-M326 HydrophobicContact CB-SD 4.18Å
247	Y	83.8	Confident	81.9	Confident	3 Å²	3	34.8 Å²	34.8	1%	0.012	17%	0.172	C	C	.	.	H	α-helix	trans	-63.2	-43.3	177	-65.6	-20.5	0	0	0	112.6	L243 M245 I249 C250 F251 K325 M326 I329 L796	L243-Y247 HydrophobicContact CB-CE2 4.42Å; L243-Y247 VanDerWaalsContact O-CG 3.29Å; L243-Y247 PolarHBondContact O-N 3.33Å; M245-Y247 PolarHBondContact O-N 3.48Å; Y247-I249 VanDerWaalsContact C-N 3.3Å; Y247-I249 PolarHBondContact O-N 3.28Å; Y247-C250 PolarHBondContact O-N 3.34Å; Y247-F251 WeakPolarHBondContact O-CD2 3.43Å; Y247-F251 PolarHBondContact O-N 3.42Å; Y247-K325 HydrophobicContact CE1-CB 4.23Å; Y247-K325 VanDerWaalsContact OH-CD 3.3Å; Y247-K325 WeakPolarHBondContact OH-CD 3.49Å; Y247-M326 HydrophobicContact CD1-CG 4.17Å; Y247-M326 HydrophobicContact CE1-CG 3.96Å; Y247-I329 HydrophobicContact CD1-CD1 3.47Å; Y247-I329 VanDerWaalsContact CD1-CD1 3.47Å; Y247-I329 HydrophobicContact CE1-CD1 4.1Å; Y247-I329 HydrophobicContact CG-CD1 3.84Å; Y247-L796 HydrophobicContact CD2-CD2 3.86Å; Y247-L796 HydrophobicContact CE2-CD2 4.24Å; Y247-L796 HydrophobicContact CE2-CG 4.46Å; Y247-L796 HydrophobicContact CG-CD2 4.28Å
248	Q	81.8	Confident	81.9	Confident	4 Å²	4	36.2 Å²	36.2	2%	0.019	18%	0.182	C	C	.	.	H	α-helix	trans	-62.4	-40.1	176.5	-171.4	64	50.2	0	0	111.7	L244 M245 F251 D252 K914 I921 I923	L244-Q248 PolarHBondContact O-N 3.27Å; L244-Q248 VanDerWaalsContact O-N 3.15Å; M245-Q248 PolarHBondContact O-N 3.28Å; Q248-F251 PolarHBondContact O-N 3.01Å; Q248-D252 PolarHBondContact NE2-OD1 3.06Å; Q248-D252 WeakPolarHBondContact O-CB 3.42Å; Q248-D252 PolarHBondContact O-N 3.47Å; Q248-K914 HydrophobicContact CG-CD 4.19Å; Q248-I921 PolarHBondContact NE2-O 2.85Å; Q248-I923 HydrophobicContact CB-CG1 4.34Å; Q248-I923 VanDerWaalsContact OE1-N 3.16Å
249	I	83	Confident	81.8	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-62.6	-44.9	175.1	-68.9	162.4	0	0	0	110.4	F214 C218 L234 L237 M245 A246 Y247 F251 D252 L253	F214-I249 HydrophobicContact CB-CD1 3.58Å; F214-I249 HydrophobicContact CB-CG1 4.35Å; F214-I249 HydrophobicContact CG-CD1 4.32Å; C218-I249 HydrophobicContact CB-CG2 4.38Å; C218-I249 WeakPolarHBondContact SG-CG2 3.42Å; L234-I249 HydrophobicContact CD2-CB 4.24Å; L234-I249 HydrophobicContact CD2-CG2 3.83Å; L237-I249 HydrophobicContact CD1-CD1 3.31Å; M245-I249 HydrophobicContact CG-CD1 4.18Å; M245-I249 WeakPolarHBondContact O-CD1 3.38Å; M245-I249 VanDerWaalsContact O-CG1 3.29Å; M245-I249 WeakPolarHBondContact O-CG1 3.31Å; M245-I249 PolarHBondContact O-N 2.91Å; A246-I249 PolarHBondContact O-N 3.35Å; Y247-I249 VanDerWaalsContact C-N 3.3Å; Y247-I249 PolarHBondContact O-N 3.28Å; I249-F251 VanDerWaalsContact C-N 3.32Å; I249-F251 PolarHBondContact O-N 2.93Å; I249-D252 PolarHBondContact O-N 3.33Å; I249-L253 HydrophobicContact CG2-CD1 3.72Å; I249-L253 HydrophobicContact CG2-CG 4.04Å; I249-L253 VanDerWaalsContact O-CB 3.31Å; I249-L253 WeakPolarHBondContact O-CB 3.36Å; I249-L253 WeakPolarHBondContact O-CG 3.43Å; I249-L253 PolarHBondContact O-N 3.17Å
250	C	86	Confident	81.8	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-60.4	-40.4	177.6	-67.4	0	0	0	0	112.3	A246 Y247 Y254 I329 L330	A246-C250 PolarHBondContact O-N 3.4Å; A246-C250 PolarHBondContact O-SG 3.16Å; Y247-C250 PolarHBondContact O-N 3.34Å; C250-Y254 WeakPolarHBondContact O-CB 3.41Å; C250-Y254 PolarHBondContact O-N 3.47Å; C250-I329 HydrophobicContact CB-CB 4.04Å; C250-I329 HydrophobicContact CB-CG2 3.52Å; C250-L330 HydrophobicContact CB-CD2 3.95Å; C250-L330 HydrophobicContact CB-CG 4.15Å
251	F	85.3	Confident	81.9	Confident	7 Å²	7	28.8 Å²	28.8	3%	0.031	15%	0.148	C	C	.	.	H	α-helix	trans	-66.2	-43.2	174.2	-76.4	-62.6	0	0	0	112.4	Y247 Q248 I249 L253 Y254 E255 I329 L792 L796 I921 I923	Y247-F251 WeakPolarHBondContact O-CD2 3.43Å; Y247-F251 PolarHBondContact O-N 3.42Å; Q248-F251 PolarHBondContact O-N 3.01Å; I249-F251 VanDerWaalsContact C-N 3.32Å; I249-F251 PolarHBondContact O-N 2.93Å; F251-L253 VanDerWaalsContact C-N 3.33Å; F251-L253 PolarHBondContact O-N 2.88Å; F251-Y254 PolarHBondContact O-N 3.22Å; F251-E255 PolarHBondContact O-N 3.12Å; F251-I329 HydrophobicContact CD1-CG2 3.63Å; F251-I329 HydrophobicContact CD2-CG2 4.1Å; F251-I329 HydrophobicContact CE1-CG1 4.47Å; F251-I329 HydrophobicContact CE1-CG2 3.64Å; F251-I329 HydrophobicContact CE2-CD1 4.08Å; F251-I329 HydrophobicContact CE2-CG1 4.34Å; F251-I329 HydrophobicContact CE2-CG2 4.09Å; F251-I329 HydrophobicContact CG-CG2 3.86Å; F251-I329 HydrophobicContact CZ-CD1 4.24Å; F251-I329 HydrophobicContact CZ-CG1 4.02Å; F251-I329 HydrophobicContact CZ-CG2 3.86Å; F251-L792 HydrophobicContact CE2-CD1 3.98Å; F251-L792 HydrophobicContact CZ-CD1 3.74Å; F251-L796 HydrophobicContact CE2-CD2 4.19Å; F251-L796 HydrophobicContact CZ-CD2 4.43Å; F251-I921 HydrophobicContact CD1-CB 4.25Å; F251-I921 HydrophobicContact CD1-CD1 3.72Å; F251-I921 HydrophobicContact CD1-CG2 4.08Å; F251-I921 HydrophobicContact CD2-CG2 3.95Å; F251-I921 HydrophobicContact CE1-CD1 3.65Å; F251-I921 HydrophobicContact CE1-CG2 4.02Å; F251-I921 HydrophobicContact CE2-CG2 3.91Å; F251-I921 HydrophobicContact CG-CB 4.32Å; F251-I921 HydrophobicContact CG-CG2 4.06Å; F251-I921 HydrophobicContact CZ-CD1 4.49Å; F251-I921 HydrophobicContact CZ-CG2 3.94Å; F251-I923 HydrophobicContact CD2-CD1 4.28Å; F251-I923 HydrophobicContact CE2-CD1 3.97Å
252	D	82.8	Confident	82.3	Confident	13 Å²	13	23.2 Å²	23.2	7%	0.07	12%	0.119	C	C	.	.	H	α-helix	trans	-65.5	-37.9	178.1	-74.7	-0.3	0	0	0	111.5	Q248 I249 S256 K914	Q248-D252 PolarHBondContact NE2-OD1 3.06Å; Q248-D252 WeakPolarHBondContact O-CB 3.42Å; Q248-D252 PolarHBondContact O-N 3.47Å; I249-D252 PolarHBondContact O-N 3.33Å; D252-S256 WeakPolarHBondContact O-CB 3.26Å; D252-S256 PolarHBondContact O-N 3.19Å; D252-S256 VanDerWaalsContact O-N 3.07Å; D252-S256 PolarHBondContact O-OG 3.17Å; D252-K914 IonicContact OD1-NZ 3.03Å; D252-K914 PolarHBondContact OD1-NZ 2.9Å; D252-K914 IonicContact OD2-NZ 3.67Å; D252-K914 PolarHBondContact OD2-NZ 3.23Å
253	L	83.2	Confident	82.5	Confident	1 Å²	1	21.3 Å²	21.3	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-62.8	-47.1	172.9	-75.3	171.7	0	0	0	110.5	I222 V230 L234 I249 F251 E255 S256 A257 F261 L262 L330	I222-L253 HydrophobicContact CD1-CD2 4.06Å; I222-L253 HydrophobicContact CG1-CD2 4Å; V230-L253 HydrophobicContact CG1-CD1 3.56Å; V230-L253 HydrophobicContact CG1-CD2 4.08Å; V230-L253 HydrophobicContact CG1-CG 4.47Å; L234-L253 HydrophobicContact CD1-CD1 4.26Å; I249-L253 HydrophobicContact CG2-CD1 3.72Å; I249-L253 HydrophobicContact CG2-CG 4.04Å; I249-L253 VanDerWaalsContact O-CB 3.31Å; I249-L253 WeakPolarHBondContact O-CB 3.36Å; I249-L253 WeakPolarHBondContact O-CG 3.43Å; I249-L253 PolarHBondContact O-N 3.17Å; F251-L253 VanDerWaalsContact C-N 3.33Å; F251-L253 PolarHBondContact O-N 2.88Å; L253-E255 PolarHBondContact O-N 2.94Å; L253-S256 PolarHBondContact O-N 2.76Å; L253-A257 WeakPolarHBondContact O-CA 3.41Å; L253-A257 WeakPolarHBondContact O-CB 3.48Å; L253-A257 PolarHBondContact O-N 3.07Å; L253-F261 HydrophobicContact CD2-CE1 4.08Å; L253-L262 HydrophobicContact CB-CD2 4.21Å; L253-L330 HydrophobicContact CB-CD2 4.2Å; L253-L330 HydrophobicContact CD1-CD2 4.23Å
254	Y	84.8	Confident	82.7	Confident	47 Å²	47	22.1 Å²	22.1	18%	0.184	12%	0.119	C	C	.	.	H	α-helix	trans	-62	-41.4	178.6	177.5	-99.2	0	0	0	112.5	C250 F251 L262 G332 H454	C250-Y254 WeakPolarHBondContact O-CB 3.41Å; C250-Y254 PolarHBondContact O-N 3.47Å; F251-Y254 PolarHBondContact O-N 3.22Å; Y254-L262 HydrophobicContact CD2-CD1 4.02Å; Y254-G332 VanDerWaalsContact CZ-CA 3.43Å; Y254-H454 AromaticContact CE2-NE2 3.51Å; Y254-H454 AromaticContact CZ-NE2 3.52Å; Y254-H454 PolarHBondContact OH-CE1 3.17Å; Y254-H454 PolarHBondContact OH-NE2 3.43Å
255	E	81.1	Confident	83	Confident	55 Å²	55	20.6 Å²	20.6	26%	0.257	11%	0.111	S	C	.	.	H	α-helix	trans	-72.9	-27.2	179.6	-169.9	175.7	170.9	0	0	113	F251 L253 R752	F251-E255 PolarHBondContact O-N 3.12Å; L253-E255 PolarHBondContact O-N 2.94Å; E255-R752 IonicContact OE1-CZ 2.85Å; E255-R752 IonicContact OE1-NH1 3.1Å; E255-R752 PolarHBondContact OE1-NH1 3.39Å; E255-R752 IonicContact OE2-NH1 2.7Å
256	S	80.4	Confident	83.2	Confident	6 Å²	6	19.8 Å²	19.8	4%	0.042	11%	0.107	C	C	.	.	H	α-helix	trans	-112.2	-30.4	-168.5	-54.9	0	0	0	0	114.9	D252 L253 T753 H755	D252-S256 WeakPolarHBondContact O-CB 3.26Å; D252-S256 PolarHBondContact O-N 3.19Å; D252-S256 VanDerWaalsContact O-N 3.07Å; D252-S256 PolarHBondContact O-OG 3.17Å; L253-S256 PolarHBondContact O-N 2.76Å; S256-T753 WeakPolarHBondContact OG-CG2 3.43Å; S256-T753 PolarHBondContact OG-OG1 3.36Å; S256-H755 PolarHBondContact O-CD2 3.46Å
257	A	81.3	Confident	83.3	Confident	16 Å²	16	25.6 Å²	25.6	13%	0.132	13%	0.134	C	C	.	.	S	Bend	trans	-83.6	161.4	-173.7	0	0	0	0	0	112.4	I222 L253 F261 L262	I222-A257 HydrophobicContact CD1-CB 4.41Å; I222-A257 HydrophobicContact CG1-CB 4.18Å; I222-A257 HydrophobicContact CG2-CB 4.43Å; L253-A257 WeakPolarHBondContact O-CA 3.41Å; L253-A257 WeakPolarHBondContact O-CB 3.48Å; L253-A257 PolarHBondContact O-N 3.07Å; A257-F261 HydrophobicContact CB-CB 4.32Å; A257-F261 HydrophobicContact CB-CD1 3.69Å; A257-F261 HydrophobicContact CB-CE1 4.4Å; A257-F261 HydrophobicContact CB-CG 4.27Å; A257-L262 HydrophobicContact CB-CD2 4.1Å; A257-L262 HydrophobicContact CB-CG 4.18Å
258	S	81.5	Confident	83.3	Confident	31 Å²	31	27.4 Å²	27.4	22%	0.217	14%	0.144	C	C	.	.			trans	-74.2	154	172.3	66.8	0	0	0	0	111.1	Q260 F261 L262	S258-Q260 VanDerWaalsContact C-N 3.28Å; S258-Q260 PolarHBondContact O-N 3.18Å; S258-F261 WeakPolarHBondContact O-CB 3.47Å; S258-F261 PolarHBondContact O-N 3.24Å; S258-F261 VanDerWaalsContact O-N 3.08Å; S258-F261 WeakPolarHBondContact OG-CB 3.42Å; S258-F261 PolarHBondContact OG-N 3.23Å; S258-L262 PolarHBondContact O-N 2.92Å
259	Q	80.9	Confident	83.2	Confident	29 Å²	29	28 Å²	28	14%	0.136	15%	0.147	C	C	.	.	H	α-helix	trans	-59.1	-41.4	179.5	-169.5	61.5	35.6	0	0	112	F261 L262 S263 T489	Q259-F261 VanDerWaalsContact C-N 3.3Å; Q259-F261 PolarHBondContact O-N 3.05Å; Q259-L262 PolarHBondContact O-N 3.19Å; Q259-S263 PolarHBondContact O-N 3.12Å; Q259-S263 PolarHBondContact O-OG 3.16Å; Q259-T489 HydrophobicContact CG-CG2 4.5Å
260	Q	81.8	Confident	83	Confident	84 Å²	84	32.8 Å²	32.8	39%	0.393	17%	0.17	S	C	.	.	H	α-helix	trans	-57.3	-44.1	175.2	-175	-179.3	-7	0	0	111.6	S258 S263 S264 G488	S258-Q260 VanDerWaalsContact C-N 3.28Å; S258-Q260 PolarHBondContact O-N 3.18Å; Q260-S263 PolarHBondContact O-N 3.33Å; Q260-S264 PolarHBondContact O-N 3.16Å; Q260-S264 PolarHBondContact O-OG 3.45Å; Q260-G488 PolarHBondContact N-O 3.13Å
261	F	84	Confident	82.5	Confident	9 Å²	9	36.7 Å²	36.7	4%	0.039	19%	0.193	C	C	.	.	H	α-helix	trans	-62.1	-46.5	177.9	-173.2	-87.9	0	0	0	111.4	P227 V230 L253 A257 S258 Q259 S263 S264 V265	P227-F261 HydrophobicContact CB-CD2 4.11Å; P227-F261 HydrophobicContact CB-CE2 3.86Å; P227-F261 HydrophobicContact CB-CZ 4.2Å; V230-F261 HydrophobicContact CB-CZ 4.28Å; V230-F261 HydrophobicContact CG2-CE1 4.22Å; V230-F261 HydrophobicContact CG2-CZ 3.73Å; L253-F261 HydrophobicContact CD2-CE1 4.08Å; A257-F261 HydrophobicContact CB-CB 4.32Å; A257-F261 HydrophobicContact CB-CD1 3.69Å; A257-F261 HydrophobicContact CB-CE1 4.4Å; A257-F261 HydrophobicContact CB-CG 4.27Å; S258-F261 WeakPolarHBondContact O-CB 3.47Å; S258-F261 PolarHBondContact O-N 3.24Å; S258-F261 VanDerWaalsContact O-N 3.08Å; S258-F261 WeakPolarHBondContact OG-CB 3.42Å; S258-F261 PolarHBondContact OG-N 3.23Å; Q259-F261 VanDerWaalsContact C-N 3.3Å; Q259-F261 PolarHBondContact O-N 3.05Å; F261-S263 PolarHBondContact O-N 2.95Å; F261-S264 PolarHBondContact O-N 3.08Å; F261-V265 HydrophobicContact CD1-CG2 3.93Å; F261-V265 HydrophobicContact CE1-CG2 3.64Å; F261-V265 HydrophobicContact CZ-CG2 4.19Å; F261-V265 WeakPolarHBondContact O-CG2 3.46Å; F261-V265 PolarHBondContact O-N 3.5Å
262	L	84.3	Confident	81.2	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.016	22%	0.217	C	C	.	.	H	α-helix	trans	-60.5	-45.8	177.5	-66.1	172.4	0	0	0	111.7	L253 Y254 A257 S258 Q259 S264 V265 I266 L330	L253-L262 HydrophobicContact CB-CD2 4.21Å; Y254-L262 HydrophobicContact CD2-CD1 4.02Å; A257-L262 HydrophobicContact CB-CD2 4.1Å; A257-L262 HydrophobicContact CB-CG 4.18Å; S258-L262 PolarHBondContact O-N 2.92Å; Q259-L262 PolarHBondContact O-N 3.19Å; L262-S264 VanDerWaalsContact C-N 3.34Å; L262-S264 PolarHBondContact O-N 2.96Å; L262-V265 PolarHBondContact O-N 3.4Å; L262-I266 WeakPolarHBondContact O-CB 3.39Å; L262-I266 WeakPolarHBondContact O-CD1 3.25Å; L262-I266 VanDerWaalsContact O-CG1 3.24Å; L262-I266 WeakPolarHBondContact O-CG1 3.49Å; L262-I266 PolarHBondContact O-N 3.14Å; L262-L330 HydrophobicContact CD2-CD2 4.11Å
263	S	84.1	Confident	79.6	Confident	41 Å²	41	41.7 Å²	41.7	29%	0.287	23%	0.232	S	C	.	.	H	α-helix	trans	-60.8	-41.1	176.7	-65.3	0	0	0	0	112.4	Q259 Q260 F261 I266 Q267	Q259-S263 PolarHBondContact O-N 3.12Å; Q259-S263 PolarHBondContact O-OG 3.16Å; Q260-S263 PolarHBondContact O-N 3.33Å; F261-S263 PolarHBondContact O-N 2.95Å; S263-I266 PolarHBondContact O-N 3.16Å; S263-Q267 WeakPolarHBondContact O-CB 3.31Å; S263-Q267 WeakPolarHBondContact O-CG 3.31Å; S263-Q267 PolarHBondContact O-N 3.26Å
264	S	84.4	Confident	77.4	Confident	36 Å²	36	45.5 Å²	45.5	25%	0.252	26%	0.256	S	S	.	.	H	α-helix	trans	-66.5	-40.3	175.5	-64.7	0	0	0	0	112.7	Q260 F261 L262 Q267 N268	Q260-S264 PolarHBondContact O-N 3.16Å; Q260-S264 PolarHBondContact O-OG 3.45Å; F261-S264 PolarHBondContact O-N 3.08Å; L262-S264 VanDerWaalsContact C-N 3.34Å; L262-S264 PolarHBondContact O-N 2.96Å; S264-Q267 PolarHBondContact O-N 2.95Å; S264-N268 WeakPolarHBondContact O-CB 3.23Å; S264-N268 PolarHBondContact O-N 3.4Å; S264-N268 PolarHBondContact O-ND2 3.42Å; S264-N268 PolarHBondContact O-OD1 3.38Å
265	V	85.1	Confident	74.8	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-64.1	-44.2	175.6	173.6	0	0	0	0	110.7	P227 L234 F261 L262 Q267 N268 L269 L330	P227-V265 HydrophobicContact CB-CG2 3.8Å; L234-V265 HydrophobicContact CD1-CG1 4.34Å; F261-V265 HydrophobicContact CD1-CG2 3.93Å; F261-V265 HydrophobicContact CE1-CG2 3.64Å; F261-V265 HydrophobicContact CZ-CG2 4.19Å; F261-V265 WeakPolarHBondContact O-CG2 3.46Å; F261-V265 PolarHBondContact O-N 3.5Å; L262-V265 PolarHBondContact O-N 3.4Å; V265-Q267 PolarHBondContact O-N 3.5Å; V265-N268 PolarHBondContact O-N 3.17Å; V265-L269 HydrophobicContact CG1-CD1 4.01Å; V265-L269 HydrophobicContact CG1-CG 4.36Å; V265-L269 VanDerWaalsContact O-CG 3.29Å; V265-L269 WeakPolarHBondContact O-CG 3.28Å; V265-L269 PolarHBondContact O-N 3.01Å; V265-L330 HydrophobicContact CG1-CD1 4.12Å
266	I	84.3	Confident	72.3	Confident	28 Å²	28	52.5 Å²	52.5	14%	0.144	30%	0.304	C	S	.	.	H	α-helix	trans	-59.5	-46.4	176.3	-68.3	164	0	0	0	110.5	L262 S263 N268 L269 H270 I327 L330	L262-I266 WeakPolarHBondContact O-CB 3.39Å; L262-I266 WeakPolarHBondContact O-CD1 3.25Å; L262-I266 VanDerWaalsContact O-CG1 3.24Å; L262-I266 WeakPolarHBondContact O-CG1 3.49Å; L262-I266 PolarHBondContact O-N 3.14Å; S263-I266 PolarHBondContact O-N 3.16Å; I266-N268 PolarHBondContact O-N 3.4Å; I266-L269 PolarHBondContact O-N 3.22Å; I266-H270 PolarHBondContact O-CD2 3.47Å; I266-H270 PolarHBondContact O-N 3.26Å; I266-I327 HydrophobicContact CG2-CG2 4.32Å; I266-L330 HydrophobicContact CD1-CB 3.97Å; I266-L330 HydrophobicContact CG1-CB 3.83Å; I266-L330 HydrophobicContact CG1-CD1 4.22Å
267	Q	84.7	Confident	69.8	Low	123 Å²	123	57.5 Å²	57.5	58%	0.575	34%	0.336	S	S	*	.	H	α-helix	trans	-59.8	-45.3	176.3	-75.7	177	-4.1	0	0	112.2	S263 S264 V265 L269 H270 T271	S263-Q267 WeakPolarHBondContact O-CB 3.31Å; S263-Q267 WeakPolarHBondContact O-CG 3.31Å; S263-Q267 PolarHBondContact O-N 3.26Å; S264-Q267 PolarHBondContact O-N 2.95Å; V265-Q267 PolarHBondContact O-N 3.5Å; Q267-L269 PolarHBondContact O-N 3.16Å; Q267-H270 WeakPolarHBondContact O-CB 3.45Å; Q267-H270 PolarHBondContact O-N 3.22Å; Q267-H270 VanDerWaalsContact O-N 3.16Å; Q267-T271 PolarHBondContact O-N 3.23Å; Q267-T271 PolarHBondContact O-OG1 2.86Å; Q267-T271 VanDerWaalsContact O-OG1 3.04Å
268	N	84.3	Confident	67.2	Low	40 Å²	40	61.4 Å²	61.4	21%	0.214	37%	0.368	C	S	.	.	H	α-helix	trans	-61.8	-42.7	177.7	-68.9	-14.8	0	0	0	111.6	S264 V265 I266 H270 T271 V272	S264-N268 WeakPolarHBondContact O-CB 3.23Å; S264-N268 PolarHBondContact O-N 3.4Å; S264-N268 PolarHBondContact O-ND2 3.42Å; S264-N268 PolarHBondContact O-OD1 3.38Å; V265-N268 PolarHBondContact O-N 3.17Å; I266-N268 PolarHBondContact O-N 3.4Å; N268-H270 VanDerWaalsContact C-N 3.3Å; N268-H270 PolarHBondContact O-N 3.15Å; N268-T271 PolarHBondContact O-N 3.22Å; N268-V272 WeakPolarHBondContact O-CB 3.45Å; N268-V272 VanDerWaalsContact O-CG2 3.25Å; N268-V272 WeakPolarHBondContact O-CG2 3.41Å; N268-V272 PolarHBondContact O-N 3.11Å
269	L	79.6	Confident	64.7	Low	18 Å²	18	66.1 Å²	66.1	9%	0.094	40%	0.396	C	S	.	.	H	α-helix	trans	-62.5	-36	175.7	-69.6	172.5	0	0	0	112.1	L234 V265 I266 Q267 G273 L330	L234-L269 HydrophobicContact CD1-CD1 4.4Å; V265-L269 HydrophobicContact CG1-CD1 4.01Å; V265-L269 HydrophobicContact CG1-CG 4.36Å; V265-L269 VanDerWaalsContact O-CG 3.29Å; V265-L269 WeakPolarHBondContact O-CG 3.28Å; V265-L269 PolarHBondContact O-N 3.01Å; I266-L269 PolarHBondContact O-N 3.22Å; Q267-L269 PolarHBondContact O-N 3.16Å; L269-G273 PolarHBondContact O-N 3.17Å; L269-L330 HydrophobicContact CD1-CD1 3.59Å
270	H	78.5	Confident	62.2	Low	101 Å²	101	70.9 Å²	70.9	47%	0.468	43%	0.429	S	S	.	.	H	α-helix	trans	-67.8	-44.8	172.9	-77.7	-67.9	0	0	0	112.9	I266 Q267 N268 G273 T274 I327	I266-H270 PolarHBondContact O-CD2 3.47Å; I266-H270 PolarHBondContact O-N 3.26Å; Q267-H270 WeakPolarHBondContact O-CB 3.45Å; Q267-H270 PolarHBondContact O-N 3.22Å; Q267-H270 VanDerWaalsContact O-N 3.16Å; N268-H270 VanDerWaalsContact C-N 3.3Å; N268-H270 PolarHBondContact O-N 3.15Å; H270-G273 PolarHBondContact O-N 3.16Å; H270-T274 PolarHBondContact O-N 2.93Å; H270-I327 VanDerWaalsContact CE1-CD1 3.44Å; H270-I327 WeakPolarHBondContact CE1-CD1 3.39Å
271	T	75.4	Confident	59.5	Low	82 Å²	82	70.5 Å²	70.5	50%	0.503	45%	0.448	S	S	.	.	H	α-helix	trans	-66	-38.2	-178.4	-54.5	0	0	0	0	112.2	Q267 N268 G273 T274	Q267-T271 PolarHBondContact O-N 3.23Å; Q267-T271 PolarHBondContact O-OG1 2.86Å; Q267-T271 VanDerWaalsContact O-OG1 3.04Å; N268-T271 PolarHBondContact O-N 3.22Å; T271-G273 VanDerWaalsContact C-N 3.34Å; T271-T274 PolarHBondContact O-N 3.28Å; T271-T274 PolarHBondContact O-OG1 3.29Å
272	V	59.3	Low	56.7	Low	85 Å²	85	75.9 Å²	75.9	52%	0.515	49%	0.486	S	S	.	.	H	α-helix	trans	-72.8	-27.7	178.3	177	0	0	0	0	111.8	N268	N268-V272 WeakPolarHBondContact O-CB 3.45Å; N268-V272 VanDerWaalsContact O-CG2 3.25Å; N268-V272 WeakPolarHBondContact O-CG2 3.41Å; N268-V272 PolarHBondContact O-N 3.11Å
273	G	48.8	Very low	54.1	Low	39 Å²	39	82 Å²	82	40%	0.402	52%	0.524	S	S	.	.	H	α-helix	trans	-77.1	-12.5	176.7	0	0	0	0	0	115.6	L269 H270 T271	L269-G273 PolarHBondContact O-N 3.17Å; H270-G273 PolarHBondContact O-N 3.16Å; T271-G273 VanDerWaalsContact C-N 3.34Å
274	T	37.3	Very low	51.2	Low	82 Å²	82	87.5 Å²	87.5	50%	0.503	55%	0.55	S	S	.	*	S	Bend	trans	-97.4	119.4	174.1	50.7	0	0	0	0	110.7	H270 T271 I276	H270-T274 PolarHBondContact O-N 2.93Å; T271-T274 PolarHBondContact O-N 3.28Å; T271-T274 PolarHBondContact O-OG1 3.29Å; T274-I276 PolarHBondContact O-N 3.13Å
275	P	29.2	Very low	48.4	Very low	125 Å²	125	92.7 Å²	92.7	81%	0.812	58%	0.581	S	S	*	*			trans	-64.9	109	166.3	25.9	-29.3	0	0	0	107.7	P277	P275-P277 WeakPolarHBondContact O-CD 3.43Å
276	I	29.6	Very low	45.5	Very low	124 Å²	124	96.1 Å²	96.1	64%	0.636	62%	0.617	S	S	*	*			trans	-60.2	123.2	175.8	-61.5	164.2	0	0	0	107.7	T274 A278	T274-I276 PolarHBondContact O-N 3.13Å; I276-A278 PolarHBondContact O-N 2.94Å
277	P	28.6	Very low	42.7	Very low	111 Å²	111	101.8 Å²	101.8	72%	0.721	65%	0.653	S	S	*	*			trans	-64.4	114.4	155.9	-2.7	18.5	0	0	0	105.7	P275 V279	P275-P277 WeakPolarHBondContact O-CD 3.43Å; P277-V279 PolarHBondContact O-N 2.95Å
278	A	25.7	Very low	39.9	Very low	97 Å²	97	102.8 Å²	102.8	80%	0.802	67%	0.667	S	S	*	*			trans	-48.5	111.7	179.1	0	0	0	0	0	110.4	I276	I276-A278 PolarHBondContact O-N 2.94Å
279	V	28.9	Very low	37.2	Very low	131 Å²	131	106.3 Å²	106.3	79%	0.794	69%	0.692	S	S	*	*			trans	-94.5	118	164.2	-164.7	0	0	0	0	106	P277 G281	P277-V279 PolarHBondContact O-N 2.95Å; V279-G281 PolarHBondContact O-N 3.16Å
280	P	27.7	Very low	34.5	Very low	128 Å²	128	112 Å²	112	83%	0.831	73%	0.728	S	S	*	*			trans	-78.3	122.9	-177.1	30.2	-31.4	0	0	0	109.9
281	G	24.9	Very low	32	Very low	77 Å²	77	111.3 Å²	111.3	79%	0.794	74%	0.739	S	S	*	*			trans	143.8	86.2	162.3	0	0	0	0	0	115.4	V279	V279-G281 PolarHBondContact O-N 3.16Å
282	S	27	Very low	29.6	Very low	121 Å²	121	114.6 Å²	114.6	85%	0.846	75%	0.754	S	S	*	*				172.1	96.3	128.5	-173.3	0	0	0	0	108.3
283	T	28.2	Very low	28.1	Very low	131 Å²	131	119.8 Å²	119.8	80%	0.804	77%	0.769	S	S	*	*			trans	-102.5	134.8	167.7	39.3	0	0	0	0	108.8
284	N	24.6	Very low	26.9	Very low	157 Å²	157	126.7 Å²	126.7	84%	0.84	79%	0.791	S	S	*	*			trans	-135.8	92.5	152.7	-95.6	-16.7	0	0	0	107.7
285	T	25.8	Very low	26.4	Very low	145 Å²	145	128.7 Å²	128.7	89%	0.89	81%	0.808	S	S	*	*			trans	-171.3	119.8	137.3	42.2	0	0	0	0	107.1
286	G	22.6	Very low	26.1	Very low	74 Å²	74	132.1 Å²	132.1	76%	0.763	81%	0.813	S	S	*	*			trans	-85.5	157.1	-166.5	0	0	0	0	0	115.4
287	T	26.1	Very low	25.9	Very low	147 Å²	147	131.2 Å²	131.2	90%	0.902	83%	0.825	S	S	*	*			trans	-155.2	151.3	146.1	34.9	0	0	0	0	109
288	V	26.5	Very low	25.8	Very low	144 Å²	144	133.8 Å²	133.8	87%	0.873	83%	0.829	S	S	*	*			trans	-74.1	155	-154.8	-178.4	0	0	0	0	114.2
289	P	26.1	Very low	25.7	Very low	113 Å²	113	136.9 Å²	136.9	73%	0.734	83%	0.827	S	S	*	*			trans	-101.1	158.9	-162.6	37.6	-30.6	0	0	0	115.2
290	T	24.8	Very low	25.5	Very low	139 Å²	139	136.4 Å²	136.4	85%	0.853	83%	0.825	S	S	*	*			trans	-145.8	117.2	156.7	47.6	0	0	0	0	111.7
291	A	25.3	Very low	25.4	Very low	86 Å²	86	137.6 Å²	137.6	71%	0.711	82%	0.824	S	S	*	*			trans	10.7	143.6	142.1	0	0	0	0	0	118.8
292	D	24.1	Very low	25.4	Very low	150 Å²	150	143.4 Å²	143.4	80%	0.802	83%	0.83	S	S	*	*			cis	-177.1	162.4	26.3	-116.7	-18.9	0	0	0	110.4
293	K	28.3	Very low	25.2	Very low	194 Å²	194	146.9 Å²	146.9	84%	0.843	83%	0.83	S	S	*	*			trans	102.2	95	155.6	-74.4	175.7	-177.5	-178.6	0	121.8
294	E	23.8	Very low	24.9	Very low	185 Å²	185	145.5 Å²	145.5	86%	0.864	83%	0.832	S	S	*	*			trans	-19.2	141.5	140.5	-60.9	169	158.3	0	0	118.6
295	S	26.4	Very low	24.8	Very low	123 Å²	123	141.2 Å²	141.2	86%	0.86	83%	0.825	S	S	*	*				-174.2	127.6	101.3	39.3	0	0	0	0	112.2
296	E	23	Very low	24.7	Very low	197 Å²	197	140.1 Å²	140.1	92%	0.921	82%	0.823	S	S	*	*			trans	-70.9	151.1	170.6	-61.3	177.1	138	0	0	112.1
297	A	25.4	Very low	24.7	Very low	106 Å²	106	142 Å²	142	88%	0.876	83%	0.825	S	S	*	*			trans	-162	126.4	135.9	0	0	0	0	0	111.4
298	M	25.9	Very low	24.8	Very low	164 Å²	164	141.2 Å²	141.2	81%	0.808	82%	0.822	S	S	*	*			trans	-70.2	149.3	179.8	-94.5	175.8	158.6	0	0	114.9
299	E	25.3	Very low	24.8	Very low	162 Å²	162	139.4 Å²	139.4	76%	0.757	82%	0.822	S	S	*	*			trans	54.1	138.5	134.8	-56.1	-162.8	177.8	0	0	119.9
300	T	24.4	Very low	24.6	Very low	122 Å²	122	137.5 Å²	137.5	75%	0.748	82%	0.824	S	S	*	*				-164.7	142.7	54.1	43.4	0	0	0	0	112.8
301	D	25.2	Very low	24.6	Very low	152 Å²	152	140.9 Å²	140.9	81%	0.813	83%	0.826	S	S	*	*			trans	34.7	121.3	135.3	-132.8	-11.1	0	0	0	121.6
302	E	24.5	Very low	24.5	Very low	199 Å²	199	141.6 Å²	141.6	93%	0.93	83%	0.833	S	S	*	*			trans	-163.3	139.6	135.2	-110.5	-173.5	-171.1	0	0	113.2
303	K	23	Very low	24.6	Very low	194 Å²	194	138.7 Å²	138.7	84%	0.843	83%	0.829	S	S	*	*			trans	-87	155	-177.5	-95.9	-179.9	177.2	172.1	0	113.6
304	A	22.8	Very low	24.8	Very low	103 Å²	103	138.5 Å²	138.5	85%	0.851	83%	0.831	S	S	*	*			trans	88.9	129.2	142.4	0	0	0	0	0	120.2
305	G	21.9	Very low	25	Very low	67 Å²	67	135.8 Å²	135.8	69%	0.691	83%	0.827	S	S	*	*			trans	122.8	95.4	135.9	0	0	0	0	0	117.8
306	S	22.8	Very low	25.4	Very low	121 Å²	121	138.1 Å²	138.1	85%	0.846	82%	0.822	S	S	*	*			trans	53.8	124.9	140.8	62	0	0	0	0	121.6
307	S	23.6	Very low	26	Very low	115 Å²	115	137.1 Å²	137.1	80%	0.804	82%	0.818	S	S	*	*			trans	-41.1	161.7	169.4	-36.7	0	0	0	0	116.5
308	P	27.5	Very low	26.7	Very low	129 Å²	129	138.3 Å²	138.3	84%	0.838	81%	0.805	S	S	*	*				-139.7	148.2	92.4	33.3	-16.9	0	0	0	116
309	A	25.9	Very low	27.8	Very low	106 Å²	106	133.7 Å²	133.7	88%	0.876	79%	0.787	S	S	*	*			trans	-11.6	132.1	166.5	0	0	0	0	0	119.5
310	G	22.9	Very low	29.3	Very low	74 Å²	74	133.6 Å²	133.6	76%	0.763	78%	0.784	S	S	*	*			trans	-168.6	78.3	166.8	0	0	0	0	0	113.6
311	K	24.8	Very low	31.2	Very low	209 Å²	209	133.3 Å²	133.3	91%	0.909	78%	0.778	S	S	*	*			trans	58.8	99.6	159.3	-66.4	-179.8	176.6	-179.8	0	118.2	A313	K311-A313 PolarHBondContact O-N 3.03Å
312	A	23.6	Very low	33.4	Very low	102 Å²	102	127.7 Å²	127.7	84%	0.843	75%	0.747	S	S	*	*			trans	-60.7	120.8	154.4	0	0	0	0	0	109.6
313	A	26.6	Very low	35.8	Very low	88 Å²	88	120.2 Å²	120.2	73%	0.727	71%	0.713	S	S	*	*			trans	-87.7	110.5	156.8	0	0	0	0	0	106.5	K311 T315	K311-A313 PolarHBondContact O-N 3.03Å; A313-T315 PolarHBondContact O-N 2.62Å; A313-T315 PolarHBondContact O-OG1 2.67Å
314	E	30.9	Very low	38.5	Very low	191 Å²	191	113.6 Å²	113.6	89%	0.893	70%	0.695	S	S	*	*			trans	-53.7	120.8	174.7	-68.9	170	160.7	0	0	110.2
315	T	28.1	Very low	41.2	Very low	127 Å²	127	112.8 Å²	112.8	78%	0.779	67%	0.672	S	S	*	*			trans	-134.3	98.7	164.9	-13.9	0	0	0	0	108.4	A313	A313-T315 PolarHBondContact O-N 2.62Å; A313-T315 PolarHBondContact O-OG1 2.67Å
316	K	35.3	Very low	44	Very low	173 Å²	173	109.6 Å²	109.6	75%	0.752	64%	0.639	S	S	*	*			trans	39.9	96.8	159.3	-64.6	-173.9	173.2	-168.4	0	118.9
317	E	35	Very low	46.9	Very low	176 Å²	176	105.5 Å²	105.5	82%	0.822	61%	0.608	S	S	*	*			trans	-88.7	-3	161.5	-75.8	-170.3	143.9	0	0	114.2	P319	E317-P319 VanDerWaalsContact C-CD 3.44Å
318	E	40.4	Very low	49.7	Very low	130 Å²	130	103.8 Å²	103.8	61%	0.607	59%	0.586	S	S	*	*	H	α-helix	trans	-63.1	-31.8	-171.9	-67.4	-177.7	149.3	0	0	118.8	K320	E318-K320 PolarHBondContact O-N 3.39Å
319	P	49.5	Very low	52.4	Low	68 Å²	68	97.6 Å²	97.6	44%	0.442	55%	0.546	S	S	.	.	H	α-helix	trans	-71.3	-17.1	-174.3	25.1	-31.7	0	0	0	113.9	E317 N323	E317-P319 VanDerWaalsContact C-CD 3.44Å; P319-N323 VanDerWaalsContact O-CG 3.3Å; P319-N323 PolarHBondContact O-N 2.93Å; P319-N323 PolarHBondContact O-ND2 3.22Å
320	K	56.2	Low	55.2	Low	160 Å²	160	92.6 Å²	92.6	70%	0.696	50%	0.504	S	S	*	.	H	α-helix	trans	-75.9	-37.7	-179.8	-73.1	-177.7	178.2	175.4	0	112.8	E318 A324	E318-K320 PolarHBondContact O-N 3.39Å; K320-A324 PolarHBondContact O-N 3.4Å
321	D	65.7	Low	58	Low	116 Å²	116	90.6 Å²	90.6	62%	0.62	48%	0.478	S	S	*	.	H	α-helix	trans	-72.6	-35	-179.3	-71.7	-16.8	0	0	0	112.2	A324 K325	D321-A324 PolarHBondContact O-N 3.37Å; D321-K325 WeakPolarHBondContact O-CG 3.46Å; D321-K325 PolarHBondContact O-N 3.17Å
322	Q	70.6	Confident	60.6	Low	34 Å²	34	80.6 Å²	80.6	16%	0.159	44%	0.435	C	S	.	.	H	α-helix	trans	-66.6	-42	176.3	-63.1	178.5	-0.8	0	0	111.2	L243 K325 M326	L243-Q322 HydrophobicContact CD1-CG 4.28Å; L243-Q322 HydrophobicContact CD2-CB 4.26Å; L243-Q322 HydrophobicContact CD2-CG 4.1Å; Q322-K325 PolarHBondContact O-N 3.42Å; Q322-M326 PolarHBondContact O-N 3.23Å; Q322-M326 VanDerWaalsContact O-N 3.09Å
323	N	74.9	Confident	63.4	Low	41 Å²	41	79.4 Å²	79.4	22%	0.219	41%	0.412	C	S	.	.	H	α-helix	trans	-63.7	-42.2	174.6	-72.6	-12.3	0	0	0	111.9	P319 K325 M326 I327	P319-N323 VanDerWaalsContact O-CG 3.3Å; P319-N323 PolarHBondContact O-N 2.93Å; P319-N323 PolarHBondContact O-ND2 3.22Å; N323-K325 VanDerWaalsContact C-N 3.34Å; N323-K325 PolarHBondContact O-N 3.05Å; N323-M326 HydrophobicContact CB-CE 4.46Å; N323-M326 PolarHBondContact O-N 3.5Å; N323-M326 WeakPolarHBondContact OD1-CE 3.17Å; N323-I327 WeakPolarHBondContact O-CD1 3.25Å; N323-I327 VanDerWaalsContact O-CG1 3.23Å; N323-I327 WeakPolarHBondContact O-CG1 3.49Å; N323-I327 PolarHBondContact O-N 3.01Å
324	A	79.1	Confident	66.1	Low	55 Å²	55	76.3 Å²	76.3	46%	0.455	38%	0.383	S	S	.	.	H	α-helix	trans	-60.6	-41.3	175.6	0	0	0	0	0	112.5	K320 D321 I327 K328	K320-A324 PolarHBondContact O-N 3.4Å; D321-A324 PolarHBondContact O-N 3.37Å; A324-I327 PolarHBondContact O-N 3.14Å; A324-K328 PolarHBondContact O-N 3.29Å
325	K	80.6	Confident	68.7	Low	86 Å²	86	67.4 Å²	67.4	37%	0.374	34%	0.341	S	S	.	.	H	α-helix	trans	-63.1	-42.4	174.9	-73.5	-179.3	-179.3	-176.6	0	112.4	Y247 D321 Q322 N323 K328 I329	Y247-K325 HydrophobicContact CE1-CB 4.23Å; Y247-K325 VanDerWaalsContact OH-CD 3.3Å; Y247-K325 WeakPolarHBondContact OH-CD 3.49Å; D321-K325 WeakPolarHBondContact O-CG 3.46Å; D321-K325 PolarHBondContact O-N 3.17Å; Q322-K325 PolarHBondContact O-N 3.42Å; N323-K325 VanDerWaalsContact C-N 3.34Å; N323-K325 PolarHBondContact O-N 3.05Å; K325-K328 PolarHBondContact O-N 3.37Å; K325-I329 WeakPolarHBondContact O-CG1 3.39Å; K325-I329 PolarHBondContact O-N 3.21Å; K325-I329 VanDerWaalsContact O-N 3.17Å
326	M	79.8	Confident	71.5	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-66.6	-40.4	176.7	-69.4	-176.4	-67.6	0	0	112.2	V238 A246 Y247 Q322 N323 K328 I329 L330	V238-M326 HydrophobicContact CG2-CE 3.46Å; V238-M326 VanDerWaalsContact CG2-CE 3.46Å; V238-M326 HydrophobicContact CG2-SD 3.81Å; A246-M326 HydrophobicContact CB-SD 4.18Å; Y247-M326 HydrophobicContact CD1-CG 4.17Å; Y247-M326 HydrophobicContact CE1-CG 3.96Å; Q322-M326 PolarHBondContact O-N 3.23Å; Q322-M326 VanDerWaalsContact O-N 3.09Å; N323-M326 HydrophobicContact CB-CE 4.46Å; N323-M326 PolarHBondContact O-N 3.5Å; N323-M326 WeakPolarHBondContact OD1-CE 3.17Å; M326-K328 VanDerWaalsContact C-N 3.27Å; M326-K328 PolarHBondContact O-N 3.17Å; M326-I329 PolarHBondContact O-N 3.26Å; M326-I329 VanDerWaalsContact O-N 3.15Å; M326-L330 WeakPolarHBondContact O-CG 3.34Å; M326-L330 PolarHBondContact O-N 3.15Å
327	I	83.3	Confident	73.8	Confident	35 Å²	35	56.8 Å²	56.8	18%	0.179	29%	0.286	C	S	.	.	H	α-helix	trans	-59.9	-41.1	175	-68.2	158.6	0	0	0	110.2	I266 H270 N323 A324 I329 L330 S331	I266-I327 HydrophobicContact CG2-CG2 4.32Å; H270-I327 VanDerWaalsContact CE1-CD1 3.44Å; H270-I327 WeakPolarHBondContact CE1-CD1 3.39Å; N323-I327 WeakPolarHBondContact O-CD1 3.25Å; N323-I327 VanDerWaalsContact O-CG1 3.23Å; N323-I327 WeakPolarHBondContact O-CG1 3.49Å; N323-I327 PolarHBondContact O-N 3.01Å; A324-I327 PolarHBondContact O-N 3.14Å; I327-I329 VanDerWaalsContact C-N 3.3Å; I327-I329 PolarHBondContact O-N 3.35Å; I327-L330 PolarHBondContact O-N 3.43Å; I327-S331 WeakPolarHBondContact O-CB 3.48Å; I327-S331 PolarHBondContact O-N 3.23Å; I327-S331 PolarHBondContact O-OG 3.4Å
328	K	83.8	Confident	76.3	Confident	78 Å²	78	49 Å²	49	34%	0.339	25%	0.25	S	C	.	.	H	α-helix	trans	-66.1	-29.4	177.3	-158.1	-174.6	176	-175.9	0	113.8	A324 K325 M326 S331 M334	A324-K328 PolarHBondContact O-N 3.29Å; K325-K328 PolarHBondContact O-N 3.37Å; M326-K328 VanDerWaalsContact C-N 3.27Å; M326-K328 PolarHBondContact O-N 3.17Å; K328-S331 PolarHBondContact O-OG 2.89Å; K328-S331 VanDerWaalsContact O-OG 3.08Å; K328-M334 HydrophobicContact CD-CG 3.86Å; K328-M334 HydrophobicContact CD-SD 3.96Å; K328-M334 HydrophobicContact CG-CG 3.91Å; K328-M334 HydrophobicContact CG-SD 4.34Å
329	I	84.6	Confident	78.5	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-75.2	-46.2	173.4	-63.5	166	0	0	0	109.9	Y247 C250 F251 K325 M326 I327 S331 G332 M334 L796	Y247-I329 HydrophobicContact CD1-CD1 3.47Å; Y247-I329 VanDerWaalsContact CD1-CD1 3.47Å; Y247-I329 HydrophobicContact CE1-CD1 4.1Å; Y247-I329 HydrophobicContact CG-CD1 3.84Å; C250-I329 HydrophobicContact CB-CB 4.04Å; C250-I329 HydrophobicContact CB-CG2 3.52Å; F251-I329 HydrophobicContact CD1-CG2 3.63Å; F251-I329 HydrophobicContact CD2-CG2 4.1Å; F251-I329 HydrophobicContact CE1-CG1 4.47Å; F251-I329 HydrophobicContact CE1-CG2 3.64Å; F251-I329 HydrophobicContact CE2-CD1 4.08Å; F251-I329 HydrophobicContact CE2-CG1 4.34Å; F251-I329 HydrophobicContact CE2-CG2 4.09Å; F251-I329 HydrophobicContact CG-CG2 3.86Å; F251-I329 HydrophobicContact CZ-CD1 4.24Å; F251-I329 HydrophobicContact CZ-CG1 4.02Å; F251-I329 HydrophobicContact CZ-CG2 3.86Å; K325-I329 WeakPolarHBondContact O-CG1 3.39Å; K325-I329 PolarHBondContact O-N 3.21Å; K325-I329 VanDerWaalsContact O-N 3.17Å; M326-I329 PolarHBondContact O-N 3.26Å; M326-I329 VanDerWaalsContact O-N 3.15Å; I327-I329 VanDerWaalsContact C-N 3.3Å; I327-I329 PolarHBondContact O-N 3.35Å; I329-S331 VanDerWaalsContact C-N 3.31Å; I329-S331 PolarHBondContact O-N 3.43Å; I329-G332 PolarHBondContact O-N 3.22Å; I329-M334 HydrophobicContact CG1-SD 4.49Å; I329-L796 HydrophobicContact CD1-CD1 3.97Å; I329-L796 HydrophobicContact CD1-CD2 4.1Å; I329-L796 HydrophobicContact CG1-CD1 4.24Å
330	L	83.8	Confident	80.3	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-67.9	-28.9	-179.7	-69.3	172.6	0	0	0	112.9	C250 L253 L262 V265 I266 L269 M326 I327 G332	C250-L330 HydrophobicContact CB-CD2 3.95Å; C250-L330 HydrophobicContact CB-CG 4.15Å; L253-L330 HydrophobicContact CB-CD2 4.2Å; L253-L330 HydrophobicContact CD1-CD2 4.23Å; L262-L330 HydrophobicContact CD2-CD2 4.11Å; V265-L330 HydrophobicContact CG1-CD1 4.12Å; I266-L330 HydrophobicContact CD1-CB 3.97Å; I266-L330 HydrophobicContact CG1-CB 3.83Å; I266-L330 HydrophobicContact CG1-CD1 4.22Å; L269-L330 HydrophobicContact CD1-CD1 3.59Å; M326-L330 WeakPolarHBondContact O-CG 3.34Å; M326-L330 PolarHBondContact O-N 3.15Å; I327-L330 PolarHBondContact O-N 3.43Å; L330-G332 PolarHBondContact O-N 3.32Å
331	S	80.8	Confident	81.6	Confident	31 Å²	31	37.1 Å²	37.1	22%	0.217	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-16.9	172.3	69.6	0	0	0	0	112.6	I327 K328 I329 E333 H454	I327-S331 WeakPolarHBondContact O-CB 3.48Å; I327-S331 PolarHBondContact O-N 3.23Å; I327-S331 PolarHBondContact O-OG 3.4Å; K328-S331 PolarHBondContact O-OG 2.89Å; K328-S331 VanDerWaalsContact O-OG 3.08Å; I329-S331 VanDerWaalsContact C-N 3.31Å; I329-S331 PolarHBondContact O-N 3.43Å; S331-E333 VanDerWaalsContact C-N 3.28Å; S331-E333 PolarHBondContact O-N 3.31Å; S331-H454 PolarHBondContact O-CD2 3.45Å; S331-H454 VanDerWaalsContact O-CD2 3.27Å
332	G	80.3	Confident	82.6	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.162	C	C	.	.	S	Bend	trans	84.7	-10.1	176.4	0	0	0	0	0	115.6	Y254 I329 L330 M334 S335 I336	Y254-G332 VanDerWaalsContact CZ-CA 3.43Å; I329-G332 PolarHBondContact O-N 3.22Å; L330-G332 PolarHBondContact O-N 3.32Å; G332-M334 VanDerWaalsContact C-N 3.26Å; G332-M334 PolarHBondContact O-N 3.37Å; G332-S335 WeakPolarHBondContact O-CB 3.28Å; G332-S335 PolarHBondContact O-N 3.04Å; G332-I336 WeakPolarHBondContact O-CG1 3.38Å; G332-I336 PolarHBondContact O-N 3.41Å
333	E	82.3	Confident	83.4	Confident	76 Å²	76	30.5 Å²	30.5	36%	0.355	16%	0.157	S	C	.	.	H	α-helix	trans	-52.2	-45.5	-178.3	-69.6	173.8	-157.9	0	0	111.6	S331 I336 E337	S331-E333 VanDerWaalsContact C-N 3.28Å; S331-E333 PolarHBondContact O-N 3.31Å; E333-I336 PolarHBondContact O-N 2.87Å; E333-E337 WeakPolarHBondContact O-CG 3.17Å; E333-E337 PolarHBondContact O-N 3.39Å
334	M	83.3	Confident	83.9	Confident	24 Å²	24	29.2 Å²	29.2	12%	0.118	15%	0.15	C	C	.	.	H	α-helix	trans	-66.8	-44.2	178.9	-63.3	-158	68	0	0	112.1	K328 I329 G332 I336 E337 L338 L796	K328-M334 HydrophobicContact CD-CG 3.86Å; K328-M334 HydrophobicContact CD-SD 3.96Å; K328-M334 HydrophobicContact CG-CG 3.91Å; K328-M334 HydrophobicContact CG-SD 4.34Å; I329-M334 HydrophobicContact CG1-SD 4.49Å; G332-M334 VanDerWaalsContact C-N 3.26Å; G332-M334 PolarHBondContact O-N 3.37Å; M334-I336 VanDerWaalsContact C-N 3.27Å; M334-I336 PolarHBondContact O-N 3.16Å; M334-E337 PolarHBondContact O-N 2.98Å; M334-L338 WeakPolarHBondContact O-CB 3.4Å; M334-L338 WeakPolarHBondContact O-CD1 3.43Å; M334-L338 WeakPolarHBondContact O-CG 3.07Å; M334-L338 PolarHBondContact O-N 3.46Å; M334-L796 HydrophobicContact CE-CB 3.55Å; M334-L796 HydrophobicContact CE-CD1 4.07Å; M334-L796 HydrophobicContact CE-CG 4.43Å; M334-L796 HydrophobicContact SD-CB 4.29Å; M334-L796 HydrophobicContact SD-CD1 3.65Å
335	S	85.3	Confident	84.1	Confident	3 Å²	3	29.5 Å²	29.5	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-59.6	-41.5	178.9	-59.3	0	0	0	0	111.2	G332 H339	G332-S335 WeakPolarHBondContact O-CB 3.28Å; G332-S335 PolarHBondContact O-N 3.04Å; S335-H339 WeakPolarHBondContact O-CB 3.29Å; S335-H339 PolarHBondContact O-CD2 3.1Å; S335-H339 VanDerWaalsContact O-CG 3.24Å; S335-H339 PolarHBondContact O-N 2.96Å
336	I	86.1	Confident	84.2	Confident	24 Å²	24	27.7 Å²	27.7	12%	0.123	13%	0.134	C	C	.	.	H	α-helix	trans	-65.8	-48.5	177.3	-64.8	167.9	0	0	0	110.9	G332 E333 M334 L338 H339 L340 G415 E417 H454	G332-I336 WeakPolarHBondContact O-CG1 3.38Å; G332-I336 PolarHBondContact O-N 3.41Å; E333-I336 PolarHBondContact O-N 2.87Å; M334-I336 VanDerWaalsContact C-N 3.27Å; M334-I336 PolarHBondContact O-N 3.16Å; I336-L338 VanDerWaalsContact C-N 3.31Å; I336-L338 PolarHBondContact O-N 2.95Å; I336-H339 PolarHBondContact O-N 3.3Å; I336-L340 VanDerWaalsContact O-CB 3.27Å; I336-L340 WeakPolarHBondContact O-CB 3.26Å; I336-L340 PolarHBondContact O-N 3.5Å; I336-G415 WeakPolarHBondContact CG2-O 3.47Å; I336-E417 VanDerWaalsContact CD1-OE1 3.27Å; I336-E417 WeakPolarHBondContact CD1-OE1 3.46Å; I336-H454 HydrophobicContact CD1-CB 4.48Å
337	E	85.1	Confident	84.3	Confident	53 Å²	53	30.1 Å²	30.1	25%	0.248	15%	0.147	C	C	.	.	H	α-helix	trans	-58.4	-42.8	177.9	-76.2	-179.8	169.2	0	0	111.6	E333 M334 L340 Q341 K418	E333-E337 WeakPolarHBondContact O-CG 3.17Å; E333-E337 PolarHBondContact O-N 3.39Å; M334-E337 PolarHBondContact O-N 2.98Å; E337-L340 PolarHBondContact O-N 3.22Å; E337-Q341 WeakPolarHBondContact O-CG 3.49Å; E337-Q341 PolarHBondContact O-N 3.17Å; E337-K418 WeakPolarHBondContact OE1-CE 3.22Å; E337-K418 IonicContact OE1-NZ 3.74Å; E337-K418 PolarHBondContact OE1-NZ 2.95Å
338	L	86.7	Confident	84.2	Confident	12 Å²	12	31.7 Å²	31.7	6%	0.063	16%	0.156	C	C	.	.	H	α-helix	trans	-67.3	-41.8	179	-65	169.2	0	0	0	111.9	M334 I336 Q341 F342 I790 L792 M798 I921	M334-L338 WeakPolarHBondContact O-CB 3.4Å; M334-L338 WeakPolarHBondContact O-CD1 3.43Å; M334-L338 WeakPolarHBondContact O-CG 3.07Å; M334-L338 PolarHBondContact O-N 3.46Å; I336-L338 VanDerWaalsContact C-N 3.31Å; I336-L338 PolarHBondContact O-N 2.95Å; L338-Q341 PolarHBondContact O-N 3.5Å; L338-F342 WeakPolarHBondContact O-CB 3.28Å; L338-F342 PolarHBondContact O-N 2.9Å; L338-I790 HydrophobicContact CB-CD1 4.06Å; L338-L792 HydrophobicContact CD1-CD1 3.7Å; L338-L792 HydrophobicContact CD1-CD2 3.98Å; L338-L792 HydrophobicContact CD1-CG 4.33Å; L338-L792 HydrophobicContact CD2-CD2 3.91Å; L338-M798 HydrophobicContact CB-CE 4.07Å; L338-M798 HydrophobicContact CD2-CE 3.28Å; L338-M798 HydrophobicContact CD2-CG 4.1Å; L338-M798 HydrophobicContact CG-CE 4.26Å; L338-I921 HydrophobicContact CD1-CD1 3.97Å
339	H	87.4	Confident	84	Confident	49 Å²	49	28.9 Å²	28.9	23%	0.227	15%	0.145	C	C	.	.	H	α-helix	trans	-66.2	-38.6	174.6	-72.4	-32.3	0	0	0	112.4	S335 I336 F342 L343 P786	S335-H339 WeakPolarHBondContact O-CB 3.29Å; S335-H339 PolarHBondContact O-CD2 3.1Å; S335-H339 VanDerWaalsContact O-CG 3.24Å; S335-H339 PolarHBondContact O-N 2.96Å; I336-H339 PolarHBondContact O-N 3.3Å; H339-F342 WeakPolarHBondContact O-CB 3.29Å; H339-F342 PolarHBondContact O-N 3.06Å; H339-L343 VanDerWaalsContact O-CG 3.32Å; H339-L343 WeakPolarHBondContact O-CG 3.5Å; H339-L343 PolarHBondContact O-N 3.47Å; H339-P786 HydrophobicContact CB-CG 4.04Å
340	L	87.2	Confident	83.7	Confident	19 Å²	19	29.4 Å²	29.4	10%	0.099	15%	0.148	C	C	.	.	H	α-helix	trans	-61.3	-48.5	174.9	-179.1	64	0	0	0	110.8	I336 E337 F342 L343 I344 G380 T382 H416	I336-L340 VanDerWaalsContact O-CB 3.27Å; I336-L340 WeakPolarHBondContact O-CB 3.26Å; I336-L340 PolarHBondContact O-N 3.5Å; E337-L340 PolarHBondContact O-N 3.22Å; L340-F342 VanDerWaalsContact C-N 3.29Å; L340-F342 PolarHBondContact O-N 3.04Å; L340-L343 PolarHBondContact O-N 2.86Å; L340-I344 HydrophobicContact CD1-CD1 3.88Å; L340-I344 HydrophobicContact CD1-CG1 4.26Å; L340-I344 HydrophobicContact CD2-CD1 4.49Å; L340-I344 HydrophobicContact CG-CD1 3.76Å; L340-I344 HydrophobicContact CG-CG1 4.49Å; L340-I344 VanDerWaalsContact O-CG1 3.3Å; L340-I344 WeakPolarHBondContact O-CG1 3.12Å; L340-I344 PolarHBondContact O-N 3.17Å; L340-G380 VanDerWaalsContact CD1-O 3.28Å; L340-G380 WeakPolarHBondContact CD1-O 3.48Å; L340-T382 HydrophobicContact CD1-CG2 3.94Å; L340-H416 HydrophobicContact CD2-CB 4.28Å
341	Q	82.8	Confident	83.6	Confident	41 Å²	41	31.6 Å²	31.6	19%	0.192	16%	0.159	C	C	.	.	H	α-helix	trans	-59.5	-40.4	176	-75.4	-178.4	3.8	0	0	112.4	E337 L338 R345 M798 P937	E337-Q341 WeakPolarHBondContact O-CG 3.49Å; E337-Q341 PolarHBondContact O-N 3.17Å; L338-Q341 PolarHBondContact O-N 3.5Å; Q341-R345 WeakPolarHBondContact O-CB 3.15Å; Q341-R345 WeakPolarHBondContact O-CG 3.47Å; Q341-R345 PolarHBondContact O-N 3.25Å; Q341-R345 VanDerWaalsContact O-N 3.08Å; Q341-M798 HydrophobicContact CB-CE 4.09Å; Q341-M798 VanDerWaalsContact OE1-CE 3.23Å; Q341-P937 VanDerWaalsContact NE2-CB 3.28Å
342	F	87.2	Confident	83.6	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61.8	-45.8	175.3	165	-107.4	0	0	0	112.2	L338 H339 L340 N346 N744 P786 A788 P891 R893	L338-F342 WeakPolarHBondContact O-CB 3.28Å; L338-F342 PolarHBondContact O-N 2.9Å; H339-F342 WeakPolarHBondContact O-CB 3.29Å; H339-F342 PolarHBondContact O-N 3.06Å; L340-F342 VanDerWaalsContact C-N 3.29Å; L340-F342 PolarHBondContact O-N 3.04Å; F342-N346 WeakPolarHBondContact CD2-ND2 3.42Å; F342-N346 HydrophobicContact CE2-CB 4.31Å; F342-N346 VanDerWaalsContact CE2-ND2 3.28Å; F342-N346 WeakPolarHBondContact CE2-ND2 3.32Å; F342-N346 WeakPolarHBondContact O-CB 3.5Å; F342-N346 PolarHBondContact O-N 3.43Å; F342-N744 HydrophobicContact CE1-CB 3.7Å; F342-N744 HydrophobicContact CZ-CB 3.89Å; F342-P786 HydrophobicContact CD1-CB 4.35Å; F342-P786 HydrophobicContact CE1-CB 4.28Å; F342-A788 HydrophobicContact CD1-CB 3.84Å; F342-A788 HydrophobicContact CD2-CB 3.93Å; F342-A788 HydrophobicContact CE1-CB 3.69Å; F342-A788 HydrophobicContact CE2-CB 3.79Å; F342-A788 HydrophobicContact CG-CB 3.95Å; F342-A788 HydrophobicContact CZ-CB 3.67Å; F342-P891 HydrophobicContact CB-CB 4.27Å; F342-P891 HydrophobicContact CB-CG 4.12Å; F342-P891 HydrophobicContact CD2-CB 3.83Å; F342-P891 HydrophobicContact CD2-CG 3.98Å; F342-P891 HydrophobicContact CG-CB 4.46Å; F342-R893 HydrophobicContact CE2-CB 4.36Å; F342-R893 HydrophobicContact CZ-CB 4.03Å
343	L	87	Confident	83.7	Confident	12 Å²	12	33.4 Å²	33.4	6%	0.063	17%	0.166	C	C	.	.	H	α-helix	trans	-70.4	-36.8	-178.3	-69.6	173.4	0	0	0	112.7	H339 L340 G380 T381 N744 V745	H339-L343 VanDerWaalsContact O-CG 3.32Å; H339-L343 WeakPolarHBondContact O-CG 3.5Å; H339-L343 PolarHBondContact O-N 3.47Å; L340-L343 PolarHBondContact O-N 2.86Å; L343-G380 WeakPolarHBondContact CB-O 3.28Å; L343-T381 HydrophobicContact CB-CG2 4.46Å; L343-N744 HydrophobicContact CD2-CB 3.78Å; L343-V745 HydrophobicContact CD2-CG1 4.09Å
344	I	85.8	Confident	83.8	Confident	14 Å²	14	30 Å²	30	7%	0.072	15%	0.149	C	C	.	.	H	α-helix	trans	-65.5	-46.6	176.1	-68.9	169.4	0	0	0	110.5	L340 T382 V938	L340-I344 HydrophobicContact CD1-CD1 3.88Å; L340-I344 HydrophobicContact CD1-CG1 4.26Å; L340-I344 HydrophobicContact CD2-CD1 4.49Å; L340-I344 HydrophobicContact CG-CD1 3.76Å; L340-I344 HydrophobicContact CG-CG1 4.49Å; L340-I344 VanDerWaalsContact O-CG1 3.3Å; L340-I344 WeakPolarHBondContact O-CG1 3.12Å; L340-I344 PolarHBondContact O-N 3.17Å; I344-T382 HydrophobicContact CD1-CG2 4.26Å; I344-V938 HydrophobicContact CG2-CG1 3.9Å
345	R	82.5	Confident	83.9	Confident	60 Å²	60	33.2 Å²	33.2	23%	0.226	16%	0.163	C	C	.	.	H	α-helix	trans	-68.2	-42.3	-179.2	-74.7	-170.4	-171.2	145.1	6.5	113.3	Q341 N347 V935 E936 V938	Q341-R345 WeakPolarHBondContact O-CB 3.15Å; Q341-R345 WeakPolarHBondContact O-CG 3.47Å; Q341-R345 PolarHBondContact O-N 3.25Å; Q341-R345 VanDerWaalsContact O-N 3.08Å; R345-N347 PolarHBondContact O-N 3.45Å; R345-V935 VanDerWaalsContact CZ-CG1 3.42Å; R345-E936 VanDerWaalsContact NH2-C 3.29Å; R345-E936 PolarHBondContact NH2-O 3.21Å; R345-V938 HydrophobicContact CG-CB 4.27Å; R345-V938 HydrophobicContact CG-CG2 3.79Å
346	N	82.9	Confident	83.9	Confident	48 Å²	48	36.7 Å²	36.7	26%	0.257	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	38.2	-171.9	-73.6	-42.3	0	0	0	113.3	F342 N348 N744 P891	F342-N346 WeakPolarHBondContact CD2-ND2 3.42Å; F342-N346 HydrophobicContact CE2-CB 4.31Å; F342-N346 VanDerWaalsContact CE2-ND2 3.28Å; F342-N346 WeakPolarHBondContact CE2-ND2 3.32Å; F342-N346 WeakPolarHBondContact O-CB 3.5Å; F342-N346 PolarHBondContact O-N 3.43Å; N346-N348 PolarHBondContact O-N 3.09Å; N346-N348 VanDerWaalsContact O-N 3.08Å; N346-N348 PolarHBondContact O-ND2 2.9Å; N346-N744 PolarHBondContact O-ND2 3.18Å; N346-P891 PolarHBondContact ND2-O 3.22Å; N346-P891 VanDerWaalsContact ND2-O 3.16Å
347	N	82.4	Confident	83.9	Confident	52 Å²	52	35.9 Å²	35.9	28%	0.278	18%	0.177	S	C	.	.			trans	-76.4	99.7	-178.9	-175.4	7.1	0	0	0	112.3	R345 T349 T381	R345-N347 PolarHBondContact O-N 3.45Å; N347-T349 PolarHBondContact ND2-OG1 3.33Å; N347-T349 WeakPolarHBondContact OD1-CB 3.18Å; N347-T349 WeakPolarHBondContact OD1-CG2 3.42Å; N347-T349 PolarHBondContact OD1-N 3.37Å; N347-T349 VanDerWaalsContact OD1-N 3.13Å; N347-T349 PolarHBondContact OD1-OG1 3.03Å; N347-T381 HydrophobicContact CB-CG2 4.41Å
348	N	82.1	Confident	83.9	Confident	68 Å²	68	35.6 Å²	35.6	36%	0.364	18%	0.175	S	C	.	.			trans	-103.9	34.2	176.3	-66.6	-62.4	0	0	0	112.9	N346 Y814	N346-N348 PolarHBondContact O-N 3.09Å; N346-N348 VanDerWaalsContact O-N 3.08Å; N346-N348 PolarHBondContact O-ND2 2.9Å; N348-Y814 HydrophobicContact CB-CD1 4.15Å; N348-Y814 HydrophobicContact CB-CE1 4.37Å; N348-Y814 HydrophobicContact CB-CG 4.27Å; N348-Y814 WeakPolarHBondContact ND2-CE2 3.49Å; N348-Y814 VanDerWaalsContact ND2-CZ 3.31Å
349	T	78.1	Confident	83.8	Confident	20 Å²	20	40.7 Å²	40.7	12%	0.123	20%	0.203	C	C	.	.			trans	-73.1	142.3	173.5	48.6	0	0	0	0	111.6	N347 M377 H378 G742	N347-T349 PolarHBondContact ND2-OG1 3.33Å; N347-T349 WeakPolarHBondContact OD1-CB 3.18Å; N347-T349 WeakPolarHBondContact OD1-CG2 3.42Å; N347-T349 PolarHBondContact OD1-N 3.37Å; N347-T349 VanDerWaalsContact OD1-N 3.13Å; N347-T349 PolarHBondContact OD1-OG1 3.03Å; T349-M377 HydrophobicContact CG2-CB 4.18Å; T349-M377 WeakPolarHBondContact CG2-O 3.37Å; T349-H378 PolarHBondContact OG1-CE1 3.17Å; T349-G742 VanDerWaalsContact CG2-CA 3.46Å
350	D	79.1	Confident	83.5	Confident	10 Å²	10	40 Å²	40	5%	0.053	21%	0.206	C	C	.	.			trans	-101.5	105.9	175.3	-173.9	-10.5	0	0	0	110.3	M352 I353 L818	D350-M352 PolarHBondContact O-N 2.76Å; D350-M352 VanDerWaalsContact OD1-CB 3.25Å; D350-M352 WeakPolarHBondContact OD1-CB 2.98Å; D350-M352 PolarHBondContact OD1-N 3.11Å; D350-I353 HydrophobicContact CB-CD1 3.94Å; D350-I353 HydrophobicContact CB-CG1 4.09Å; D350-I353 PolarHBondContact O-N 2.76Å; D350-L818 WeakPolarHBondContact OD2-CB 3.39Å; D350-L818 PolarHBondContact OD2-N 2.98Å
351	L	80.6	Confident	83	Confident	47 Å²	47	39.9 Å²	39.9	25%	0.246	21%	0.206	C	C	.	.	H	α-helix	trans	-64.5	-18.7	177.7	-71.5	103.2	0	0	0	113	L354 K355	L351-L354 PolarHBondContact O-N 3.2Å; L351-K355 WeakPolarHBondContact O-CG 3.38Å; L351-K355 PolarHBondContact O-N 2.88Å
352	M	81.4	Confident	82.5	Confident	49 Å²	49	48.3 Å²	48.3	24%	0.241	24%	0.236	C	C	.	.	H	α-helix	trans	-71.5	-33.1	179	-61	-156	-141.7	0	0	112.8	D350 L354 K355 N356 L818 V820	D350-M352 PolarHBondContact O-N 2.76Å; D350-M352 VanDerWaalsContact OD1-CB 3.25Å; D350-M352 WeakPolarHBondContact OD1-CB 2.98Å; D350-M352 PolarHBondContact OD1-N 3.11Å; M352-L354 VanDerWaalsContact C-N 3.25Å; M352-L354 PolarHBondContact O-N 2.93Å; M352-K355 PolarHBondContact O-N 3.41Å; M352-N356 VanDerWaalsContact O-CG 3.27Å; M352-N356 PolarHBondContact O-N 3.15Å; M352-N356 PolarHBondContact O-ND2 3.42Å; M352-L818 WeakPolarHBondContact CE-O 3.32Å; M352-V820 HydrophobicContact CE-CB 4.04Å; M352-V820 HydrophobicContact CE-CG2 3.27Å; M352-V820 VanDerWaalsContact SD-CA 3.59Å; M352-V820 HydrophobicContact SD-CB 4.16Å; M352-V820 HydrophobicContact SD-CG1 4.4Å; M352-V820 HydrophobicContact SD-CG2 3.98Å
353	I	83.3	Confident	81.9	Confident	21 Å²	21	52.2 Å²	52.2	11%	0.108	26%	0.257	C	S	.	.	H	α-helix	trans	-58.2	-46.2	174.4	-61.3	175.9	0	0	0	109	D350 N356 T357 D739 L818	D350-I353 HydrophobicContact CB-CD1 3.94Å; D350-I353 HydrophobicContact CB-CG1 4.09Å; D350-I353 PolarHBondContact O-N 2.76Å; I353-N356 PolarHBondContact O-N 3.1Å; I353-T357 PolarHBondContact O-N 2.99Å; I353-T357 PolarHBondContact O-OG1 3.1Å; I353-T357 VanDerWaalsContact O-OG1 3.09Å; I353-D739 WeakPolarHBondContact CD1-OD2 3.45Å; I353-L818 HydrophobicContact CG1-CD1 3.85Å
354	L	83.4	Confident	81.1	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-65.1	-40.1	177.2	-70.3	170.7	0	0	0	112.8	L351 M352 T357 K358 N374 M377 F386	L351-L354 PolarHBondContact O-N 3.2Å; M352-L354 VanDerWaalsContact C-N 3.25Å; M352-L354 PolarHBondContact O-N 2.93Å; L354-T357 PolarHBondContact O-N 3.45Å; L354-K358 VanDerWaalsContact O-CB 3.28Å; L354-K358 WeakPolarHBondContact O-CB 3.45Å; L354-K358 PolarHBondContact O-N 3.05Å; L354-N374 HydrophobicContact CD1-CB 4.37Å; L354-N374 VanDerWaalsContact CD1-OD1 3.32Å; L354-N374 WeakPolarHBondContact CD1-OD1 3.27Å; L354-N374 HydrophobicContact CD2-CB 4.1Å; L354-M377 HydrophobicContact CD1-CE 4.16Å; L354-M377 HydrophobicContact CD1-SD 4.07Å; L354-M377 HydrophobicContact CD2-SD 3.58Å; L354-M377 VanDerWaalsContact CD2-SD 3.58Å; L354-M377 HydrophobicContact CG-CE 4Å; L354-M377 HydrophobicContact CG-SD 3.71Å; L354-F386 HydrophobicContact CB-CD2 4.08Å; L354-F386 HydrophobicContact CB-CE2 3.88Å; L354-F386 HydrophobicContact CD1-CD2 4.34Å
355	K	85.2	Confident	81	Confident	93 Å²	93	57 Å²	57	40%	0.404	29%	0.29	S	S	.	.	H	α-helix	trans	-62.3	-46.3	175.8	-73.7	179	-179.9	179	0	111.7	L351 M352 T357 K358 D359 E389	L351-K355 WeakPolarHBondContact O-CG 3.38Å; L351-K355 PolarHBondContact O-N 2.88Å; M352-K355 PolarHBondContact O-N 3.41Å; K355-T357 PolarHBondContact O-N 2.85Å; K355-K358 PolarHBondContact O-N 3.19Å; K355-D359 PolarHBondContact O-N 3.45Å; K355-E389 IonicContact NZ-OE2 3.95Å
356	N	86.1	Confident	81	Confident	75 Å²	75	54.4 Å²	54.4	40%	0.401	28%	0.281	S	S	.	.	H	α-helix	trans	-61.2	-44.5	177	-68.5	-19.2	0	0	0	111.7	M352 I353 D359 A360	M352-N356 VanDerWaalsContact O-CG 3.27Å; M352-N356 PolarHBondContact O-N 3.15Å; M352-N356 PolarHBondContact O-ND2 3.42Å; I353-N356 PolarHBondContact O-N 3.1Å; N356-D359 PolarHBondContact O-N 2.8Å; N356-A360 WeakPolarHBondContact O-CB 3.42Å; N356-A360 PolarHBondContact O-N 3.08Å; N356-A360 VanDerWaalsContact O-N 3.1Å
357	T	85.1	Confident	81	Confident	7 Å²	7	52.8 Å²	52.8	4%	0.043	27%	0.272	C	S	.	.	H	α-helix	trans	-65.2	-42.1	177.9	-61.9	0	0	0	0	111.4	I353 L354 K355 D359 A360 V361 T370 I718 I732 Q735	I353-T357 PolarHBondContact O-N 2.99Å; I353-T357 PolarHBondContact O-OG1 3.1Å; I353-T357 VanDerWaalsContact O-OG1 3.09Å; L354-T357 PolarHBondContact O-N 3.45Å; K355-T357 PolarHBondContact O-N 2.85Å; T357-D359 PolarHBondContact O-N 2.85Å; T357-A360 PolarHBondContact O-N 3.22Å; T357-V361 HydrophobicContact CG2-CG2 4.36Å; T357-V361 WeakPolarHBondContact O-CB 3.42Å; T357-V361 WeakPolarHBondContact O-CG2 3.46Å; T357-V361 PolarHBondContact O-N 3.03Å; T357-T370 HydrophobicContact CG2-CG2 4.27Å; T357-I718 HydrophobicContact CG2-CG2 4.29Å; T357-I732 HydrophobicContact CG2-CD1 4.21Å; T357-I732 HydrophobicContact CG2-CG1 3.85Å; T357-I732 HydrophobicContact CG2-CG2 4.09Å; T357-Q735 PolarHBondContact OG1-OE1 3.04Å; T357-Q735 VanDerWaalsContact OG1-OE1 3.09Å
358	K	85.8	Confident	81.2	Confident	47 Å²	47	50.9 Å²	50.9	20%	0.204	26%	0.262	C	S	.	.	H	α-helix	trans	-59.1	-46.2	175	-178.6	-162.8	167.6	-155.2	0	111.7	L354 K355 A360 V361 F386 N390 W393	L354-K358 VanDerWaalsContact O-CB 3.28Å; L354-K358 WeakPolarHBondContact O-CB 3.45Å; L354-K358 PolarHBondContact O-N 3.05Å; K355-K358 PolarHBondContact O-N 3.19Å; K358-A360 VanDerWaalsContact C-N 3.34Å; K358-A360 PolarHBondContact O-N 3.41Å; K358-V361 PolarHBondContact O-N 2.93Å; K358-F386 HydrophobicContact CD-CZ 4.49Å; K358-N390 WeakPolarHBondContact CE-OD1 3.45Å; K358-N390 PolarHBondContact NZ-OD1 2.92Å; K358-W393 HydrophobicContact CG-CD2 4.34Å; K358-W393 HydrophobicContact CG-CZ2 4.22Å
359	D	84.6	Confident	81.5	Confident	119 Å²	119	47.7 Å²	47.7	64%	0.636	25%	0.245	S	C	*	.	H	α-helix	trans	-69.3	-31.4	-176.6	-70.9	-17	0	0	0	112.8	K355 N356 T357 V361	K355-D359 PolarHBondContact O-N 3.45Å; N356-D359 PolarHBondContact O-N 2.8Å; T357-D359 PolarHBondContact O-N 2.85Å; D359-V361 VanDerWaalsContact C-N 3.33Å
360	A	81.3	Confident	82	Confident	36 Å²	36	46.7 Å²	46.7	30%	0.298	24%	0.239	S	C	.	.	H	α-helix	trans	-72	-27.3	174.6	0	0	0	0	0	112.8	N356 T357 K358 I718	N356-A360 WeakPolarHBondContact O-CB 3.42Å; N356-A360 PolarHBondContact O-N 3.08Å; N356-A360 VanDerWaalsContact O-N 3.1Å; T357-A360 PolarHBondContact O-N 3.22Å; K358-A360 VanDerWaalsContact C-N 3.34Å; K358-A360 PolarHBondContact O-N 3.41Å; A360-I718 HydrophobicContact CB-CG2 3.9Å
361	V	77.1	Confident	82.5	Confident	16 Å²	16	46.3 Å²	46.3	10%	0.097	24%	0.237	C	C	.	.			trans	-90.8	122.8	-168.8	164.7	0	0	0	0	112.7	T357 K358 D359 C366 I732	T357-V361 HydrophobicContact CG2-CG2 4.36Å; T357-V361 WeakPolarHBondContact O-CB 3.42Å; T357-V361 WeakPolarHBondContact O-CG2 3.46Å; T357-V361 PolarHBondContact O-N 3.03Å; K358-V361 PolarHBondContact O-N 2.93Å; D359-V361 VanDerWaalsContact C-N 3.33Å; V361-C366 HydrophobicContact CB-CB 4.17Å; V361-C366 HydrophobicContact CG1-CB 3.29Å; V361-C366 HydrophobicContact CG2-CB 3.84Å; V361-I732 HydrophobicContact CG2-CD1 3.79Å
362	R	70.9	Confident	83	Confident	217 Å²	217	44 Å²	44	82%	0.819	23%	0.225	S	C	*	.			trans	-119.3	-16.6	177.1	-60.3	-175.8	-178	-165.8	-2.8	114.9
363	N	75.4	Confident	83.5	Confident	83 Å²	83	41.9 Å²	41.9	44%	0.444	22%	0.215	S	C	.	.	S	Bend	trans	-94	149.4	-174.4	-67.7	-7.3	0	0	0	112.2	V365 C366 H367 V725	N363-V365 PolarHBondContact O-N 3.27Å; N363-C366 HydrophobicContact CB-CB 4.44Å; N363-C366 PolarHBondContact O-N 3.2Å; N363-H367 PolarHBondContact O-N 3.47Å; N363-V725 WeakPolarHBondContact ND2-CG2 3.4Å
364	S	70.4	Confident	83.9	Confident	73 Å²	73	40.9 Å²	40.9	51%	0.51	21%	0.21	S	C	.	.	H	α-helix	trans	-61.1	-39	-179.2	175.8	0	0	0	0	113.8	C366 H367 T368	S364-C366 PolarHBondContact O-N 3.44Å; S364-H367 WeakPolarHBondContact O-CB 3.29Å; S364-H367 PolarHBondContact O-N 2.98Å; S364-T368 PolarHBondContact O-N 2.87Å; S364-T368 VanDerWaalsContact O-N 3.13Å; S364-T368 PolarHBondContact O-OG1 3.46Å
365	V	83.4	Confident	84.2	Confident	54 Å²	54	40.7 Å²	40.7	33%	0.327	21%	0.209	S	C	.	.	H	α-helix	trans	-64.4	-41.3	176.7	174.5	0	0	0	0	111.4	N363 H367 T368 A369 V725 F729	N363-V365 PolarHBondContact O-N 3.27Å; V365-H367 VanDerWaalsContact C-N 3.33Å; V365-T368 WeakPolarHBondContact O-CB 3.49Å; V365-T368 PolarHBondContact O-N 3.43Å; V365-A369 PolarHBondContact O-N 2.94Å; V365-V725 HydrophobicContact CB-CG1 3.95Å; V365-V725 HydrophobicContact CG1-CG1 4.08Å; V365-F729 HydrophobicContact CG1-CB 4.46Å; V365-F729 HydrophobicContact CG1-CD2 3.67Å; V365-F729 HydrophobicContact CG1-CE2 4.38Å; V365-F729 HydrophobicContact CG1-CG 4.41Å
366	C	81.7	Confident	84.6	Confident	4 Å²	4	36.3 Å²	36.3	3%	0.027	19%	0.19	C	C	.	.	H	α-helix	trans	-70.3	-30.4	176.7	-63	0	0	0	0	112	V361 N363 S364 A369 T370 I732	V361-C366 HydrophobicContact CB-CB 4.17Å; V361-C366 HydrophobicContact CG1-CB 3.29Å; V361-C366 HydrophobicContact CG2-CB 3.84Å; N363-C366 HydrophobicContact CB-CB 4.44Å; N363-C366 PolarHBondContact O-N 3.2Å; S364-C366 PolarHBondContact O-N 3.44Å; C366-A369 WeakPolarHBondContact O-CB 3.11Å; C366-A369 PolarHBondContact O-N 3.49Å; C366-T370 WeakPolarHBondContact O-CB 3.2Å; C366-T370 PolarHBondContact O-N 3.23Å; C366-T370 PolarHBondContact O-OG1 3.35Å; C366-I732 HydrophobicContact CB-CD1 4.15Å
367	H	83.4	Confident	84.7	Confident	14 Å²	14	32.8 Å²	32.8	7%	0.065	17%	0.171	C	C	.	.	H	α-helix	trans	-59.9	-50.3	170.7	175.4	-73.5	0	0	0	110.2	N363 S364 V365 A369 T370 V371 W393	N363-H367 PolarHBondContact O-N 3.47Å; S364-H367 WeakPolarHBondContact O-CB 3.29Å; S364-H367 PolarHBondContact O-N 2.98Å; V365-H367 VanDerWaalsContact C-N 3.33Å; H367-A369 VanDerWaalsContact C-N 3.31Å; H367-A369 PolarHBondContact O-N 3.23Å; H367-T370 PolarHBondContact O-N 3.47Å; H367-V371 WeakPolarHBondContact O-CG2 3.38Å; H367-V371 PolarHBondContact O-N 2.82Å; H367-V371 VanDerWaalsContact O-N 3.08Å; H367-W393 HydrophobicContact CB-CZ2 4.28Å; H367-W393 AromaticContact CD2-CD2 3.74Å; H367-W393 AromaticContact CD2-CE2 3.3Å; H367-W393 AromaticContact CD2-CH2 3.64Å; H367-W393 AromaticContact CD2-CZ2 3.27Å; H367-W393 WeakPolarHBondContact CD2-CZ2 3.45Å; H367-W393 AromaticContact CD2-NE1 3.79Å; H367-W393 AromaticContact CG-CZ2 3.88Å; H367-W393 AromaticContact NE2-CD2 3.72Å; H367-W393 AromaticContact NE2-CE2 3.8Å; H367-W393 AromaticContact NE2-CE3 3.72Å; H367-W393 AromaticContact NE2-CH2 3.86Å; H367-W393 AromaticContact NE2-CZ2 3.89Å; H367-W393 AromaticContact NE2-CZ3 3.79Å; H367-W393 PolarHBondContact NE2-O 2.96Å
368	T	87.1	Confident	85	Confident	13 Å²	13	32.5 Å²	32.5	8%	0.08	17%	0.169	C	C	.	.	H	α-helix	trans	-55.7	-46.6	174.4	-51.1	0	0	0	0	111.2	S364 V365 T370 V371 I372 T404	S364-T368 PolarHBondContact O-N 2.87Å; S364-T368 VanDerWaalsContact O-N 3.13Å; S364-T368 PolarHBondContact O-OG1 3.46Å; V365-T368 WeakPolarHBondContact O-CB 3.49Å; V365-T368 PolarHBondContact O-N 3.43Å; T368-T370 VanDerWaalsContact C-N 3.33Å; T368-T370 PolarHBondContact O-N 3.3Å; T368-V371 PolarHBondContact O-N 3.15Å; T368-I372 HydrophobicContact CG2-CD1 3.87Å; T368-I372 WeakPolarHBondContact O-CD1 3.37Å; T368-I372 VanDerWaalsContact O-CG1 3.26Å; T368-I372 WeakPolarHBondContact O-CG1 3.46Å; T368-I372 PolarHBondContact O-N 3.39Å; T368-T404 HydrophobicContact CG2-CG2 3.63Å
369	A	88.4	Confident	85.1	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58.1	-42.9	177.3	0	0	0	0	0	112.9	V365 C366 H367 I372 A373 F729 I732	V365-A369 PolarHBondContact O-N 2.94Å; C366-A369 WeakPolarHBondContact O-CB 3.11Å; C366-A369 PolarHBondContact O-N 3.49Å; H367-A369 VanDerWaalsContact C-N 3.31Å; H367-A369 PolarHBondContact O-N 3.23Å; A369-I372 PolarHBondContact O-N 3.47Å; A369-A373 WeakPolarHBondContact O-CB 3.34Å; A369-A373 PolarHBondContact O-N 3.3Å; A369-F729 HydrophobicContact CB-CD2 3.48Å; A369-F729 VanDerWaalsContact CB-CD2 3.48Å; A369-F729 HydrophobicContact CB-CE2 3.81Å; A369-F729 HydrophobicContact CB-CG 4.12Å; A369-I732 HydrophobicContact CB-CB 3.96Å; A369-I732 HydrophobicContact CB-CD1 3.99Å; A369-I732 HydrophobicContact CB-CG2 3.79Å; A369-I732 WeakPolarHBondContact O-CG2 3.2Å
370	T	89.3	Confident	85.1	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-67.8	-39.6	-177.4	-53.9	0	0	0	0	111.1	T357 C366 H367 T368 A373 N374 F386 W393	T357-T370 HydrophobicContact CG2-CG2 4.27Å; C366-T370 WeakPolarHBondContact O-CB 3.2Å; C366-T370 PolarHBondContact O-N 3.23Å; C366-T370 PolarHBondContact O-OG1 3.35Å; H367-T370 PolarHBondContact O-N 3.47Å; T368-T370 VanDerWaalsContact C-N 3.33Å; T368-T370 PolarHBondContact O-N 3.3Å; T370-A373 PolarHBondContact O-N 2.7Å; T370-N374 WeakPolarHBondContact O-CB 3.45Å; T370-N374 PolarHBondContact O-N 3.19Å; T370-F386 HydrophobicContact CG2-CZ 4.41Å; T370-W393 HydrophobicContact CG2-CH2 3.8Å; T370-W393 HydrophobicContact CG2-CZ2 4.34Å
371	V	89.6	Confident	85.3	Confident	1 Å²	1	23.5 Å²	23.5	1%	0.006	12%	0.119	C	C	.	.	H	α-helix	trans	-67.3	-39.4	175.4	179.3	0	0	0	0	111.3	H367 T368 S375 W393 A405 S408	H367-V371 WeakPolarHBondContact O-CG2 3.38Å; H367-V371 PolarHBondContact O-N 2.82Å; H367-V371 VanDerWaalsContact O-N 3.08Å; T368-V371 PolarHBondContact O-N 3.15Å; V371-S375 PolarHBondContact O-N 2.97Å; V371-W393 HydrophobicContact CG2-CH2 3.91Å; V371-W393 HydrophobicContact CG2-CZ3 3.73Å; V371-A405 HydrophobicContact CG1-CB 4.32Å; V371-S408 WeakPolarHBondContact CG1-OG 3.34Å
372	I	91.2	Very high	85.6	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-65.1	-44.1	173.8	-63.5	158.7	0	0	0	110.7	T368 A369 N374 S375 F376 T404 L733 S777	T368-I372 HydrophobicContact CG2-CD1 3.87Å; T368-I372 WeakPolarHBondContact O-CD1 3.37Å; T368-I372 VanDerWaalsContact O-CG1 3.26Å; T368-I372 WeakPolarHBondContact O-CG1 3.46Å; T368-I372 PolarHBondContact O-N 3.39Å; A369-I372 PolarHBondContact O-N 3.47Å; I372-N374 PolarHBondContact O-N 3.42Å; I372-S375 WeakPolarHBondContact O-CA 3.14Å; I372-S375 WeakPolarHBondContact O-CB 3.44Å; I372-S375 PolarHBondContact O-N 3.25Å; I372-S375 PolarHBondContact O-OG 3.33Å; I372-F376 HydrophobicContact CG2-CD1 4.49Å; I372-F376 HydrophobicContact CG2-CD2 4.04Å; I372-F376 HydrophobicContact CG2-CE1 3.97Å; I372-F376 HydrophobicContact CG2-CE2 3.46Å; I372-F376 VanDerWaalsContact CG2-CE2 3.46Å; I372-F376 HydrophobicContact CG2-CZ 3.42Å; I372-F376 VanDerWaalsContact CG2-CZ 3.42Å; I372-F376 PolarHBondContact O-N 2.9Å; I372-T404 HydrophobicContact CD1-CG2 3.86Å; I372-T404 HydrophobicContact CG1-CG2 3.57Å; I372-L733 HydrophobicContact CB-CD2 3.88Å; I372-L733 HydrophobicContact CG2-CD2 3.49Å; I372-L733 VanDerWaalsContact CG2-CD2 3.49Å; I372-S777 VanDerWaalsContact CD1-OG 3.22Å; I372-S777 WeakPolarHBondContact CD1-OG 3.35Å
373	A	91.1	Very high	86	Confident	3 Å²	3	13.6 Å²	13.6	3%	0.025	8%	0.084	C	C	.	.	H	α-helix	trans	-61.1	-43.6	178.3	0	0	0	0	0	111.8	A369 T370 S375 F376 M377 I732	A369-A373 WeakPolarHBondContact O-CB 3.34Å; A369-A373 PolarHBondContact O-N 3.3Å; T370-A373 PolarHBondContact O-N 2.7Å; A373-S375 VanDerWaalsContact C-N 3.27Å; A373-S375 PolarHBondContact O-N 2.9Å; A373-F376 PolarHBondContact O-N 3.44Å; A373-M377 WeakPolarHBondContact O-CG 3.44Å; A373-M377 PolarHBondContact O-N 2.94Å; A373-I732 HydrophobicContact CB-CG2 3.72Å; A373-I732 WeakPolarHBondContact CB-O 3.32Å
374	N	90.7	Very high	86.2	Confident	0 Å²	0	10.2 Å²	10.2	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-55.8	-44.2	171.1	178.8	67.1	0	0	0	111.4	L354 T370 I372 F376 M377 H378 F386	L354-N374 HydrophobicContact CD1-CB 4.37Å; L354-N374 VanDerWaalsContact CD1-OD1 3.32Å; L354-N374 WeakPolarHBondContact CD1-OD1 3.27Å; L354-N374 HydrophobicContact CD2-CB 4.1Å; T370-N374 WeakPolarHBondContact O-CB 3.45Å; T370-N374 PolarHBondContact O-N 3.19Å; I372-N374 PolarHBondContact O-N 3.42Å; N374-F376 VanDerWaalsContact C-N 3.32Å; N374-F376 PolarHBondContact O-N 3.11Å; N374-M377 PolarHBondContact O-N 3.35Å; N374-H378 WeakPolarHBondContact O-CB 3.12Å; N374-H378 PolarHBondContact O-CD2 3.41Å; N374-H378 PolarHBondContact O-N 3.24Å; N374-H378 PolarHBondContact OD1-CD2 3.25Å; N374-F386 HydrophobicContact CB-CD1 4.06Å; N374-F386 HydrophobicContact CB-CE1 4.27Å; N374-F386 VanDerWaalsContact CG-CD1 3.48Å; N374-F386 WeakPolarHBondContact OD1-CB 3.41Å; N374-F386 WeakPolarHBondContact OD1-CD1 3.33Å
375	S	90.8	Very high	86.8	Confident	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-62.7	-38	179.3	84.5	0	0	0	0	113.2	V371 I372 A373 T379 V411	V371-S375 PolarHBondContact O-N 2.97Å; I372-S375 WeakPolarHBondContact O-CA 3.14Å; I372-S375 WeakPolarHBondContact O-CB 3.44Å; I372-S375 PolarHBondContact O-N 3.25Å; I372-S375 PolarHBondContact O-OG 3.33Å; A373-S375 VanDerWaalsContact C-N 3.27Å; A373-S375 PolarHBondContact O-N 2.9Å; S375-T379 PolarHBondContact O-N 3.05Å; S375-T379 VanDerWaalsContact O-N 3.1Å; S375-T379 PolarHBondContact O-OG1 3.05Å; S375-V411 WeakPolarHBondContact O-CG1 3.47Å
376	F	92.4	Very high	86.7	Confident	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-70.6	-45.3	175.7	-63.8	-21.1	0	0	0	111.7	I372 A373 N374 H378 T379 V411 L733 G736 I737 A740 G741 S777 L780 F784	I372-F376 HydrophobicContact CG2-CD1 4.49Å; I372-F376 HydrophobicContact CG2-CD2 4.04Å; I372-F376 HydrophobicContact CG2-CE1 3.97Å; I372-F376 HydrophobicContact CG2-CE2 3.46Å; I372-F376 VanDerWaalsContact CG2-CE2 3.46Å; I372-F376 HydrophobicContact CG2-CZ 3.42Å; I372-F376 VanDerWaalsContact CG2-CZ 3.42Å; I372-F376 PolarHBondContact O-N 2.9Å; A373-F376 PolarHBondContact O-N 3.44Å; N374-F376 VanDerWaalsContact C-N 3.32Å; N374-F376 PolarHBondContact O-N 3.11Å; F376-H378 VanDerWaalsContact C-N 3.27Å; F376-H378 PolarHBondContact O-N 2.87Å; F376-T379 WeakPolarHBondContact CA-OG1 3.42Å; F376-T379 PolarHBondContact O-N 3.15Å; F376-T379 PolarHBondContact O-OG1 2.74Å; F376-T379 VanDerWaalsContact O-OG1 3.04Å; F376-V411 HydrophobicContact CD1-CG1 4.47Å; F376-L733 HydrophobicContact CE2-CD2 4.08Å; F376-G736 WeakPolarHBondContact CB-O 3.24Å; F376-I737 HydrophobicContact CD2-CG1 3.99Å; F376-I737 HydrophobicContact CE2-CG1 4.22Å; F376-A740 CarbonylContact O-C 3.05Å; F376-A740 VanDerWaalsContact O-CA 3.23Å; F376-A740 WeakPolarHBondContact O-CA 3.16Å; F376-G741 PolarHBondContact O-N 3.49Å; F376-S777 VanDerWaalsContact CZ-O 3.28Å; F376-S777 WeakPolarHBondContact CZ-O 3.46Å; F376-L780 HydrophobicContact CD2-CD2 4.3Å; F376-L780 HydrophobicContact CE1-CB 4.02Å; F376-L780 HydrophobicContact CE1-CD2 4.37Å; F376-L780 HydrophobicContact CE2-CD2 3.76Å; F376-L780 HydrophobicContact CZ-CB 3.85Å; F376-L780 HydrophobicContact CZ-CD2 3.8Å; F376-L780 HydrophobicContact CZ-CG 4.4Å; F376-F784 HydrophobicContact CB-CE2 4.05Å; F376-F784 HydrophobicContact CB-CZ 4.08Å; F376-F784 AromaticContact CD1-CE2 3.65Å; F376-F784 HydrophobicContact CD1-CE2 3.65Å; F376-F784 HydrophobicContact CD1-CZ 4.09Å; F376-F784 HydrophobicContact CE1-CE2 4.32Å; F376-F784 AromaticContact CG-CE2 3.98Å; F376-F784 HydrophobicContact CG-CE2 3.98Å; F376-F784 HydrophobicContact CG-CZ 4.02Å
377	M	90.2	Very high	86.7	Confident	1 Å²	1	9.1 Å²	9.1	1%	0.005	5%	0.049	C	C	.	.	H	α-helix	trans	-58.2	-40.5	178	-70.4	177.4	67.2	0	0	112.2	T349 L354 A373 N374 D739 G741 G742	T349-M377 HydrophobicContact CG2-CB 4.18Å; T349-M377 WeakPolarHBondContact CG2-O 3.37Å; L354-M377 HydrophobicContact CD1-CE 4.16Å; L354-M377 HydrophobicContact CD1-SD 4.07Å; L354-M377 HydrophobicContact CD2-SD 3.58Å; L354-M377 VanDerWaalsContact CD2-SD 3.58Å; L354-M377 HydrophobicContact CG-CE 4Å; L354-M377 HydrophobicContact CG-SD 3.71Å; A373-M377 WeakPolarHBondContact O-CG 3.44Å; A373-M377 PolarHBondContact O-N 2.94Å; N374-M377 PolarHBondContact O-N 3.35Å; M377-D739 WeakPolarHBondContact CA-O 3.32Å; M377-D739 HydrophobicContact CE-CB 3.98Å; M377-D739 HydrophobicContact CG-CB 3.95Å; M377-D739 HydrophobicContact SD-CB 4.39Å; M377-G741 CarbonylContact O-C 3.6Å; M377-G741 VanDerWaalsContact O-CA 3.27Å; M377-G741 WeakPolarHBondContact O-CA 3.41Å; M377-G741 PolarHBondContact O-N 3.01Å; M377-G742 PolarHBondContact O-N 3.36Å
378	H	89.9	Confident	86.5	Confident	1 Å²	1	15.4 Å²	15.4	1%	0.005	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	16.2	-175.7	-66.5	-74.4	0	0	0	114.4	T349 N374 F376 G380 T381 I412	T349-H378 PolarHBondContact OG1-CE1 3.17Å; N374-H378 WeakPolarHBondContact O-CB 3.12Å; N374-H378 PolarHBondContact O-CD2 3.41Å; N374-H378 PolarHBondContact O-N 3.24Å; N374-H378 PolarHBondContact OD1-CD2 3.25Å; F376-H378 VanDerWaalsContact C-N 3.27Å; F376-H378 PolarHBondContact O-N 2.87Å; H378-G380 PolarHBondContact O-N 3.17Å; H378-G380 VanDerWaalsContact O-N 3.17Å; H378-T381 WeakPolarHBondContact CA-OG1 3.49Å; H378-T381 WeakPolarHBondContact CB-OG1 3.21Å; H378-T381 PolarHBondContact O-N 2.84Å; H378-T381 VanDerWaalsContact O-N 3.08Å; H378-T381 PolarHBondContact O-OG1 3.43Å; H378-I412 HydrophobicContact CB-CG1 4.2Å; H378-I412 HydrophobicContact CB-CG2 4.26Å
379	T	88.6	Confident	86.3	Confident	6 Å²	6	19.3 Å²	19.3	4%	0.037	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	122.9	-179.4	-60.9	0	0	0	0	111.3	S375 F376 T381 V411 K414 F784	S375-T379 PolarHBondContact O-N 3.05Å; S375-T379 VanDerWaalsContact O-N 3.1Å; S375-T379 PolarHBondContact O-OG1 3.05Å; F376-T379 WeakPolarHBondContact CA-OG1 3.42Å; F376-T379 PolarHBondContact O-N 3.15Å; F376-T379 PolarHBondContact O-OG1 2.74Å; F376-T379 VanDerWaalsContact O-OG1 3.04Å; T379-T381 PolarHBondContact O-N 3.47Å; T379-V411 WeakPolarHBondContact CA-O 3.43Å; T379-V411 HydrophobicContact CG2-CG1 4.1Å; T379-V411 VanDerWaalsContact OG1-CG1 3.31Å; T379-V411 WeakPolarHBondContact OG1-CG1 3.45Å; T379-K414 HydrophobicContact CG2-CB 4.49Å; T379-K414 HydrophobicContact CG2-CD 4.36Å; T379-F784 HydrophobicContact CG2-CD2 4.09Å
380	G	84.6	Confident	85.9	Confident	3 Å²	3	20.2 Å²	20.2	3%	0.031	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.1	10	177.6	0	0	0	0	0	115.4	L340 L343 H378 V411 I412 K414	L340-G380 VanDerWaalsContact CD1-O 3.28Å; L340-G380 WeakPolarHBondContact CD1-O 3.48Å; L343-G380 WeakPolarHBondContact CB-O 3.28Å; H378-G380 PolarHBondContact O-N 3.17Å; H378-G380 VanDerWaalsContact O-N 3.17Å; G380-V411 PolarHBondContact N-O 3.35Å; G380-I412 WeakPolarHBondContact CA-O 3.42Å; G380-I412 PolarHBondContact N-O 3.38Å; G380-I412 VanDerWaalsContact N-O 3.08Å; G380-K414 WeakPolarHBondContact CA-O 3.39Å
381	T	84.3	Confident	85.4	Confident	4 Å²	4	25.3 Å²	25.3	3%	0.025	12%	0.121	C	C	.	.	S	Bend	trans	-92.1	-11.1	177.4	64.6	0	0	0	0	112.8	L343 N347 H378 T379 S383	L343-T381 HydrophobicContact CB-CG2 4.46Å; N347-T381 HydrophobicContact CB-CG2 4.41Å; H378-T381 WeakPolarHBondContact CA-OG1 3.49Å; H378-T381 WeakPolarHBondContact CB-OG1 3.21Å; H378-T381 PolarHBondContact O-N 2.84Å; H378-T381 VanDerWaalsContact O-N 3.08Å; H378-T381 PolarHBondContact O-OG1 3.43Å; T379-T381 PolarHBondContact O-N 3.47Å; T381-S383 PolarHBondContact O-N 3.06Å
382	T	84	Confident	84.7	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.158	C	C	.	.			trans	58.3	6.9	-174	68.3	0	0	0	0	115.6	L340 I344 D384 I412 H413 H941	L340-T382 HydrophobicContact CD1-CG2 3.94Å; I344-T382 HydrophobicContact CD1-CG2 4.26Å; T382-D384 PolarHBondContact O-N 3.5Å; T382-I412 PolarHBondContact N-O 3.41Å; T382-H413 PolarHBondContact O-CE1 2.9Å; T382-H941 PolarHBondContact OG1-N 3.47Å
383	S	79.7	Confident	83.9	Confident	25 Å²	25	34.7 Å²	34.7	18%	0.175	16%	0.164	C	C	.	.			trans	-82.9	107	178.8	-174.5	0	0	0	0	110.6	T381 I412	T381-S383 PolarHBondContact O-N 3.06Å; S383-I412 WeakPolarHBondContact O-CG2 3.46Å
384	D	79.8	Confident	83	Confident	12 Å²	12	36.7 Å²	36.7	6%	0.064	17%	0.174	C	C	.	.			trans	-105.3	15	176.7	67.7	-10	0	0	0	112.9	T382 F386 L387 R388 H941	T382-D384 PolarHBondContact O-N 3.5Å; D384-F386 VanDerWaalsContact C-N 3.26Å; D384-F386 PolarHBondContact O-N 3.28Å; D384-L387 HydrophobicContact CB-CD1 4.46Å; D384-L387 WeakPolarHBondContact O-CB 3.38Å; D384-L387 PolarHBondContact O-N 3.44Å; D384-R388 PolarHBondContact O-N 3.12Å; D384-R388 IonicContact OD1-CZ 2.72Å; D384-R388 IonicContact OD1-NE 3.2Å; D384-R388 PolarHBondContact OD1-NE 3.38Å; D384-R388 IonicContact OD1-NH2 2.85Å; D384-R388 IonicContact OD2-CZ 3.95Å; D384-R388 IonicContact OD2-NE 3.79Å; D384-R388 PolarHBondContact OD2-NE 3.03Å; D384-R388 IonicContact OD2-NH2 2.74Å; D384-R388 PolarHBondContact OD2-NH2 3Å; D384-H941 IonicContact OD1-NE2 3.72Å
385	Q	82.9	Confident	82.2	Confident	88 Å²	88	40 Å²	40	41%	0.411	20%	0.201	S	C	.	.	H	α-helix	trans	-51.6	-43.6	-177.9	-177.8	176.8	5.1	0	0	112.2	L387 R388 E389	Q385-L387 VanDerWaalsContact C-N 3.3Å; Q385-L387 PolarHBondContact O-N 3.36Å; Q385-R388 PolarHBondContact O-N 3.2Å; Q385-E389 HydrophobicContact CG-CG 4.24Å; Q385-E389 WeakPolarHBondContact CG-OE1 3.3Å; Q385-E389 PolarHBondContact NE2-OE1 3.46Å; Q385-E389 WeakPolarHBondContact O-CB 3.11Å; Q385-E389 WeakPolarHBondContact O-CG 3.2Å; Q385-E389 PolarHBondContact O-N 2.95Å
386	F	81.6	Confident	81.7	Confident	4 Å²	4	49.1 Å²	49.1	2%	0.018	24%	0.236	C	C	.	.	H	α-helix	trans	-60.2	-38.3	178.1	178.9	-95.3	0	0	0	112.7	L354 K358 T370 N374 D384 N390 W393	L354-F386 HydrophobicContact CB-CD2 4.08Å; L354-F386 HydrophobicContact CB-CE2 3.88Å; L354-F386 HydrophobicContact CD1-CD2 4.34Å; K358-F386 HydrophobicContact CD-CZ 4.49Å; T370-F386 HydrophobicContact CG2-CZ 4.41Å; N374-F386 HydrophobicContact CB-CD1 4.06Å; N374-F386 HydrophobicContact CB-CE1 4.27Å; N374-F386 VanDerWaalsContact CG-CD1 3.48Å; N374-F386 WeakPolarHBondContact OD1-CB 3.41Å; N374-F386 WeakPolarHBondContact OD1-CD1 3.33Å; D384-F386 VanDerWaalsContact C-N 3.26Å; D384-F386 PolarHBondContact O-N 3.28Å; F386-N390 WeakPolarHBondContact O-CB 3.42Å; F386-N390 PolarHBondContact O-N 3.47Å; F386-N390 PolarHBondContact O-ND2 2.77Å; F386-W393 HydrophobicContact CE1-CZ3 4.05Å; F386-W393 HydrophobicContact CZ-CZ3 4.25Å
387	L	80.3	Confident	81	Confident	16 Å²	16	49.3 Å²	49.3	8%	0.084	24%	0.237	C	C	.	.	H	α-helix	trans	-73.2	-41.3	179.7	-69.2	162	0	0	0	110.8	D384 Q385 N390 L391 L394 L409 I412	D384-L387 HydrophobicContact CB-CD1 4.46Å; D384-L387 WeakPolarHBondContact O-CB 3.38Å; D384-L387 PolarHBondContact O-N 3.44Å; Q385-L387 VanDerWaalsContact C-N 3.3Å; Q385-L387 PolarHBondContact O-N 3.36Å; L387-N390 CarbonylContact O-C 3.51Å; L387-N390 PolarHBondContact O-N 3.16Å; L387-L391 PolarHBondContact O-N 2.74Å; L387-L394 HydrophobicContact CD2-CD1 3.29Å; L387-L409 HydrophobicContact CD1-CD1 3.99Å; L387-L409 HydrophobicContact CD1-CG 4.15Å; L387-I412 HydrophobicContact CD1-CD1 3.63Å
388	R	80.8	Confident	80.7	Confident	146 Å²	146	53.2 Å²	53.2	55%	0.551	26%	0.261	S	S	*	.	H	α-helix	trans	-64.4	-45.4	178.5	-66.3	-177.1	-173.3	-96.2	-7.8	112.4	D384 Q385 N390 L391	D384-R388 PolarHBondContact O-N 3.12Å; D384-R388 IonicContact OD1-CZ 2.72Å; D384-R388 IonicContact OD1-NE 3.2Å; D384-R388 PolarHBondContact OD1-NE 3.38Å; D384-R388 IonicContact OD1-NH2 2.85Å; D384-R388 IonicContact OD2-CZ 3.95Å; D384-R388 IonicContact OD2-NE 3.79Å; D384-R388 PolarHBondContact OD2-NE 3.03Å; D384-R388 IonicContact OD2-NH2 2.74Å; D384-R388 PolarHBondContact OD2-NH2 3Å; Q385-R388 PolarHBondContact O-N 3.2Å; R388-N390 PolarHBondContact O-N 2.89Å; R388-L391 WeakPolarHBondContact O-CD1 3.3Å
389	E	82.7	Confident	80.6	Confident	95 Å²	95	57.6 Å²	57.6	44%	0.444	28%	0.284	S	S	.	.	H	α-helix	trans	-64.8	-22.6	178	-72.8	-178.4	-173.2	0	0	112.8	K355 Q385	K355-E389 IonicContact NZ-OE2 3.95Å; Q385-E389 HydrophobicContact CG-CG 4.24Å; Q385-E389 WeakPolarHBondContact CG-OE1 3.3Å; Q385-E389 PolarHBondContact NE2-OE1 3.46Å; Q385-E389 WeakPolarHBondContact O-CB 3.11Å; Q385-E389 WeakPolarHBondContact O-CG 3.2Å; Q385-E389 PolarHBondContact O-N 2.95Å
390	N	80.6	Confident	80.6	Confident	19 Å²	19	60.5 Å²	60.5	10%	0.102	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.9	28.7	-169.9	-60	-64.1	0	0	0	113.7	K358 F386 L387 R388 E392 W393 L394	K358-N390 WeakPolarHBondContact CE-OD1 3.45Å; K358-N390 PolarHBondContact NZ-OD1 2.92Å; F386-N390 WeakPolarHBondContact O-CB 3.42Å; F386-N390 PolarHBondContact O-N 3.47Å; F386-N390 PolarHBondContact O-ND2 2.77Å; L387-N390 CarbonylContact O-C 3.51Å; L387-N390 PolarHBondContact O-N 3.16Å; R388-N390 PolarHBondContact O-N 2.89Å; N390-E392 VanDerWaalsContact C-N 3.31Å; N390-E392 PolarHBondContact O-N 3.29Å; N390-W393 HydrophobicContact CB-CB 4.3Å; N390-W393 HydrophobicContact CB-CE3 4.4Å; N390-W393 WeakPolarHBondContact O-CA 3.49Å; N390-W393 WeakPolarHBondContact O-CB 3.49Å; N390-W393 PolarHBondContact O-N 2.76Å; N390-L394 PolarHBondContact O-N 2.87Å
391	L	77.3	Confident	80.7	Confident	108 Å²	108	60.8 Å²	60.8	57%	0.565	30%	0.297	S	S	*	.	H	α-helix	trans	-52.3	-43.1	178.9	-88.3	153.8	0	0	0	113.5	L387 R388 W393 L394 A395	L387-L391 PolarHBondContact O-N 2.74Å; R388-L391 WeakPolarHBondContact O-CD1 3.3Å; L391-W393 VanDerWaalsContact C-N 3.28Å; L391-W393 PolarHBondContact O-N 3.41Å; L391-L394 PolarHBondContact O-N 2.9Å; L391-A395 WeakPolarHBondContact O-CB 3.41Å; L391-A395 PolarHBondContact O-N 3.21Å
392	E	75.7	Confident	80.8	Confident	168 Å²	168	63.9 Å²	63.9	79%	0.785	31%	0.31	S	S	*	.	H	α-helix	trans	-63.8	-33.3	177.6	-65.8	-175.1	175.4	0	0	113	N390	N390-E392 VanDerWaalsContact C-N 3.31Å; N390-E392 PolarHBondContact O-N 3.29Å
393	W	74.9	Confident	81.1	Confident	30 Å²	30	63.9 Å²	63.9	11%	0.114	31%	0.31	C	S	.	.	H	α-helix	trans	-73.3	-41.9	177.2	178.3	78.1	0	0	0	110.3	K358 H367 T370 V371 F386 N390 L391 A395 R396	K358-W393 HydrophobicContact CG-CD2 4.34Å; K358-W393 HydrophobicContact CG-CZ2 4.22Å; H367-W393 HydrophobicContact CB-CZ2 4.28Å; H367-W393 AromaticContact CD2-CD2 3.74Å; H367-W393 AromaticContact CD2-CE2 3.3Å; H367-W393 AromaticContact CD2-CH2 3.64Å; H367-W393 AromaticContact CD2-CZ2 3.27Å; H367-W393 WeakPolarHBondContact CD2-CZ2 3.45Å; H367-W393 AromaticContact CD2-NE1 3.79Å; H367-W393 AromaticContact CG-CZ2 3.88Å; H367-W393 AromaticContact NE2-CD2 3.72Å; H367-W393 AromaticContact NE2-CE2 3.8Å; H367-W393 AromaticContact NE2-CE3 3.72Å; H367-W393 AromaticContact NE2-CH2 3.86Å; H367-W393 AromaticContact NE2-CZ2 3.89Å; H367-W393 AromaticContact NE2-CZ3 3.79Å; H367-W393 PolarHBondContact NE2-O 2.96Å; T370-W393 HydrophobicContact CG2-CH2 3.8Å; T370-W393 HydrophobicContact CG2-CZ2 4.34Å; V371-W393 HydrophobicContact CG2-CH2 3.91Å; V371-W393 HydrophobicContact CG2-CZ3 3.73Å; F386-W393 HydrophobicContact CE1-CZ3 4.05Å; F386-W393 HydrophobicContact CZ-CZ3 4.25Å; N390-W393 HydrophobicContact CB-CB 4.3Å; N390-W393 HydrophobicContact CB-CE3 4.4Å; N390-W393 WeakPolarHBondContact O-CA 3.49Å; N390-W393 WeakPolarHBondContact O-CB 3.49Å; N390-W393 PolarHBondContact O-N 2.76Å; L391-W393 VanDerWaalsContact C-N 3.28Å; L391-W393 PolarHBondContact O-N 3.41Å; W393-A395 VanDerWaalsContact C-N 3.32Å; W393-A395 PolarHBondContact O-N 2.66Å; W393-R396 VanDerWaalsContact O-CB 3.32Å; W393-R396 WeakPolarHBondContact O-CB 3.4Å; W393-R396 PolarHBondContact O-N 3.43Å; W393-R396 VanDerWaalsContact O-N 3.15Å
394	L	70.4	Confident	81.6	Confident	44 Å²	44	62.8 Å²	62.8	23%	0.23	30%	0.302	C	S	.	.	H	α-helix	trans	-66.7	-32.3	176.3	-162.9	132.6	0	0	0	112.7	L387 N390 L391 R396 A397 A405	L387-L394 HydrophobicContact CD2-CD1 3.29Å; N390-L394 PolarHBondContact O-N 2.87Å; L391-L394 PolarHBondContact O-N 2.9Å; L394-R396 PolarHBondContact O-N 3.36Å; L394-A397 WeakPolarHBondContact O-CB 3.34Å; L394-A397 PolarHBondContact O-N 3.3Å; L394-A405 HydrophobicContact CD1-CB 4.11Å; L394-A405 HydrophobicContact CD2-CB 4.27Å; L394-A405 HydrophobicContact CG-CB 4.18Å
395	A	75	Confident	82	Confident	71 Å²	71	62.3 Å²	62.3	59%	0.587	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-21.1	174.3	0	0	0	0	0	113.3	L391 W393 A397	L391-A395 WeakPolarHBondContact O-CB 3.41Å; L391-A395 PolarHBondContact O-N 3.21Å; W393-A395 VanDerWaalsContact C-N 3.32Å; W393-A395 PolarHBondContact O-N 2.66Å; A395-A397 VanDerWaalsContact C-N 3.26Å; A395-A397 PolarHBondContact O-N 3.08Å
396	R	79.6	Confident	82.3	Confident	191 Å²	191	58.5 Å²	58.5	72%	0.721	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-13.9	174.8	-60	178.1	-179.6	-175.7	-0.1	113.1	W393 L394	W393-R396 VanDerWaalsContact O-CB 3.32Å; W393-R396 WeakPolarHBondContact O-CB 3.4Å; W393-R396 PolarHBondContact O-N 3.43Å; W393-R396 VanDerWaalsContact O-N 3.15Å; L394-R396 PolarHBondContact O-N 3.36Å
397	A	78.8	Confident	82.7	Confident	3 Å²	3	58.3 Å²	58.3	3%	0.025	28%	0.282	C	S	.	.			trans	-61.9	141.3	174.5	0	0	0	0	0	110.2	L394 A395 A401 K402	L394-A397 WeakPolarHBondContact O-CB 3.34Å; L394-A397 PolarHBondContact O-N 3.3Å; A395-A397 VanDerWaalsContact C-N 3.26Å; A395-A397 PolarHBondContact O-N 3.08Å; A397-A401 HydrophobicContact CB-CB 3.91Å; A397-K402 HydrophobicContact CB-CG 3.92Å; A397-K402 WeakPolarHBondContact O-CE 3.39Å; A397-K402 VanDerWaalsContact O-CG 3.27Å; A397-K402 WeakPolarHBondContact O-CG 3.23Å
398	T	83	Confident	83.2	Confident	84 Å²	84	57.6 Å²	57.6	52%	0.515	28%	0.278	S	S	.	.			trans	-127.5	148.4	177.7	55	0	0	0	0	110.4	W400 A401	T398-W400 PolarHBondContact O-N 3.47Å; T398-A401 WeakPolarHBondContact O-CB 3.42Å; T398-A401 PolarHBondContact O-N 3.29Å
399	N	88	Confident	83.6	Confident	92 Å²	92	51.1 Å²	51.1	49%	0.492	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	-118.9	176.2	-55.7	-24.2	0	0	0	113.3	A401 K402 F403 Y438	N399-A401 VanDerWaalsContact C-N 3.26Å; N399-A401 PolarHBondContact O-N 3.2Å; N399-K402 WeakPolarHBondContact O-CA 3.39Å; N399-K402 WeakPolarHBondContact O-CB 3.49Å; N399-K402 PolarHBondContact O-N 3.39Å; N399-F403 PolarHBondContact O-N 2.96Å; N399-Y438 HydrophobicContact CB-CD2 4.49Å; N399-Y438 HydrophobicContact CB-CE1 4.35Å; N399-Y438 HydrophobicContact CB-CE2 4.08Å
400	W	88.1	Confident	83.9	Confident	67 Å²	67	46.6 Å²	46.6	25%	0.254	23%	0.234	S	C	.	.	H	α-helix	trans	-62.4	-25.6	-179.2	-65.6	108.5	0	0	0	114.4	T398 K402 F403 T404 Y438 I473 V508 W773	T398-W400 PolarHBondContact O-N 3.47Å; W400-K402 VanDerWaalsContact C-N 3.28Å; W400-K402 PolarHBondContact O-N 3.4Å; W400-F403 HydrophobicContact CE3-CB 3.89Å; W400-F403 HydrophobicContact CE3-CD1 4.23Å; W400-F403 HydrophobicContact CE3-CD2 4.24Å; W400-F403 AromaticContact CE3-CG 3.87Å; W400-F403 HydrophobicContact CE3-CG 3.87Å; W400-F403 HydrophobicContact CZ3-CB 4.37Å; W400-F403 HydrophobicContact CZ3-CD1 4.34Å; W400-F403 AromaticContact CZ3-CD2 3.86Å; W400-F403 HydrophobicContact CZ3-CD2 3.86Å; W400-F403 HydrophobicContact CZ3-CE2 4.2Å; W400-F403 AromaticContact CZ3-CG 3.94Å; W400-F403 HydrophobicContact CZ3-CG 3.94Å; W400-F403 WeakPolarHBondContact O-CB 3.41Å; W400-F403 PolarHBondContact O-N 3.41Å; W400-T404 PolarHBondContact O-N 2.92Å; W400-T404 PolarHBondContact O-OG1 3.44Å; W400-Y438 HydrophobicContact CD2-CD1 4.13Å; W400-Y438 AromaticContact CD2-CE1 3.81Å; W400-Y438 HydrophobicContact CD2-CE1 3.81Å; W400-Y438 AromaticContact CE2-CE1 3.56Å; W400-Y438 HydrophobicContact CE3-CD1 4.11Å; W400-Y438 HydrophobicContact CE3-CE1 4.18Å; W400-Y438 HydrophobicContact CG-CE1 4.28Å; W400-Y438 HydrophobicContact CH2-CD1 4.41Å; W400-Y438 HydrophobicContact CH2-CE1 4.06Å; W400-Y438 HydrophobicContact CZ2-CD1 4.43Å; W400-Y438 AromaticContact CZ2-CE1 3.69Å; W400-Y438 HydrophobicContact CZ2-CE1 3.69Å; W400-Y438 HydrophobicContact CZ3-CD1 4.25Å; W400-Y438 HydrophobicContact CZ3-CE1 4.29Å; W400-Y438 AromaticContact NE1-CE1 3.94Å; W400-I473 HydrophobicContact CH2-CG2 4.41Å; W400-V508 HydrophobicContact CH2-CG1 3.86Å; W400-V508 HydrophobicContact CZ2-CG1 4.12Å; W400-W773 AromaticContact CD2-CH2 3.73Å; W400-W773 HydrophobicContact CD2-CH2 3.73Å; W400-W773 AromaticContact CD2-CZ2 3.9Å; W400-W773 HydrophobicContact CD2-CZ2 3.9Å; W400-W773 AromaticContact CE2-CH2 3.34Å; W400-W773 AromaticContact CE2-CZ2 3.87Å; W400-W773 AromaticContact CE3-CH2 3.92Å; W400-W773 HydrophobicContact CE3-CH2 3.92Å; W400-W773 AromaticContact CE3-CZ2 3.58Å; W400-W773 HydrophobicContact CE3-CZ2 3.58Å; W400-W773 AromaticContact CH2-CH2 3.5Å; W400-W773 HydrophobicContact CH2-CH2 3.5Å; W400-W773 VanDerWaalsContact CH2-CH2 3.5Å; W400-W773 AromaticContact CH2-CZ2 3.3Å; W400-W773 HydrophobicContact CH2-CZ2 3.3Å; W400-W773 AromaticContact CZ2-CH2 3.25Å; W400-W773 HydrophobicContact CZ2-CH2 3.25Å; W400-W773 AromaticContact CZ2-CZ2 3.62Å; W400-W773 HydrophobicContact CZ2-CZ2 3.62Å; W400-W773 HydrophobicContact CZ2-CZ3 4.44Å; W400-W773 AromaticContact CZ3-CH2 3.82Å; W400-W773 HydrophobicContact CZ3-CH2 3.82Å; W400-W773 AromaticContact CZ3-CZ2 3.27Å; W400-W773 HydrophobicContact CZ3-CZ2 3.27Å; W400-W773 AromaticContact NE1-CH2 3.96Å
401	A	86.6	Confident	84.4	Confident	9 Å²	9	45.7 Å²	45.7	7%	0.074	23%	0.229	C	C	.	.	H	α-helix	trans	-67.6	-32	172.6	0	0	0	0	0	111.5	A397 T398 N399 A405	A397-A401 HydrophobicContact CB-CB 3.91Å; T398-A401 WeakPolarHBondContact O-CB 3.42Å; T398-A401 PolarHBondContact O-N 3.29Å; N399-A401 VanDerWaalsContact C-N 3.26Å; N399-A401 PolarHBondContact O-N 3.2Å; A401-A405 VanDerWaalsContact O-CB 3.25Å; A401-A405 WeakPolarHBondContact O-CB 3.44Å; A401-A405 PolarHBondContact O-N 3.01Å
402	K	87.9	Confident	85	Confident	70 Å²	70	40.6 Å²	40.6	30%	0.304	20%	0.202	S	C	.	.	H	α-helix	trans	-68.9	-41.4	170.5	-65.1	-171.2	-179.4	-175.2	0	110.9	A397 N399 W400 A405 T406	A397-K402 HydrophobicContact CB-CG 3.92Å; A397-K402 WeakPolarHBondContact O-CE 3.39Å; A397-K402 VanDerWaalsContact O-CG 3.27Å; A397-K402 WeakPolarHBondContact O-CG 3.23Å; N399-K402 WeakPolarHBondContact O-CA 3.39Å; N399-K402 WeakPolarHBondContact O-CB 3.49Å; N399-K402 PolarHBondContact O-N 3.39Å; W400-K402 VanDerWaalsContact C-N 3.28Å; W400-K402 PolarHBondContact O-N 3.4Å; K402-A405 PolarHBondContact O-N 3.37Å; K402-T406 PolarHBondContact O-N 3.42Å; K402-T406 PolarHBondContact O-OG1 3.28Å
403	F	90.6	Very high	85.6	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-56.8	-51.9	175.3	-174.9	-80.7	0	0	0	111.4	N399 W400 A405 T406 A407 Y438 G442 Y445 I473 H476 P775	N399-F403 PolarHBondContact O-N 2.96Å; W400-F403 HydrophobicContact CE3-CB 3.89Å; W400-F403 HydrophobicContact CE3-CD1 4.23Å; W400-F403 HydrophobicContact CE3-CD2 4.24Å; W400-F403 AromaticContact CE3-CG 3.87Å; W400-F403 HydrophobicContact CE3-CG 3.87Å; W400-F403 HydrophobicContact CZ3-CB 4.37Å; W400-F403 HydrophobicContact CZ3-CD1 4.34Å; W400-F403 AromaticContact CZ3-CD2 3.86Å; W400-F403 HydrophobicContact CZ3-CD2 3.86Å; W400-F403 HydrophobicContact CZ3-CE2 4.2Å; W400-F403 AromaticContact CZ3-CG 3.94Å; W400-F403 HydrophobicContact CZ3-CG 3.94Å; W400-F403 WeakPolarHBondContact O-CB 3.41Å; W400-F403 PolarHBondContact O-N 3.41Å; F403-A405 VanDerWaalsContact C-N 3.34Å; F403-A405 PolarHBondContact O-N 3.24Å; F403-T406 PolarHBondContact O-N 3.35Å; F403-A407 WeakPolarHBondContact O-CB 3.34Å; F403-A407 PolarHBondContact O-N 3.48Å; F403-Y438 WeakPolarHBondContact CA-O 3.25Å; F403-Y438 HydrophobicContact CB-CD1 4.35Å; F403-Y438 VanDerWaalsContact CD2-O 3.29Å; F403-Y438 WeakPolarHBondContact CD2-O 3.24Å; F403-G442 VanDerWaalsContact CE2-N 3.34Å; F403-Y445 AromaticContact CE1-CD1 3.8Å; F403-Y445 HydrophobicContact CE1-CD1 3.8Å; F403-Y445 HydrophobicContact CE1-CG 4.38Å; F403-Y445 HydrophobicContact CZ-CD1 4.18Å; F403-Y445 HydrophobicContact CZ-CG 4.32Å; F403-I473 HydrophobicContact CD2-CG2 4.41Å; F403-H476 AromaticContact CZ-CD2 3.88Å; F403-P775 HydrophobicContact CD1-CB 4.02Å; F403-P775 HydrophobicContact CD1-CG 3.85Å; F403-P775 HydrophobicContact CE1-CB 3.87Å; F403-P775 HydrophobicContact CE1-CG 4.11Å
404	T	90.1	Very high	86.2	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.012	17%	0.17	C	C	.	.	H	α-helix	trans	-61.7	-40.1	175.6	-57.8	0	0	0	0	111.7	T368 I372 W400 T406 A407 S408 H778	T368-T404 HydrophobicContact CG2-CG2 3.63Å; I372-T404 HydrophobicContact CD1-CG2 3.86Å; I372-T404 HydrophobicContact CG1-CG2 3.57Å; W400-T404 PolarHBondContact O-N 2.92Å; W400-T404 PolarHBondContact O-OG1 3.44Å; T404-T406 PolarHBondContact O-N 3.05Å; T404-A407 PolarHBondContact O-N 3.13Å; T404-S408 WeakPolarHBondContact O-CB 3.25Å; T404-S408 PolarHBondContact O-N 3.37Å; T404-H778 WeakPolarHBondContact CG2-NE2 3.42Å; T404-H778 PolarHBondContact O-NE2 3.36Å
405	A	87.8	Confident	86.7	Confident	2 Å²	2	32.1 Å²	32.1	2%	0.017	17%	0.165	C	C	.	.	H	α-helix	trans	-61.4	-44	178.1	0	0	0	0	0	111.8	V371 L394 A401 K402 F403 S408 L409	V371-A405 HydrophobicContact CG1-CB 4.32Å; L394-A405 HydrophobicContact CD1-CB 4.11Å; L394-A405 HydrophobicContact CD2-CB 4.27Å; L394-A405 HydrophobicContact CG-CB 4.18Å; A401-A405 VanDerWaalsContact O-CB 3.25Å; A401-A405 WeakPolarHBondContact O-CB 3.44Å; A401-A405 PolarHBondContact O-N 3.01Å; K402-A405 PolarHBondContact O-N 3.37Å; F403-A405 VanDerWaalsContact C-N 3.34Å; F403-A405 PolarHBondContact O-N 3.24Å; A405-S408 WeakPolarHBondContact O-CB 3.15Å; A405-S408 PolarHBondContact O-N 3.2Å; A405-S408 PolarHBondContact O-OG 3.37Å; A405-L409 VanDerWaalsContact O-CD1 3.22Å; A405-L409 WeakPolarHBondContact O-CD1 3.35Å
406	T	88.8	Confident	87	Confident	8 Å²	8	29.9 Å²	29.9	5%	0.049	14%	0.142	C	C	.	.	H	α-helix	trans	-69.5	-40.2	175.2	-50.8	0	0	0	0	112.1	K402 F403 T404 S408 L409 M424 Y427 Q439	K402-T406 PolarHBondContact O-N 3.42Å; K402-T406 PolarHBondContact O-OG1 3.28Å; F403-T406 PolarHBondContact O-N 3.35Å; T404-T406 PolarHBondContact O-N 3.05Å; T406-S408 PolarHBondContact O-N 3.41Å; T406-L409 WeakPolarHBondContact O-CB 3.49Å; T406-L409 PolarHBondContact O-N 3.07Å; T406-M424 HydrophobicContact CG2-CE 4.32Å; T406-Y427 HydrophobicContact CG2-CD1 4.19Å; T406-Y427 HydrophobicContact CG2-CG 4.11Å; T406-Q439 HydrophobicContact CG2-CG 4.41Å; T406-Q439 WeakPolarHBondContact CG2-O 3.34Å
407	A	90.9	Very high	86.7	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-58.2	-35	174.9	0	0	0	0	0	112.8	F403 T404 L409 G410 Y445	F403-A407 WeakPolarHBondContact O-CB 3.34Å; F403-A407 PolarHBondContact O-N 3.48Å; T404-A407 PolarHBondContact O-N 3.13Å; A407-L409 VanDerWaalsContact C-N 3.26Å; A407-L409 PolarHBondContact O-N 2.91Å; A407-G410 PolarHBondContact O-N 3.26Å; A407-Y445 HydrophobicContact CB-CD1 3.55Å; A407-Y445 HydrophobicContact CB-CE1 3.97Å
408	S	90.6	Very high	86.6	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.1	-29.9	-180	81	0	0	0	0	113.6	V371 T404 A405 T406 G410 V411 I412	V371-S408 WeakPolarHBondContact CG1-OG 3.34Å; T404-S408 WeakPolarHBondContact O-CB 3.25Å; T404-S408 PolarHBondContact O-N 3.37Å; A405-S408 WeakPolarHBondContact O-CB 3.15Å; A405-S408 PolarHBondContact O-N 3.2Å; A405-S408 PolarHBondContact O-OG 3.37Å; T406-S408 PolarHBondContact O-N 3.41Å; S408-G410 VanDerWaalsContact C-N 3.26Å; S408-G410 PolarHBondContact O-N 3.29Å; S408-V411 PolarHBondContact O-N 3.01Å; S408-I412 WeakPolarHBondContact O-CG1 3.48Å; S408-I412 PolarHBondContact O-N 3.09Å; S408-I412 VanDerWaalsContact O-N 3.16Å
409	L	88.5	Confident	86.2	Confident	11 Å²	11	31.1 Å²	31.1	6%	0.058	15%	0.147	C	C	.	.	H	α-helix	trans	-62.4	-37.2	173.5	-80.3	81.9	0	0	0	110.9	L387 A405 T406 A407 V411 I412 H413 M424 Y427	L387-L409 HydrophobicContact CD1-CD1 3.99Å; L387-L409 HydrophobicContact CD1-CG 4.15Å; A405-L409 VanDerWaalsContact O-CD1 3.22Å; A405-L409 WeakPolarHBondContact O-CD1 3.35Å; T406-L409 WeakPolarHBondContact O-CB 3.49Å; T406-L409 PolarHBondContact O-N 3.07Å; A407-L409 VanDerWaalsContact C-N 3.26Å; A407-L409 PolarHBondContact O-N 2.91Å; L409-V411 VanDerWaalsContact C-N 3.26Å; L409-V411 PolarHBondContact O-N 3.41Å; L409-I412 PolarHBondContact O-N 2.84Å; L409-H413 WeakPolarHBondContact O-CB 3.32Å; L409-H413 PolarHBondContact O-CD2 3.19Å; L409-H413 VanDerWaalsContact O-CD2 3.22Å; L409-H413 PolarHBondContact O-N 3.32Å; L409-M424 HydrophobicContact CB-CE 4.46Å; L409-M424 HydrophobicContact CB-SD 4.05Å; L409-M424 HydrophobicContact CD2-SD 4.26Å; L409-Y427 HydrophobicContact CD2-CD2 4.13Å; L409-Y427 HydrophobicContact CD2-CE2 3.63Å
410	G	88.1	Confident	85.7	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62	-33.5	177.4	0	0	0	0	0	113.2	A407 S408 K414 I450	A407-G410 PolarHBondContact O-N 3.26Å; S408-G410 VanDerWaalsContact C-N 3.26Å; S408-G410 PolarHBondContact O-N 3.29Å; G410-K414 PolarHBondContact O-N 3.43Å; G410-I450 VanDerWaalsContact O-CG1 3.29Å; G410-I450 WeakPolarHBondContact O-CG1 3.17Å
411	V	91.4	Very high	85.4	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-74.7	-40.9	176.2	-179.2	0	0	0	0	111.4	S375 F376 T379 G380 S408 L409 K414 L449 H778	S375-V411 WeakPolarHBondContact O-CG1 3.47Å; F376-V411 HydrophobicContact CD1-CG1 4.47Å; T379-V411 WeakPolarHBondContact CA-O 3.43Å; T379-V411 HydrophobicContact CG2-CG1 4.1Å; T379-V411 VanDerWaalsContact OG1-CG1 3.31Å; T379-V411 WeakPolarHBondContact OG1-CG1 3.45Å; G380-V411 PolarHBondContact N-O 3.35Å; S408-V411 PolarHBondContact O-N 3.01Å; L409-V411 VanDerWaalsContact C-N 3.26Å; L409-V411 PolarHBondContact O-N 3.41Å; V411-K414 VanDerWaalsContact O-CB 3.28Å; V411-K414 WeakPolarHBondContact O-CB 3Å; V411-K414 PolarHBondContact O-N 2.74Å; V411-L449 HydrophobicContact CG2-CD1 4.02Å; V411-H778 HydrophobicContact CG2-CB 4.07Å
412	I	91	Very high	85.2	Confident	0 Å²	0	34 Å²	34	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-65.1	-42.5	178.6	-64.6	168.8	0	0	0	111	H378 G380 T382 S383 L387 S408 L409 K414	H378-I412 HydrophobicContact CB-CG1 4.2Å; H378-I412 HydrophobicContact CB-CG2 4.26Å; G380-I412 WeakPolarHBondContact CA-O 3.42Å; G380-I412 PolarHBondContact N-O 3.38Å; G380-I412 VanDerWaalsContact N-O 3.08Å; T382-I412 PolarHBondContact N-O 3.41Å; S383-I412 WeakPolarHBondContact O-CG2 3.46Å; L387-I412 HydrophobicContact CD1-CD1 3.63Å; S408-I412 WeakPolarHBondContact O-CG1 3.48Å; S408-I412 PolarHBondContact O-N 3.09Å; S408-I412 VanDerWaalsContact O-N 3.16Å; L409-I412 PolarHBondContact O-N 2.84Å; I412-K414 VanDerWaalsContact C-N 3.3Å; I412-K414 PolarHBondContact O-N 3.27Å
413	H	88.3	Confident	84.7	Confident	2 Å²	2	32.5 Å²	32.5	1%	0.009	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	17.8	179.6	-63.4	-72.3	0	0	0	113.5	T382 L409 G415 H416 L423 I450	T382-H413 PolarHBondContact O-CE1 2.9Å; L409-H413 WeakPolarHBondContact O-CB 3.32Å; L409-H413 PolarHBondContact O-CD2 3.19Å; L409-H413 VanDerWaalsContact O-CD2 3.22Å; L409-H413 PolarHBondContact O-N 3.32Å; H413-G415 PolarHBondContact O-N 3.31Å; H413-H416 WeakPolarHBondContact O-CB 3.26Å; H413-H416 PolarHBondContact O-N 2.88Å; H413-H416 VanDerWaalsContact O-N 3.15Å; H413-L423 VanDerWaalsContact CE1-CD1 3.48Å; H413-L423 WeakPolarHBondContact CE1-CD1 3.4Å; H413-I450 HydrophobicContact CB-CD1 4.18Å
414	K	87.4	Confident	84.2	Confident	50 Å²	50	32.6 Å²	32.6	22%	0.217	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	129.9	177.3	179.9	169.5	177.6	165.5	0	110.8	T379 G380 G410 V411 I412 S781	T379-K414 HydrophobicContact CG2-CB 4.49Å; T379-K414 HydrophobicContact CG2-CD 4.36Å; G380-K414 WeakPolarHBondContact CA-O 3.39Å; G410-K414 PolarHBondContact O-N 3.43Å; V411-K414 VanDerWaalsContact O-CB 3.28Å; V411-K414 WeakPolarHBondContact O-CB 3Å; V411-K414 PolarHBondContact O-N 2.74Å; I412-K414 VanDerWaalsContact C-N 3.3Å; I412-K414 PolarHBondContact O-N 3.27Å; K414-S781 PolarHBondContact NZ-O 3.29Å
415	G	80	Confident	83.8	Confident	12 Å²	12	33.6 Å²	33.6	12%	0.124	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.2	-2.6	-179.6	0	0	0	0	0	115.4	I336 H413 E417	I336-G415 WeakPolarHBondContact CG2-O 3.47Å; H413-G415 PolarHBondContact O-N 3.31Å; G415-E417 PolarHBondContact O-N 3.12Å
416	H	81.8	Confident	83.6	Confident	24 Å²	24	38 Å²	38	11%	0.111	19%	0.192	C	C	.	.			trans	-89.3	72.3	179	-161.8	-156.5	0	0	0	112.5	L340 H413 K418 E419 A420	L340-H416 HydrophobicContact CD2-CB 4.28Å; H413-H416 WeakPolarHBondContact O-CB 3.26Å; H413-H416 PolarHBondContact O-N 2.88Å; H413-H416 VanDerWaalsContact O-N 3.15Å; H416-K418 PolarHBondContact O-N 3.5Å; H416-E419 IonicContact CE1-OE2 3.83Å; H416-E419 PolarHBondContact CE1-OE2 3.45Å; H416-E419 IonicContact NE2-OE2 3.54Å; H416-A420 WeakPolarHBondContact O-CB 3.32Å; H416-A420 PolarHBondContact O-N 2.97Å
417	E	73.8	Confident	83.2	Confident	48 Å²	48	41 Å²	41	22%	0.224	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-38.7	-166.6	-63.8	-176.2	157.8	0	0	115	I336 G415 H454	I336-E417 VanDerWaalsContact CD1-OE1 3.27Å; I336-E417 WeakPolarHBondContact CD1-OE1 3.46Å; G415-E417 PolarHBondContact O-N 3.12Å; E417-H454 IonicContact OE1-CG 3.73Å
418	K	75.4	Confident	82.7	Confident	157 Å²	157	41.3 Å²	41.3	68%	0.683	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-38.6	-171.2	-65.9	177.2	-171	155.6	0	113.8	E337 H416	E337-K418 WeakPolarHBondContact OE1-CE 3.22Å; E337-K418 IonicContact OE1-NZ 3.74Å; E337-K418 PolarHBondContact OE1-NZ 2.95Å; H416-K418 PolarHBondContact O-N 3.5Å
419	E	75.3	Confident	82	Confident	99 Å²	99	42.6 Å²	42.6	46%	0.463	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-2.8	-175.4	-56.6	-175.8	170.8	0	0	113.5	H416 L421 Q422 L423	H416-E419 IonicContact CE1-OE2 3.83Å; H416-E419 PolarHBondContact CE1-OE2 3.45Å; H416-E419 IonicContact NE2-OE2 3.54Å; E419-L421 VanDerWaalsContact C-N 3.27Å; E419-L421 PolarHBondContact O-N 2.97Å; E419-Q422 PolarHBondContact O-N 3.47Å; E419-Q422 VanDerWaalsContact O-N 3.13Å; E419-L423 PolarHBondContact O-N 3.16Å
420	A	77.9	Confident	81.2	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.008	24%	0.235	C	C	.	.	H	α-helix	trans	-53.9	-42.7	-179.4	0	0	0	0	0	112.8	H416 Q422 L423 M424 L447 I450	H416-A420 WeakPolarHBondContact O-CB 3.32Å; H416-A420 PolarHBondContact O-N 2.97Å; A420-Q422 PolarHBondContact O-N 3.25Å; A420-L423 PolarHBondContact O-N 3.34Å; A420-M424 VanDerWaalsContact O-CB 3.27Å; A420-M424 WeakPolarHBondContact O-CB 3.36Å; A420-M424 VanDerWaalsContact O-CG 3.27Å; A420-M424 WeakPolarHBondContact O-CG 3.49Å; A420-M424 PolarHBondContact O-N 3.09Å; A420-L447 HydrophobicContact CB-CD1 4.47Å; A420-I450 HydrophobicContact CB-CD1 3.84Å; A420-I450 HydrophobicContact CB-CG2 3.98Å
421	L	80.6	Confident	79.6	Confident	74 Å²	74	56.2 Å²	56.2	39%	0.387	28%	0.28	S	S	.	.	H	α-helix	trans	-67.4	-38	-177.9	-158	147.6	0	0	0	111.6	E419 A425 I458	E419-L421 VanDerWaalsContact C-N 3.27Å; E419-L421 PolarHBondContact O-N 2.97Å; L421-A425 WeakPolarHBondContact O-CB 3.42Å; L421-A425 PolarHBondContact O-N 3.41Å; L421-I458 HydrophobicContact CD1-CD1 4.16Å
422	Q	82.4	Confident	77.5	Confident	154 Å²	154	62.7 Å²	62.7	72%	0.72	32%	0.32	S	S	*	.	H	α-helix	trans	-68.7	-42.5	176.8	-175.4	175.7	-2.6	0	0	111.8	E419 A420 A425	E419-Q422 PolarHBondContact O-N 3.47Å; E419-Q422 VanDerWaalsContact O-N 3.13Å; A420-Q422 PolarHBondContact O-N 3.25Å; Q422-A425 WeakPolarHBondContact O-CB 3.43Å; Q422-A425 PolarHBondContact O-N 2.98Å
423	L	78.4	Confident	75.7	Confident	39 Å²	39	65.1 Å²	65.1	20%	0.204	34%	0.337	C	S	.	.	H	α-helix	trans	-66.4	-43	178.7	-166.2	154.6	0	0	0	111.2	H413 E419 A420 A425	H413-L423 VanDerWaalsContact CE1-CD1 3.48Å; H413-L423 WeakPolarHBondContact CE1-CD1 3.4Å; E419-L423 PolarHBondContact O-N 3.16Å; A420-L423 PolarHBondContact O-N 3.34Å; L423-A425 VanDerWaalsContact C-N 3.31Å; L423-A425 PolarHBondContact O-N 3.43Å
424	M	80.2	Confident	74.1	Confident	1 Å²	1	71.7 Å²	71.7	1%	0.005	38%	0.38	C	S	.	.	H	α-helix	trans	-80.8	-8.8	-179.9	-64.5	-60.8	-67.8	0	0	113.4	T406 L409 A420 T426 Y427 L428 A446 I450	T406-M424 HydrophobicContact CG2-CE 4.32Å; L409-M424 HydrophobicContact CB-CE 4.46Å; L409-M424 HydrophobicContact CB-SD 4.05Å; L409-M424 HydrophobicContact CD2-SD 4.26Å; A420-M424 VanDerWaalsContact O-CB 3.27Å; A420-M424 WeakPolarHBondContact O-CB 3.36Å; A420-M424 VanDerWaalsContact O-CG 3.27Å; A420-M424 WeakPolarHBondContact O-CG 3.49Å; A420-M424 PolarHBondContact O-N 3.09Å; M424-T426 PolarHBondContact O-N 3.08Å; M424-Y427 CarbonylContact O-C 3.6Å; M424-Y427 WeakPolarHBondContact O-CA 3.39Å; M424-Y427 PolarHBondContact O-N 3.46Å; M424-Y427 HydrophobicContact SD-CD2 4.42Å; M424-L428 HydrophobicContact CB-CD1 4.09Å; M424-L428 HydrophobicContact CB-CG 4.27Å; M424-L428 WeakPolarHBondContact O-CG 3.41Å; M424-L428 PolarHBondContact O-N 3.15Å; M424-A446 HydrophobicContact CE-CB 3.44Å; M424-A446 VanDerWaalsContact CE-CB 3.44Å; M424-I450 HydrophobicContact CG-CD1 4.43Å
425	A	80.9	Confident	73	Confident	23 Å²	23	70.6 Å²	70.6	19%	0.19	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-23.9	-178.8	0	0	0	0	0	113.7	L421 Q422 L423 Y427 K430	L421-A425 WeakPolarHBondContact O-CB 3.42Å; L421-A425 PolarHBondContact O-N 3.41Å; Q422-A425 WeakPolarHBondContact O-CB 3.43Å; Q422-A425 PolarHBondContact O-N 2.98Å; L423-A425 VanDerWaalsContact C-N 3.31Å; L423-A425 PolarHBondContact O-N 3.43Å; A425-Y427 VanDerWaalsContact C-N 3.35Å; A425-K430 WeakPolarHBondContact O-CE 3.07Å; A425-K430 PolarHBondContact O-NZ 3.31Å
426	T	83.3	Confident	73.1	Confident	96 Å²	96	71.9 Å²	71.9	59%	0.589	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-25.3	175.8	-52.6	0	0	0	0	112.8	M424	M424-T426 PolarHBondContact O-N 3.08Å
427	Y	80.8	Confident	73.4	Confident	70 Å²	70	71.9 Å²	71.9	28%	0.275	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	-12.7	-176.2	-56.7	-78.1	0	0	0	113.3	T406 L409 M424 A425 Q439	T406-Y427 HydrophobicContact CG2-CD1 4.19Å; T406-Y427 HydrophobicContact CG2-CG 4.11Å; L409-Y427 HydrophobicContact CD2-CD2 4.13Å; L409-Y427 HydrophobicContact CD2-CE2 3.63Å; M424-Y427 CarbonylContact O-C 3.6Å; M424-Y427 WeakPolarHBondContact O-CA 3.39Å; M424-Y427 PolarHBondContact O-N 3.46Å; M424-Y427 HydrophobicContact SD-CD2 4.42Å; A425-Y427 VanDerWaalsContact C-N 3.35Å; Y427-Q439 HydrophobicContact CD1-CG 4.01Å; Y427-Q439 VanDerWaalsContact CD1-NE2 3.28Å
428	L	81.6	Confident	74.1	Confident	7 Å²	7	71.8 Å²	71.8	4%	0.037	39%	0.392	C	S	.	.	S	Bend	trans	-77.1	151.4	176.3	-74.6	166.7	0	0	0	111.9	M424 K430 L444	M424-L428 HydrophobicContact CB-CD1 4.09Å; M424-L428 HydrophobicContact CB-CG 4.27Å; M424-L428 WeakPolarHBondContact O-CG 3.41Å; M424-L428 PolarHBondContact O-N 3.15Å; L428-K430 PolarHBondContact O-N 3.12Å; L428-L444 HydrophobicContact CD2-CD2 3.69Å; L428-L444 HydrophobicContact CD2-CG 4.43Å
429	P	74.1	Confident	74.6	Confident	27 Å²	27	66.8 Å²	66.8	18%	0.175	37%	0.371	C	S	.	.			trans	-60.1	126.6	176.4	23.6	-31.4	0	0	0	110.5	E440 L444	P429-E440 HydrophobicContact CB-CB 4.29Å; P429-E440 HydrophobicContact CB-CG 4.28Å; P429-L444 HydrophobicContact CG-CD2 4.41Å
430	K	71.8	Confident	75.2	Confident	118 Å²	118	63.3 Å²	63.3	51%	0.513	36%	0.355	S	S	.	.			trans	-128.7	144.9	172.6	-71.6	176.9	172.4	164.6	0	108	A425 L428 T432 S433	A425-K430 WeakPolarHBondContact O-CE 3.07Å; A425-K430 PolarHBondContact O-NZ 3.31Å; L428-K430 PolarHBondContact O-N 3.12Å; K430-T432 PolarHBondContact O-N 3.41Å; K430-S433 PolarHBondContact O-N 3.21Å
431	D	55.2	Low	75.7	Confident	178 Å²	178	63.3 Å²	63.3	95%	0.952	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-7.6	-179.9	-68.9	-38.2	0	0	0	114.6
432	T	46.5	Very low	76.1	Confident	137 Å²	137	59.8 Å²	59.8	84%	0.84	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.8	35.6	-174.8	-29.5	0	0	0	0	113.3	K430	K430-T432 PolarHBondContact O-N 3.41Å
433	S	53.4	Low	76.5	Confident	51 Å²	51	52.4 Å²	52.4	36%	0.357	30%	0.302	S	S	.	.			trans	-108.9	134.3	176.7	-163	0	0	0	0	112.7	K430 G435	K430-S433 PolarHBondContact O-N 3.21Å; S433-G435 PolarHBondContact O-N 3.49Å
434	P	54.5	Low	77.1	Confident	139 Å²	139	50.6 Å²	50.6	90%	0.903	29%	0.292	S	S	*	.			trans	-78.2	35.5	170.4	34.5	-34.1	0	0	0	111.8
435	G	64.6	Low	77.7	Confident	27 Å²	27	50.6 Å²	50.6	28%	0.278	29%	0.292	S	S	.	.			trans	-73.8	146.1	-178.2	0	0	0	0	0	112.1	S433	S433-G435 PolarHBondContact O-N 3.49Å
436	S	82.9	Confident	78.2	Confident	40 Å²	40	49.5 Å²	49.5	28%	0.28	28%	0.283	S	S	.	.			trans	-73.4	137	169.3	169.1	0	0	0	0	109.2	Y438 Q439 E440	S436-Y438 PolarHBondContact O-N 2.68Å; S436-Q439 WeakPolarHBondContact O-CA 3.34Å; S436-Q439 WeakPolarHBondContact O-CB 3.49Å; S436-Q439 PolarHBondContact O-N 3.05Å; S436-E440 PolarHBondContact O-N 3.35Å
437	A	87.4	Confident	78.6	Confident	23 Å²	23	44.9 Å²	44.9	19%	0.19	26%	0.255	C	S	.	.	H	α-helix	trans	-52.4	-32.2	178.7	0	0	0	0	0	113.9	Q439 E440 G441 I473	A437-Q439 PolarHBondContact O-N 3.44Å; A437-E440 PolarHBondContact O-N 3.28Å; A437-G441 PolarHBondContact O-N 3.38Å; A437-I473 HydrophobicContact CB-CB 4.4Å; A437-I473 HydrophobicContact CB-CD1 4.09Å
438	Y	88.4	Confident	79.1	Confident	46 Å²	46	41.6 Å²	41.6	18%	0.18	24%	0.242	C	C	.	.	H	α-helix	trans	-62.5	-35.4	172.6	-66.9	-79.5	0	0	0	114.5	N399 W400 F403 S436 G442 I473	N399-Y438 HydrophobicContact CB-CD2 4.49Å; N399-Y438 HydrophobicContact CB-CE1 4.35Å; N399-Y438 HydrophobicContact CB-CE2 4.08Å; W400-Y438 HydrophobicContact CD2-CD1 4.13Å; W400-Y438 AromaticContact CD2-CE1 3.81Å; W400-Y438 HydrophobicContact CD2-CE1 3.81Å; W400-Y438 AromaticContact CE2-CE1 3.56Å; W400-Y438 HydrophobicContact CE3-CD1 4.11Å; W400-Y438 HydrophobicContact CE3-CE1 4.18Å; W400-Y438 HydrophobicContact CG-CE1 4.28Å; W400-Y438 HydrophobicContact CH2-CD1 4.41Å; W400-Y438 HydrophobicContact CH2-CE1 4.06Å; W400-Y438 HydrophobicContact CZ2-CD1 4.43Å; W400-Y438 AromaticContact CZ2-CE1 3.69Å; W400-Y438 HydrophobicContact CZ2-CE1 3.69Å; W400-Y438 HydrophobicContact CZ3-CD1 4.25Å; W400-Y438 HydrophobicContact CZ3-CE1 4.29Å; W400-Y438 AromaticContact NE1-CE1 3.94Å; F403-Y438 WeakPolarHBondContact CA-O 3.25Å; F403-Y438 HydrophobicContact CB-CD1 4.35Å; F403-Y438 VanDerWaalsContact CD2-O 3.29Å; F403-Y438 WeakPolarHBondContact CD2-O 3.24Å; S436-Y438 PolarHBondContact O-N 2.68Å; Y438-G442 PolarHBondContact O-N 3.34Å; Y438-I473 HydrophobicContact CD1-CD1 4.18Å; Y438-I473 HydrophobicContact CD1-CG2 3.73Å; Y438-I473 HydrophobicContact CD2-CD1 4.16Å; Y438-I473 HydrophobicContact CE1-CD1 3.75Å; Y438-I473 HydrophobicContact CE1-CG1 4.17Å; Y438-I473 HydrophobicContact CE1-CG2 4.14Å; Y438-I473 HydrophobicContact CE2-CD1 3.73Å; Y438-I473 HydrophobicContact CG-CD1 4.37Å; Y438-I473 HydrophobicContact CG-CG2 4.18Å
439	Q	86.9	Confident	79.5	Confident	52 Å²	52	41.2 Å²	41.2	24%	0.243	24%	0.24	C	C	.	.	H	α-helix	trans	-72.9	-43	177.4	177.8	176	-25.3	0	0	110	T406 Y427 S436 A437 G442 G443	T406-Q439 HydrophobicContact CG2-CG 4.41Å; T406-Q439 WeakPolarHBondContact CG2-O 3.34Å; Y427-Q439 HydrophobicContact CD1-CG 4.01Å; Y427-Q439 VanDerWaalsContact CD1-NE2 3.28Å; S436-Q439 WeakPolarHBondContact O-CA 3.34Å; S436-Q439 WeakPolarHBondContact O-CB 3.49Å; S436-Q439 PolarHBondContact O-N 3.05Å; A437-Q439 PolarHBondContact O-N 3.44Å; Q439-G442 CarbonylContact O-C 3.6Å; Q439-G442 PolarHBondContact O-N 3.25Å; Q439-G443 PolarHBondContact O-N 3.11Å
440	E	87.5	Confident	80.3	Confident	27 Å²	27	40.3 Å²	40.3	13%	0.126	23%	0.233	C	C	.	.	H	α-helix	trans	-63.2	-46.9	176.7	-63.5	175.9	167.5	0	0	111.7	P429 S436 A437 G442 G443 L444 V474	P429-E440 HydrophobicContact CB-CB 4.29Å; P429-E440 HydrophobicContact CB-CG 4.28Å; S436-E440 PolarHBondContact O-N 3.35Å; A437-E440 PolarHBondContact O-N 3.28Å; E440-G442 PolarHBondContact O-N 3.05Å; E440-G443 PolarHBondContact O-N 2.89Å; E440-L444 PolarHBondContact O-N 3.27Å; E440-L444 VanDerWaalsContact O-N 3.09Å; E440-V474 HydrophobicContact CB-CG2 4.1Å
441	G	88.6	Confident	81	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.2	-43.1	173.4	0	0	0	0	0	112.3	A437 G443 L444 Y445 G477	A437-G441 PolarHBondContact O-N 3.38Å; G441-G443 VanDerWaalsContact C-N 3.26Å; G441-G443 PolarHBondContact O-N 2.84Å; G441-L444 PolarHBondContact O-N 3.43Å; G441-Y445 PolarHBondContact O-N 3.03Å; G441-G477 VanDerWaalsContact O-CA 3.32Å; G441-G477 WeakPolarHBondContact O-CA 3.37Å
442	G	89.4	Confident	82.4	Confident	0 Å²	0	27 Å²	27	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64	-31.3	175.4	0	0	0	0	0	113	F403 Y438 Q439 E440 A446	F403-G442 VanDerWaalsContact CE2-N 3.34Å; Y438-G442 PolarHBondContact O-N 3.34Å; Q439-G442 CarbonylContact O-C 3.6Å; Q439-G442 PolarHBondContact O-N 3.25Å; E440-G442 PolarHBondContact O-N 3.05Å; G442-A446 WeakPolarHBondContact O-CB 3.35Å; G442-A446 PolarHBondContact O-N 3.44Å
443	G	89.8	Confident	84.1	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-67.7	-44.1	175.1	0	0	0	0	0	112.7	Q439 E440 G441 Y445 A446 L447	Q439-G443 PolarHBondContact O-N 3.11Å; E440-G443 PolarHBondContact O-N 2.89Å; G441-G443 VanDerWaalsContact C-N 3.26Å; G441-G443 PolarHBondContact O-N 2.84Å; G443-Y445 VanDerWaalsContact C-N 3.34Å; G443-A446 PolarHBondContact O-N 3.04Å; G443-L447 PolarHBondContact O-N 3.12Å
444	L	91.6	Very high	85.4	Confident	1 Å²	1	20.9 Å²	20.9	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-64.8	-39.4	174	-64.4	177.3	0	0	0	111.9	L428 P429 E440 G441 L447 G448 Y461 L462 Q465 V474	L428-L444 HydrophobicContact CD2-CD2 3.69Å; L428-L444 HydrophobicContact CD2-CG 4.43Å; P429-L444 HydrophobicContact CG-CD2 4.41Å; E440-L444 PolarHBondContact O-N 3.27Å; E440-L444 VanDerWaalsContact O-N 3.09Å; G441-L444 PolarHBondContact O-N 3.43Å; L444-L447 PolarHBondContact O-N 3.42Å; L444-G448 PolarHBondContact O-N 3.21Å; L444-G448 VanDerWaalsContact O-N 3.13Å; L444-Y461 HydrophobicContact CD2-CE1 4.46Å; L444-L462 HydrophobicContact CB-CD2 4.25Å; L444-L462 HydrophobicContact CD2-CD2 3.86Å; L444-Q465 HydrophobicContact CD2-CB 4.4Å; L444-Q465 HydrophobicContact CD2-CG 4.37Å; L444-V474 HydrophobicContact CD1-CG1 3.54Å
445	Y	93.4	Very high	85.9	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-65.6	-42.3	175.5	-179.6	-131	0	0	0	112.1	F403 A407 G441 G443 L447 G448 L449 G477 L480 L484 P775 H778 F779	F403-Y445 AromaticContact CE1-CD1 3.8Å; F403-Y445 HydrophobicContact CE1-CD1 3.8Å; F403-Y445 HydrophobicContact CE1-CG 4.38Å; F403-Y445 HydrophobicContact CZ-CD1 4.18Å; F403-Y445 HydrophobicContact CZ-CG 4.32Å; A407-Y445 HydrophobicContact CB-CD1 3.55Å; A407-Y445 HydrophobicContact CB-CE1 3.97Å; G441-Y445 PolarHBondContact O-N 3.03Å; G443-Y445 VanDerWaalsContact C-N 3.34Å; Y445-L447 VanDerWaalsContact C-N 3.32Å; Y445-L447 PolarHBondContact O-N 3.18Å; Y445-G448 PolarHBondContact O-N 3.16Å; Y445-L449 HydrophobicContact CD1-CD1 4.12Å; Y445-L449 HydrophobicContact CE1-CD1 3.75Å; Y445-L449 HydrophobicContact CE1-CG 4.49Å; Y445-L449 HydrophobicContact CE2-CD1 4.27Å; Y445-L449 HydrophobicContact CE2-CD2 4.4Å; Y445-L449 HydrophobicContact CE2-CG 4.14Å; Y445-L449 PolarHBondContact O-N 2.86Å; Y445-G477 PolarHBondContact N-O 2.93Å; Y445-L480 HydrophobicContact CD2-CB 3.5Å; Y445-L480 HydrophobicContact CD2-CD1 4.2Å; Y445-L480 HydrophobicContact CE2-CB 3.79Å; Y445-L480 HydrophobicContact CE2-CD1 4.18Å; Y445-L480 HydrophobicContact CG-CB 4.42Å; Y445-L484 HydrophobicContact CD2-CD1 4.11Å; Y445-L484 HydrophobicContact CE2-CD1 3.52Å; Y445-P775 PolarHBondContact OH-O 2.99Å; Y445-H778 HydrophobicContact CE1-CB 4.09Å; Y445-F779 AromaticContact CE2-CE2 3.99Å; Y445-F779 HydrophobicContact CE2-CE2 3.99Å; Y445-F779 HydrophobicContact CE2-CZ 4.23Å; Y445-F779 AromaticContact CZ-CE2 3.87Å; Y445-F779 WeakPolarHBondContact OH-CD2 3.21Å; Y445-F779 WeakPolarHBondContact OH-CE2 3.3Å
446	A	91.6	Very high	86.6	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-58.8	-42	173	0	0	0	0	0	112.4	M424 G442 G443 G448 L449 I450	M424-A446 HydrophobicContact CE-CB 3.44Å; M424-A446 VanDerWaalsContact CE-CB 3.44Å; G442-A446 WeakPolarHBondContact O-CB 3.35Å; G442-A446 PolarHBondContact O-N 3.44Å; G443-A446 PolarHBondContact O-N 3.04Å; A446-G448 VanDerWaalsContact C-N 3.32Å; A446-G448 PolarHBondContact O-N 3.4Å; A446-L449 WeakPolarHBondContact O-CB 3.46Å; A446-L449 PolarHBondContact O-N 2.95Å; A446-L449 VanDerWaalsContact O-N 3.17Å; A446-I450 WeakPolarHBondContact O-CG1 3.46Å; A446-I450 PolarHBondContact O-N 3.1Å
447	L	90.7	Very high	86.5	Confident	0 Å²	0	21 Å²	21	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61.5	-42.1	177	-171.1	64	0	0	0	111.4	A420 G443 L444 Y445 L449 I450 H451 I458 Y461 L462	A420-L447 HydrophobicContact CB-CD1 4.47Å; G443-L447 PolarHBondContact O-N 3.12Å; L444-L447 PolarHBondContact O-N 3.42Å; Y445-L447 VanDerWaalsContact C-N 3.32Å; Y445-L447 PolarHBondContact O-N 3.18Å; L447-L449 PolarHBondContact O-N 2.69Å; L447-I450 PolarHBondContact O-N 3.33Å; L447-H451 PolarHBondContact O-CD2 2.9Å; L447-H451 PolarHBondContact O-N 2.86Å; L447-H451 VanDerWaalsContact O-N 3.14Å; L447-I458 HydrophobicContact CD2-CG2 3.94Å; L447-I458 HydrophobicContact CG-CG2 3.88Å; L447-Y461 HydrophobicContact CD2-CD1 3.77Å; L447-Y461 HydrophobicContact CD2-CE1 3.76Å; L447-L462 HydrophobicContact CD2-CD2 4.16Å
448	G	90.3	Very high	86.5	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-66.3	-32	174	0	0	0	0	0	114.3	L444 Y445 A446 H451 A452 G481	L444-G448 PolarHBondContact O-N 3.21Å; L444-G448 VanDerWaalsContact O-N 3.13Å; Y445-G448 PolarHBondContact O-N 3.16Å; A446-G448 VanDerWaalsContact C-N 3.32Å; A446-G448 PolarHBondContact O-N 3.4Å; G448-H451 CarbonylContact O-C 3.55Å; G448-A452 WeakPolarHBondContact O-CA 3.32Å; G448-A452 PolarHBondContact O-N 3.42Å; G448-G481 WeakPolarHBondContact CA-O 3.32Å
449	L	91.1	Very high	86.5	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-68.4	-35.5	174.1	-75.4	166.1	0	0	0	112.7	V411 Y445 A446 L447 L484 H778	V411-L449 HydrophobicContact CG2-CD1 4.02Å; Y445-L449 HydrophobicContact CD1-CD1 4.12Å; Y445-L449 HydrophobicContact CE1-CD1 3.75Å; Y445-L449 HydrophobicContact CE1-CG 4.49Å; Y445-L449 HydrophobicContact CE2-CD1 4.27Å; Y445-L449 HydrophobicContact CE2-CD2 4.4Å; Y445-L449 HydrophobicContact CE2-CG 4.14Å; Y445-L449 PolarHBondContact O-N 2.86Å; A446-L449 WeakPolarHBondContact O-CB 3.46Å; A446-L449 PolarHBondContact O-N 2.95Å; A446-L449 VanDerWaalsContact O-N 3.17Å; L447-L449 PolarHBondContact O-N 2.69Å; L449-L484 HydrophobicContact CD2-CD1 3.6Å; L449-L484 HydrophobicContact CG-CD1 3.83Å; L449-H778 HydrophobicContact CD1-CB 3.83Å; L449-H778 HydrophobicContact CD2-CB 4.43Å
450	I	90	Very high	86.7	Confident	7 Å²	7	20.6 Å²	20.6	4%	0.036	12%	0.124	C	C	.	.	H	α-helix	trans	-66.7	-47	175.9	-65.2	168.5	0	0	0	110	G410 H413 A420 M424 A446 L447 A452	G410-I450 VanDerWaalsContact O-CG1 3.29Å; G410-I450 WeakPolarHBondContact O-CG1 3.17Å; H413-I450 HydrophobicContact CB-CD1 4.18Å; A420-I450 HydrophobicContact CB-CD1 3.84Å; A420-I450 HydrophobicContact CB-CG2 3.98Å; M424-I450 HydrophobicContact CG-CD1 4.43Å; A446-I450 WeakPolarHBondContact O-CG1 3.46Å; A446-I450 PolarHBondContact O-N 3.1Å; L447-I450 PolarHBondContact O-N 3.33Å; I450-A452 VanDerWaalsContact C-N 3.34Å; I450-A452 PolarHBondContact O-N 3.25Å
451	H	87.8	Confident	86.8	Confident	9 Å²	9	22.5 Å²	22.5	4%	0.042	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	24	-176.4	-65.9	-82.7	0	0	0	113.6	L447 G448 N453 H454 G455 I458	L447-H451 PolarHBondContact O-CD2 2.9Å; L447-H451 PolarHBondContact O-N 2.86Å; L447-H451 VanDerWaalsContact O-N 3.14Å; G448-H451 CarbonylContact O-C 3.55Å; H451-N453 PolarHBondContact O-N 3.39Å; H451-H454 CarbonylContact O-C 3.5Å; H451-H454 PolarHBondContact O-N 3.19Å; H451-G455 PolarHBondContact O-N 3.14Å; H451-I458 HydrophobicContact CB-CG2 4.35Å
452	A	85	Confident	86.8	Confident	8 Å²	8	22.5 Å²	22.5	7%	0.066	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	130.6	179.1	0	0	0	0	0	110.5	G448 I450 H454 L484 L782	G448-A452 WeakPolarHBondContact O-CA 3.32Å; G448-A452 PolarHBondContact O-N 3.42Å; I450-A452 VanDerWaalsContact C-N 3.34Å; I450-A452 PolarHBondContact O-N 3.25Å; A452-H454 PolarHBondContact O-N 2.97Å; A452-H454 VanDerWaalsContact O-N 3.14Å; A452-H454 PolarHBondContact O-ND1 3.38Å; A452-L484 WeakPolarHBondContact CA-O 3.5Å; A452-L782 HydrophobicContact CB-CD2 3.44Å; A452-L782 VanDerWaalsContact CB-CD2 3.44Å
453	N	81.3	Confident	86.9	Confident	24 Å²	24	24.3 Å²	24.3	13%	0.128	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.7	-11.6	-171.5	-50.7	-17.9	0	0	0	116.5	H451 L484 L487 P759	H451-N453 PolarHBondContact O-N 3.39Å; N453-L484 PolarHBondContact N-O 3.4Å; N453-L484 VanDerWaalsContact N-O 3.15Å; N453-L487 WeakPolarHBondContact OD1-CB 3.31Å; N453-L487 WeakPolarHBondContact OD1-CD1 3.44Å; N453-L487 WeakPolarHBondContact OD1-CD2 3.42Å; N453-P759 WeakPolarHBondContact ND2-CG 3.45Å
454	H	79.8	Confident	86.9	Confident	35 Å²	35	25.7 Å²	25.7	16%	0.162	15%	0.154	C	C	.	.			trans	-118.8	35.5	-172.4	-57.3	84.6	0	0	0	111.4	Y254 S331 I336 E417 H451 A452 G456	Y254-H454 AromaticContact CE2-NE2 3.51Å; Y254-H454 AromaticContact CZ-NE2 3.52Å; Y254-H454 PolarHBondContact OH-CE1 3.17Å; Y254-H454 PolarHBondContact OH-NE2 3.43Å; S331-H454 PolarHBondContact O-CD2 3.45Å; S331-H454 VanDerWaalsContact O-CD2 3.27Å; I336-H454 HydrophobicContact CD1-CB 4.48Å; E417-H454 IonicContact OE1-CG 3.73Å; H451-H454 CarbonylContact O-C 3.5Å; H451-H454 PolarHBondContact O-N 3.19Å; A452-H454 PolarHBondContact O-N 2.97Å; A452-H454 VanDerWaalsContact O-N 3.14Å; A452-H454 PolarHBondContact O-ND1 3.38Å; H454-G456 VanDerWaalsContact C-N 3.33Å; H454-G456 PolarHBondContact O-N 2.95Å
455	G	66.4	Low	86.6	Confident	19 Å²	19	28 Å²	28	20%	0.196	17%	0.165	C	C	.	.			trans	-72.6	83.4	178.3	0	0	0	0	0	111.7	H451 I459 A485	H451-G455 PolarHBondContact O-N 3.14Å; G455-I459 WeakPolarHBondContact O-CD1 3.42Å; G455-I459 VanDerWaalsContact O-CG1 3.25Å; G455-I459 WeakPolarHBondContact O-CG1 3.38Å; G455-A485 WeakPolarHBondContact CA-O 3.5Å; G455-A485 PolarHBondContact N-O 3.25Å
456	G	78	Confident	86.3	Confident	47 Å²	47	28.2 Å²	28.2	49%	0.485	17%	0.166	S	C	.	.	S	Bend	trans	-78.6	-119.1	162.3	0	0	0	0	0	110.1	H454 I458 I459	H454-G456 VanDerWaalsContact C-N 3.33Å; H454-G456 PolarHBondContact O-N 2.95Å; G456-I458 PolarHBondContact O-N 3.48Å; G456-I459 PolarHBondContact O-N 2.91Å
457	D	82.1	Confident	86.2	Confident	142 Å²	142	35.5 Å²	35.5	76%	0.759	20%	0.198	S	C	*	.	H	α-helix	trans	-55	-24.7	-179.6	-56	-20.6	0	0	0	114.2	I459 D460 Y461	D457-I459 VanDerWaalsContact C-N 3.29Å; D457-I459 PolarHBondContact O-N 3.29Å; D457-D460 PolarHBondContact O-N 2.76Å; D457-Y461 PolarHBondContact O-N 3.27Å; D457-Y461 VanDerWaalsContact O-N 3.09Å
458	I	86.6	Confident	86	Confident	22 Å²	22	41.7 Å²	41.7	11%	0.113	23%	0.231	C	C	.	.	H	α-helix	trans	-67.7	-29.1	178.9	-57.1	-60.3	0	0	0	112.1	L421 L447 H451 G456 D460 Y461 L462	L421-I458 HydrophobicContact CD1-CD1 4.16Å; L447-I458 HydrophobicContact CD2-CG2 3.94Å; L447-I458 HydrophobicContact CG-CG2 3.88Å; H451-I458 HydrophobicContact CB-CG2 4.35Å; G456-I458 PolarHBondContact O-N 3.48Å; I458-D460 VanDerWaalsContact C-N 3.32Å; I458-Y461 PolarHBondContact O-N 3.24Å; I458-L462 HydrophobicContact CG2-CD1 3.9Å; I458-L462 HydrophobicContact CG2-CG 4.11Å; I458-L462 WeakPolarHBondContact O-CB 3.44Å; I458-L462 VanDerWaalsContact O-CG 3.3Å; I458-L462 WeakPolarHBondContact O-CG 2.84Å; I458-L462 PolarHBondContact O-N 3.39Å
459	I	89.3	Confident	85.6	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.015	24%	0.237	C	C	.	.	H	α-helix	trans	-60.5	-47.8	173.5	-68.5	-177.5	0	0	0	109.3	G455 G456 D457 Y461 L462 L463 L482 A485 A486 V494	G455-I459 WeakPolarHBondContact O-CD1 3.42Å; G455-I459 VanDerWaalsContact O-CG1 3.25Å; G455-I459 WeakPolarHBondContact O-CG1 3.38Å; G456-I459 PolarHBondContact O-N 2.91Å; D457-I459 VanDerWaalsContact C-N 3.29Å; D457-I459 PolarHBondContact O-N 3.29Å; I459-Y461 VanDerWaalsContact C-N 3.34Å; I459-Y461 PolarHBondContact O-N 3.14Å; I459-L462 PolarHBondContact O-N 2.96Å; I459-L463 WeakPolarHBondContact O-CB 3.38Å; I459-L463 PolarHBondContact O-N 3.41Å; I459-L482 HydrophobicContact CB-CD1 4.5Å; I459-L482 HydrophobicContact CG2-CD1 3.83Å; I459-A485 HydrophobicContact CG1-CB 3.98Å; I459-A486 HydrophobicContact CD1-CB 3.82Å; I459-A486 HydrophobicContact CG1-CB 4.46Å; I459-V494 HydrophobicContact CG2-CG2 3.92Å
460	D	89.8	Confident	84.9	Confident	89 Å²	89	46.9 Å²	46.9	48%	0.476	27%	0.268	S	S	.	.	H	α-helix	trans	-69.3	-35.7	-177	-63.1	-22.9	0	0	0	111.2	D457 I458 L463 G464 R491	D457-D460 PolarHBondContact O-N 2.76Å; I458-D460 VanDerWaalsContact C-N 3.32Å; D460-L463 PolarHBondContact O-N 2.9Å; D460-G464 PolarHBondContact O-N 3.46Å; D460-R491 IonicContact OD1-NH1 2.87Å; D460-R491 PolarHBondContact OD1-NH1 3.14Å; D460-R491 IonicContact OD1-NH2 2.74Å
461	Y	89.9	Confident	84.7	Confident	67 Å²	67	50.2 Å²	50.2	26%	0.263	29%	0.286	S	S	.	.	H	α-helix	trans	-60.5	-51.2	170.7	176.7	-100.9	0	0	0	112.2	L444 L447 D457 I458 I459 L463 G464 Q465	L444-Y461 HydrophobicContact CD2-CE1 4.46Å; L447-Y461 HydrophobicContact CD2-CD1 3.77Å; L447-Y461 HydrophobicContact CD2-CE1 3.76Å; D457-Y461 PolarHBondContact O-N 3.27Å; D457-Y461 VanDerWaalsContact O-N 3.09Å; I458-Y461 PolarHBondContact O-N 3.24Å; I459-Y461 VanDerWaalsContact C-N 3.34Å; I459-Y461 PolarHBondContact O-N 3.14Å; Y461-L463 VanDerWaalsContact C-N 3.32Å; Y461-L463 PolarHBondContact O-N 2.83Å; Y461-G464 PolarHBondContact O-N 2.85Å; Y461-Q465 HydrophobicContact CD1-CG 4.43Å; Y461-Q465 HydrophobicContact CE1-CG 4.01Å; Y461-Q465 HydrophobicContact CE2-CG 4.2Å; Y461-Q465 WeakPolarHBondContact O-CG 3.4Å; Y461-Q465 PolarHBondContact O-N 2.71Å
462	L	89.5	Confident	84.7	Confident	0 Å²	0	53 Å²	53	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-64.7	-37.3	179.3	-72.5	174	0	0	0	111.8	L444 L447 I458 I459 Q465 L466 L482 A485	L444-L462 HydrophobicContact CB-CD2 4.25Å; L444-L462 HydrophobicContact CD2-CD2 3.86Å; L447-L462 HydrophobicContact CD2-CD2 4.16Å; I458-L462 HydrophobicContact CG2-CD1 3.9Å; I458-L462 HydrophobicContact CG2-CG 4.11Å; I458-L462 WeakPolarHBondContact O-CB 3.44Å; I458-L462 VanDerWaalsContact O-CG 3.3Å; I458-L462 WeakPolarHBondContact O-CG 2.84Å; I458-L462 PolarHBondContact O-N 3.39Å; I459-L462 PolarHBondContact O-N 2.96Å; L462-Q465 PolarHBondContact O-N 3.29Å; L462-L466 VanDerWaalsContact O-CB 3.28Å; L462-L466 WeakPolarHBondContact O-CB 3.39Å; L462-L466 PolarHBondContact O-N 3.39Å; L462-L482 HydrophobicContact CB-CB 4.33Å; L462-L482 HydrophobicContact CB-CD1 4.07Å; L462-A485 HydrophobicContact CD1-CB 4.23Å
463	L	90.6	Very high	84.9	Confident	38 Å²	38	54.3 Å²	54.3	20%	0.199	31%	0.307	C	S	.	.	H	α-helix	trans	-63.2	-45.5	175.2	-167.5	159.4	0	0	0	110.6	I459 D460 Y461 L466 K467 V494 L497	I459-L463 WeakPolarHBondContact O-CB 3.38Å; I459-L463 PolarHBondContact O-N 3.41Å; D460-L463 PolarHBondContact O-N 2.9Å; Y461-L463 VanDerWaalsContact C-N 3.32Å; Y461-L463 PolarHBondContact O-N 2.83Å; L463-L466 PolarHBondContact O-N 2.77Å; L463-K467 WeakPolarHBondContact O-CB 3.45Å; L463-K467 PolarHBondContact O-N 3.34Å; L463-V494 HydrophobicContact CD1-CG2 4.24Å; L463-L497 HydrophobicContact CD2-CD2 4.09Å; L463-L497 HydrophobicContact CG-CD2 3.75Å
464	G	89.3	Confident	85.4	Confident	28 Å²	28	53.6 Å²	53.6	29%	0.289	30%	0.303	S	S	.	.	H	α-helix	trans	-60.4	-44.5	174.6	0	0	0	0	0	112.8	D460 Y461 K467 N468	D460-G464 PolarHBondContact O-N 3.46Å; Y461-G464 PolarHBondContact O-N 2.85Å; G464-K467 PolarHBondContact O-N 3.02Å; G464-N468 VanDerWaalsContact O-CG 3.31Å; G464-N468 PolarHBondContact O-N 3.31Å; G464-N468 PolarHBondContact O-ND2 3.17Å
465	Q	87	Confident	85.9	Confident	50 Å²	50	54 Å²	54	23%	0.234	30%	0.303	C	S	.	.	H	α-helix	trans	-64.8	-42.3	176.4	-69.4	-62.5	-29.2	0	0	112.1	L444 Y461 L462 K467 N468 A469	L444-Q465 HydrophobicContact CD2-CB 4.4Å; L444-Q465 HydrophobicContact CD2-CG 4.37Å; Y461-Q465 HydrophobicContact CD1-CG 4.43Å; Y461-Q465 HydrophobicContact CE1-CG 4.01Å; Y461-Q465 HydrophobicContact CE2-CG 4.2Å; Y461-Q465 WeakPolarHBondContact O-CG 3.4Å; Y461-Q465 PolarHBondContact O-N 2.71Å; L462-Q465 PolarHBondContact O-N 3.29Å; Q465-K467 VanDerWaalsContact C-N 3.34Å; Q465-K467 PolarHBondContact O-N 3.03Å; Q465-N468 PolarHBondContact O-N 2.85Å; Q465-A469 VanDerWaalsContact O-CB 3.3Å; Q465-A469 WeakPolarHBondContact O-CB 3.34Å; Q465-A469 PolarHBondContact O-N 3.09Å
466	L	87	Confident	87	Confident	4 Å²	4	53.2 Å²	53.2	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-66.5	-36.7	-179.8	-170.7	62.9	0	0	0	112	L462 L463 N468 R475 A479 L482 L497 L498	L462-L466 VanDerWaalsContact O-CB 3.28Å; L462-L466 WeakPolarHBondContact O-CB 3.39Å; L462-L466 PolarHBondContact O-N 3.39Å; L463-L466 PolarHBondContact O-N 2.77Å; L466-N468 VanDerWaalsContact C-N 3.35Å; L466-R475 HydrophobicContact CD1-CB 3.94Å; L466-R475 HydrophobicContact CD1-CG 4.08Å; L466-A479 HydrophobicContact CD2-CB 4.49Å; L466-L482 HydrophobicContact CD2-CD2 3.72Å; L466-L497 HydrophobicContact CB-CD2 4.33Å; L466-L497 HydrophobicContact CD2-CD2 3.97Å; L466-L497 HydrophobicContact CD2-CG 4.32Å; L466-L497 HydrophobicContact CG-CD2 4.34Å; L466-L498 HydrophobicContact CD2-CD2 4.14Å
467	K	88.4	Confident	87.6	Confident	154 Å²	154	51 Å²	51	67%	0.67	27%	0.271	S	S	*	.	H	α-helix	trans	-67.4	-34.7	176.2	-169.4	173.3	-176	175.1	0	112.7	L463 G464 Q465	L463-K467 WeakPolarHBondContact O-CB 3.45Å; L463-K467 PolarHBondContact O-N 3.34Å; G464-K467 PolarHBondContact O-N 3.02Å; Q465-K467 VanDerWaalsContact C-N 3.34Å; Q465-K467 PolarHBondContact O-N 3.03Å
468	N	86.2	Confident	88	Confident	130 Å²	130	44.2 Å²	44.2	70%	0.695	24%	0.235	S	C	*	.	H	α-helix	trans	-89.5	-15.5	-178.8	-65.4	-16.5	0	0	0	113.3	G464 Q465 L466 S470	G464-N468 VanDerWaalsContact O-CG 3.31Å; G464-N468 PolarHBondContact O-N 3.31Å; G464-N468 PolarHBondContact O-ND2 3.17Å; Q465-N468 PolarHBondContact O-N 2.85Å; L466-N468 VanDerWaalsContact C-N 3.35Å; N468-S470 PolarHBondContact O-N 3.17Å
469	A	82.6	Confident	88.3	Confident	15 Å²	15	43.1 Å²	43.1	12%	0.124	23%	0.23	C	C	.	.			trans	-67	128	-176.2	0	0	0	0	0	112	Q465 V474 R475	Q465-A469 VanDerWaalsContact O-CB 3.3Å; Q465-A469 WeakPolarHBondContact O-CB 3.34Å; Q465-A469 PolarHBondContact O-N 3.09Å; A469-V474 HydrophobicContact CB-CB 4.5Å; A469-V474 HydrophobicContact CB-CG1 4.15Å; A469-R475 HydrophobicContact CB-CG 3.81Å; A469-R475 VanDerWaalsContact O-CZ 3.26Å; A469-R475 PolarHBondContact O-NE 3.2Å; A469-R475 PolarHBondContact O-NH2 2.9Å
470	S	76.9	Confident	88.4	Confident	93 Å²	93	43 Å²	43	65%	0.65	23%	0.229	S	C	*	.			trans	-95.6	-26.6	172.5	55.2	0	0	0	0	113.2	N468	N468-S470 PolarHBondContact O-N 3.17Å
471	N	85.4	Confident	88.5	Confident	77 Å²	77	38.8 Å²	38.8	41%	0.412	21%	0.206	S	C	.	.			trans	-89.2	130.8	-176.7	-72.1	-28.7	0	0	0	112.3	I473 V474 R475	N471-I473 VanDerWaalsContact C-N 3.29Å; N471-I473 PolarHBondContact O-N 3.24Å; N471-V474 HydrophobicContact CB-CB 4.25Å; N471-V474 HydrophobicContact CB-CG2 3.94Å; N471-V474 PolarHBondContact O-N 3.48Å; N471-V474 VanDerWaalsContact O-N 3.13Å; N471-R475 PolarHBondContact O-N 3.5Å
472	D	87.7	Confident	88.6	Confident	69 Å²	69	35.6 Å²	35.6	37%	0.369	19%	0.194	S	C	.	.	H	α-helix	trans	-60.6	-35.5	-179.7	-54.3	-32.3	0	0	0	113	V474 R475 H476 D506 T509	D472-V474 PolarHBondContact O-N 2.98Å; D472-R475 PolarHBondContact O-N 3.35Å; D472-R475 IonicContact OD1-NH1 2.67Å; D472-R475 PolarHBondContact OD1-NH1 2.82Å; D472-H476 WeakPolarHBondContact O-CB 3.39Å; D472-H476 PolarHBondContact O-N 3.23Å; D472-D506 WeakPolarHBondContact CB-OD2 3.4Å; D472-T509 PolarHBondContact O-OG1 3.43Å
473	I	90	Very high	88.7	Confident	35 Å²	35	35.6 Å²	35.6	18%	0.179	19%	0.194	C	C	.	.	H	α-helix	trans	-68.7	-36.8	179.2	-57.7	160.9	0	0	0	111.4	W400 F403 A437 Y438 N471 H476 G477	W400-I473 HydrophobicContact CH2-CG2 4.41Å; F403-I473 HydrophobicContact CD2-CG2 4.41Å; A437-I473 HydrophobicContact CB-CB 4.4Å; A437-I473 HydrophobicContact CB-CD1 4.09Å; Y438-I473 HydrophobicContact CD1-CD1 4.18Å; Y438-I473 HydrophobicContact CD1-CG2 3.73Å; Y438-I473 HydrophobicContact CD2-CD1 4.16Å; Y438-I473 HydrophobicContact CE1-CD1 3.75Å; Y438-I473 HydrophobicContact CE1-CG1 4.17Å; Y438-I473 HydrophobicContact CE1-CG2 4.14Å; Y438-I473 HydrophobicContact CE2-CD1 3.73Å; Y438-I473 HydrophobicContact CG-CD1 4.37Å; Y438-I473 HydrophobicContact CG-CG2 4.18Å; N471-I473 VanDerWaalsContact C-N 3.29Å; N471-I473 PolarHBondContact O-N 3.24Å; I473-H476 PolarHBondContact O-N 3.3Å; I473-G477 PolarHBondContact O-N 2.99Å; I473-G477 VanDerWaalsContact O-N 3.14Å
474	V	90.3	Very high	88.7	Confident	9 Å²	9	33.8 Å²	33.8	6%	0.055	18%	0.184	C	C	.	.	H	α-helix	trans	-71.7	-40.3	176.7	-179.3	0	0	0	0	109.4	E440 L444 A469 N471 D472 H476 G477 G478	E440-V474 HydrophobicContact CB-CG2 4.1Å; L444-V474 HydrophobicContact CD1-CG1 3.54Å; A469-V474 HydrophobicContact CB-CB 4.5Å; A469-V474 HydrophobicContact CB-CG1 4.15Å; N471-V474 HydrophobicContact CB-CB 4.25Å; N471-V474 HydrophobicContact CB-CG2 3.94Å; N471-V474 PolarHBondContact O-N 3.48Å; N471-V474 VanDerWaalsContact O-N 3.13Å; D472-V474 PolarHBondContact O-N 2.98Å; V474-H476 VanDerWaalsContact C-N 3.33Å; V474-H476 PolarHBondContact O-N 3.49Å; V474-G477 PolarHBondContact O-N 2.85Å; V474-G478 PolarHBondContact O-N 3Å
475	R	90.2	Very high	88.7	Confident	44 Å²	44	32.5 Å²	32.5	17%	0.166	17%	0.171	C	C	.	.	H	α-helix	trans	-61.6	-39.9	172	-67.1	-177.6	-173	141.6	-3	112.5	L466 A469 N471 D472 G478 A479 T509	L466-R475 HydrophobicContact CD1-CB 3.94Å; L466-R475 HydrophobicContact CD1-CG 4.08Å; A469-R475 HydrophobicContact CB-CG 3.81Å; A469-R475 VanDerWaalsContact O-CZ 3.26Å; A469-R475 PolarHBondContact O-NE 3.2Å; A469-R475 PolarHBondContact O-NH2 2.9Å; N471-R475 PolarHBondContact O-N 3.5Å; D472-R475 PolarHBondContact O-N 3.35Å; D472-R475 IonicContact OD1-NH1 2.67Å; D472-R475 PolarHBondContact OD1-NH1 2.82Å; R475-G478 PolarHBondContact O-N 3.11Å; R475-A479 WeakPolarHBondContact O-CB 3.37Å; R475-A479 PolarHBondContact O-N 3.39Å; R475-T509 HydrophobicContact CB-CG2 3.69Å
476	H	91.2	Very high	88.8	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-59.3	-52.5	176	178.2	88.2	0	0	0	111.7	F403 D472 I473 V474 L480 V508 A512 W773	F403-H476 AromaticContact CZ-CD2 3.88Å; D472-H476 WeakPolarHBondContact O-CB 3.39Å; D472-H476 PolarHBondContact O-N 3.23Å; I473-H476 PolarHBondContact O-N 3.3Å; V474-H476 VanDerWaalsContact C-N 3.33Å; V474-H476 PolarHBondContact O-N 3.49Å; H476-L480 WeakPolarHBondContact O-CG 3.43Å; H476-L480 PolarHBondContact O-N 3.14Å; H476-L480 VanDerWaalsContact O-N 3.14Å; H476-V508 HydrophobicContact CB-CG1 3.95Å; H476-V508 PolarHBondContact ND1-O 3.43Å; H476-A512 HydrophobicContact CB-CB 4.4Å; H476-A512 WeakPolarHBondContact ND1-CB 3.34Å; H476-A512 WeakPolarHBondContact O-CB 3.22Å; H476-W773 AromaticContact CE1-CE2 3.74Å; H476-W773 AromaticContact CE1-CZ2 3.68Å; H476-W773 AromaticContact CE1-NE1 3.47Å; H476-W773 PolarHBondContact CE1-NE1 3.38Å; H476-W773 AromaticContact NE2-CE2 3.54Å; H476-W773 AromaticContact NE2-CZ2 3.5Å; H476-W773 AromaticContact NE2-NE1 3.06Å; H476-W773 PolarHBondContact NE2-NE1 2.89Å
477	G	89.4	Confident	88.8	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-66.9	-38.7	178	0	0	0	0	0	113.6	G441 Y445 I473 V474 G481	G441-G477 VanDerWaalsContact O-CA 3.32Å; G441-G477 WeakPolarHBondContact O-CA 3.37Å; Y445-G477 PolarHBondContact N-O 2.93Å; I473-G477 PolarHBondContact O-N 2.99Å; I473-G477 VanDerWaalsContact O-N 3.14Å; V474-G477 PolarHBondContact O-N 2.85Å; G477-G481 PolarHBondContact O-N 3.25Å
478	G	90.6	Very high	88.7	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65.2	-42.6	175.8	0	0	0	0	0	113.1	V474 R475 G481 L482	V474-G478 PolarHBondContact O-N 3Å; R475-G478 PolarHBondContact O-N 3.11Å; G478-G481 PolarHBondContact O-N 2.93Å; G478-L482 WeakPolarHBondContact O-CB 3.34Å; G478-L482 PolarHBondContact O-N 3.25Å
479	A	93.1	Very high	88.6	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-66.7	-44.1	177.5	0	0	0	0	0	111.8	L466 R475 L482 G483 L498 A512 A516	L466-A479 HydrophobicContact CD2-CB 4.49Å; R475-A479 WeakPolarHBondContact O-CB 3.37Å; R475-A479 PolarHBondContact O-N 3.39Å; A479-L482 PolarHBondContact O-N 2.93Å; A479-G483 PolarHBondContact O-N 2.76Å; A479-L498 HydrophobicContact CB-CD2 3.83Å; A479-A512 HydrophobicContact CB-CB 4.02Å; A479-A516 VanDerWaalsContact O-CB 3.24Å; A479-A516 WeakPolarHBondContact O-CB 3.07Å
480	L	91.9	Very high	88.7	Confident	1 Å²	1	19.3 Å²	19.3	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-62.1	-43.8	173.7	-70.9	178	0	0	0	111.7	Y445 H476 G483 L484 A512 L515 F779	Y445-L480 HydrophobicContact CD2-CB 3.5Å; Y445-L480 HydrophobicContact CD2-CD1 4.2Å; Y445-L480 HydrophobicContact CE2-CB 3.79Å; Y445-L480 HydrophobicContact CE2-CD1 4.18Å; Y445-L480 HydrophobicContact CG-CB 4.42Å; H476-L480 WeakPolarHBondContact O-CG 3.43Å; H476-L480 PolarHBondContact O-N 3.14Å; H476-L480 VanDerWaalsContact O-N 3.14Å; L480-G483 PolarHBondContact O-N 3.2Å; L480-L484 WeakPolarHBondContact O-CB 3.19Å; L480-L484 WeakPolarHBondContact O-CG 3.27Å; L480-L484 PolarHBondContact O-N 3.28Å; L480-A512 HydrophobicContact CD1-CB 4.44Å; L480-A512 HydrophobicContact CD2-CB 3.92Å; L480-A512 HydrophobicContact CG-CB 3.68Å; L480-L515 HydrophobicContact CD2-CB 4.3Å; L480-L515 HydrophobicContact CD2-CD1 4.21Å; L480-F779 HydrophobicContact CD2-CZ 4.4Å
481	G	91.1	Very high	89.2	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-64.6	-42.3	178.4	0	0	0	0	0	112.5	G448 G477 G478 L484 A485	G448-G481 WeakPolarHBondContact CA-O 3.32Å; G477-G481 PolarHBondContact O-N 3.25Å; G478-G481 PolarHBondContact O-N 2.93Å; G481-L484 PolarHBondContact O-N 3.07Å; G481-A485 WeakPolarHBondContact O-CB 3.44Å; G481-A485 PolarHBondContact O-N 2.64Å
482	L	92.8	Very high	89.4	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-65.3	-43.6	177.3	-178.8	61.1	0	0	0	111.5	I459 L462 L466 G478 A479 L484 A485 A486 V494 L498	I459-L482 HydrophobicContact CB-CD1 4.5Å; I459-L482 HydrophobicContact CG2-CD1 3.83Å; L462-L482 HydrophobicContact CB-CB 4.33Å; L462-L482 HydrophobicContact CB-CD1 4.07Å; L466-L482 HydrophobicContact CD2-CD2 3.72Å; G478-L482 WeakPolarHBondContact O-CB 3.34Å; G478-L482 PolarHBondContact O-N 3.25Å; A479-L482 PolarHBondContact O-N 2.93Å; L482-L484 VanDerWaalsContact C-N 3.32Å; L482-L484 PolarHBondContact O-N 3.13Å; L482-A485 PolarHBondContact O-N 3.43Å; L482-A486 VanDerWaalsContact O-CB 3.27Å; L482-A486 WeakPolarHBondContact O-CB 3.43Å; L482-A486 PolarHBondContact O-N 3.21Å; L482-V494 HydrophobicContact CD1-CG1 4.17Å; L482-V494 HydrophobicContact CD1-CG2 4.35Å; L482-V494 HydrophobicContact CD2-CG1 3.8Å; L482-V494 HydrophobicContact CG-CG1 3.72Å; L482-L498 HydrophobicContact CD2-CD2 4.49Å
483	G	90.7	Very high	89.5	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-62.6	-36.8	175.9	0	0	0	0	0	113.2	A479 L480 L487 L519	A479-G483 PolarHBondContact O-N 2.76Å; L480-G483 PolarHBondContact O-N 3.2Å; G483-L487 PolarHBondContact O-N 2.82Å; G483-L519 WeakPolarHBondContact O-CB 3.44Å
484	L	90.1	Very high	89.6	Confident	0 Å²	0	18 Å²	18	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-69.2	-43.4	174.2	-80.7	172.5	0	0	0	112.9	Y445 L449 A452 N453 L480 G481 L482 A486 L487 F779 L782	Y445-L484 HydrophobicContact CD2-CD1 4.11Å; Y445-L484 HydrophobicContact CE2-CD1 3.52Å; L449-L484 HydrophobicContact CD2-CD1 3.6Å; L449-L484 HydrophobicContact CG-CD1 3.83Å; A452-L484 WeakPolarHBondContact CA-O 3.5Å; N453-L484 PolarHBondContact N-O 3.4Å; N453-L484 VanDerWaalsContact N-O 3.15Å; L480-L484 WeakPolarHBondContact O-CB 3.19Å; L480-L484 WeakPolarHBondContact O-CG 3.27Å; L480-L484 PolarHBondContact O-N 3.28Å; G481-L484 PolarHBondContact O-N 3.07Å; L482-L484 VanDerWaalsContact C-N 3.32Å; L482-L484 PolarHBondContact O-N 3.13Å; L484-A486 VanDerWaalsContact C-N 3.34Å; L484-L487 WeakPolarHBondContact O-CB 3.3Å; L484-L487 PolarHBondContact O-N 3.25Å; L484-F779 HydrophobicContact CD1-CE1 4.17Å; L484-F779 HydrophobicContact CD1-CZ 4.18Å; L484-F779 HydrophobicContact CD2-CD1 3.87Å; L484-F779 HydrophobicContact CD2-CE1 3.38Å; L484-F779 HydrophobicContact CD2-CZ 4.17Å; L484-F779 HydrophobicContact CG-CE1 3.85Å; L484-F779 HydrophobicContact CG-CZ 4.16Å; L484-L782 HydrophobicContact CD2-CD1 3.76Å; L484-L782 HydrophobicContact CD2-CD2 4.39Å
485	A	90.1	Very high	89.7	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-66.3	-38.5	178.4	0	0	0	0	0	111.6	G455 I459 L462 G481 L482 L487	G455-A485 WeakPolarHBondContact CA-O 3.5Å; G455-A485 PolarHBondContact N-O 3.25Å; I459-A485 HydrophobicContact CG1-CB 3.98Å; L462-A485 HydrophobicContact CD1-CB 4.23Å; G481-A485 WeakPolarHBondContact O-CB 3.44Å; G481-A485 PolarHBondContact O-N 2.64Å; L482-A485 PolarHBondContact O-N 3.43Å; A485-L487 VanDerWaalsContact C-N 3.35Å
486	A	88.9	Confident	89.8	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	18.5	-179.5	0	0	0	0	0	114	I459 L482 L484 G488 T489 V494 V520	I459-A486 HydrophobicContact CD1-CB 3.82Å; I459-A486 HydrophobicContact CG1-CB 4.46Å; L482-A486 VanDerWaalsContact O-CB 3.27Å; L482-A486 WeakPolarHBondContact O-CB 3.43Å; L482-A486 PolarHBondContact O-N 3.21Å; L484-A486 VanDerWaalsContact C-N 3.34Å; A486-G488 PolarHBondContact O-N 3.18Å; A486-T489 PolarHBondContact O-N 3.08Å; A486-T489 PolarHBondContact O-OG1 3.35Å; A486-V494 HydrophobicContact CB-CG1 4.36Å; A486-V520 HydrophobicContact CB-CG2 3.79Å
487	L	87.8	Confident	89.8	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	122.6	-174.7	-171.6	157.9	0	0	0	111.8	N453 G483 L484 A485 T489 L519 L522 M758 L782	N453-L487 WeakPolarHBondContact OD1-CB 3.31Å; N453-L487 WeakPolarHBondContact OD1-CD1 3.44Å; N453-L487 WeakPolarHBondContact OD1-CD2 3.42Å; G483-L487 PolarHBondContact O-N 2.82Å; L484-L487 WeakPolarHBondContact O-CB 3.3Å; L484-L487 PolarHBondContact O-N 3.25Å; A485-L487 VanDerWaalsContact C-N 3.35Å; L487-T489 PolarHBondContact O-N 2.99Å; L487-L519 WeakPolarHBondContact CA-O 3.23Å; L487-L519 HydrophobicContact CD1-CD2 4.09Å; L487-L522 HydrophobicContact CD2-CD2 3.46Å; L487-L522 VanDerWaalsContact CD2-CD2 3.46Å; L487-L522 HydrophobicContact CG-CD2 4.11Å; L487-M758 HydrophobicContact CD2-CE 3.8Å; L487-L782 HydrophobicContact CD1-CD1 4.4Å
488	G	84.8	Confident	89.9	Confident	4 Å²	4	21 Å²	21	4%	0.041	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	16.8	176.4	0	0	0	0	0	115.2	Q260 A486 L519	Q260-G488 PolarHBondContact N-O 3.13Å; A486-G488 PolarHBondContact O-N 3.18Å; G488-L519 PolarHBondContact N-O 3.2Å
489	T	84.2	Confident	90	Very high	37 Å²	37	23.2 Å²	23.2	23%	0.227	12%	0.121	C	C	.	.			trans	-86.6	-18.2	178.5	62.4	0	0	0	0	113.4	Q259 A486 L487 R491	Q259-T489 HydrophobicContact CG-CG2 4.5Å; A486-T489 PolarHBondContact O-N 3.08Å; A486-T489 PolarHBondContact O-OG1 3.35Å; L487-T489 PolarHBondContact O-N 2.99Å; T489-R491 PolarHBondContact O-N 3.48Å
490	A	85.4	Confident	89.9	Confident	36 Å²	36	25.6 Å²	25.6	30%	0.298	14%	0.137	S	C	.	.			trans	52.1	32.7	-175.5	0	0	0	0	0	114.4	Q492 V520 M521	A490-Q492 PolarHBondContact O-N 2.94Å; A490-V520 PolarHBondContact N-O 3.06Å; A490-V520 VanDerWaalsContact N-O 3.08Å; A490-M521 HydrophobicContact CB-SD 4.3Å
491	R	87.4	Confident	89.7	Confident	75 Å²	75	25.8 Å²	25.8	28%	0.283	14%	0.139	S	C	.	.			trans	-70.4	122.2	176.3	-81.3	-169.2	63.7	178.2	-3.3	111.8	D460 T489 D493 V494 Y495	D460-R491 IonicContact OD1-NH1 2.87Å; D460-R491 PolarHBondContact OD1-NH1 3.14Å; D460-R491 IonicContact OD1-NH2 2.74Å; T489-R491 PolarHBondContact O-N 3.48Å; R491-D493 IonicContact CZ-OD2 3.09Å; R491-D493 IonicContact NE-OD2 3.79Å; R491-D493 IonicContact NH2-OD2 3.77Å; R491-D493 PolarHBondContact NH2-OD2 3.42Å; R491-V494 HydrophobicContact CB-CB 4.43Å; R491-V494 HydrophobicContact CB-CG2 4.2Å; R491-Y495 PolarHBondContact O-N 3.05Å
492	Q	88.9	Confident	89.6	Confident	75 Å²	75	26 Å²	26	35%	0.35	14%	0.14	S	C	.	.	H	α-helix	trans	-68.5	-39.6	-179.8	-165.6	61.9	34.1	0	0	113.2	A490 V494 Y495 D496	A490-Q492 PolarHBondContact O-N 2.94Å; Q492-V494 VanDerWaalsContact C-N 3.26Å; Q492-V494 PolarHBondContact O-N 2.96Å; Q492-Y495 VanDerWaalsContact NE2-CD1 3.33Å; Q492-Y495 WeakPolarHBondContact O-CA 3.5Å; Q492-Y495 WeakPolarHBondContact O-CB 3.49Å; Q492-Y495 PolarHBondContact O-N 3.23Å; Q492-D496 PolarHBondContact NE2-OD1 3.43Å; Q492-D496 PolarHBondContact O-N 3.25Å
493	D	90.6	Very high	89.5	Confident	95 Å²	95	31.5 Å²	31.5	51%	0.508	16%	0.161	S	C	.	.	H	α-helix	trans	-58.9	-39.6	-178.3	-39.9	-39.7	0	0	0	112.5	R491 L497	R491-D493 IonicContact CZ-OD2 3.09Å; R491-D493 IonicContact NE-OD2 3.79Å; R491-D493 IonicContact NH2-OD2 3.77Å; R491-D493 PolarHBondContact NH2-OD2 3.42Å; D493-L497 PolarHBondContact O-N 2.97Å
494	V	91.1	Very high	89.3	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-70.3	-41.8	178.3	177.6	0	0	0	0	109.9	I459 L463 L482 A486 R491 Q492 L497 L498 V520	I459-V494 HydrophobicContact CG2-CG2 3.92Å; L463-V494 HydrophobicContact CD1-CG2 4.24Å; L482-V494 HydrophobicContact CD1-CG1 4.17Å; L482-V494 HydrophobicContact CD1-CG2 4.35Å; L482-V494 HydrophobicContact CD2-CG1 3.8Å; L482-V494 HydrophobicContact CG-CG1 3.72Å; A486-V494 HydrophobicContact CB-CG1 4.36Å; R491-V494 HydrophobicContact CB-CB 4.43Å; R491-V494 HydrophobicContact CB-CG2 4.2Å; Q492-V494 VanDerWaalsContact C-N 3.26Å; Q492-V494 PolarHBondContact O-N 2.96Å; V494-L497 PolarHBondContact O-N 2.86Å; V494-L498 HydrophobicContact CG1-CD1 3.84Å; V494-L498 HydrophobicContact CG1-CG 4.35Å; V494-L498 WeakPolarHBondContact O-CB 3.48Å; V494-L498 VanDerWaalsContact O-CG 3.27Å; V494-L498 WeakPolarHBondContact O-CG 3.48Å; V494-L498 PolarHBondContact O-N 2.93Å; V494-V520 HydrophobicContact CG1-CG2 3.86Å
495	Y	92.9	Very high	89.2	Confident	6 Å²	6	39.3 Å²	39.3	2%	0.024	20%	0.2	C	C	.	.	H	α-helix	trans	-59.2	-48.2	176.3	178.2	-89	0	0	0	111.6	R491 Q492 L497 L498 K499 L517 M521 A529 D532 M533	R491-Y495 PolarHBondContact O-N 3.05Å; Q492-Y495 VanDerWaalsContact NE2-CD1 3.33Å; Q492-Y495 WeakPolarHBondContact O-CA 3.5Å; Q492-Y495 WeakPolarHBondContact O-CB 3.49Å; Q492-Y495 PolarHBondContact O-N 3.23Å; Y495-L497 PolarHBondContact O-N 3.13Å; Y495-L498 PolarHBondContact O-N 2.79Å; Y495-K499 HydrophobicContact CE1-CD 4.04Å; Y495-K499 VanDerWaalsContact O-CB 3.31Å; Y495-K499 WeakPolarHBondContact O-CB 3.45Å; Y495-K499 PolarHBondContact O-N 2.99Å; Y495-L517 HydrophobicContact CD2-CD2 3.38Å; Y495-L517 HydrophobicContact CE2-CD2 3.56Å; Y495-L517 HydrophobicContact CG-CD2 4.01Å; Y495-M521 HydrophobicContact CD2-CG 3.65Å; Y495-M521 HydrophobicContact CD2-SD 4.26Å; Y495-M521 HydrophobicContact CE2-CG 4.13Å; Y495-A529 HydrophobicContact CE2-CB 3.75Å; Y495-A529 WeakPolarHBondContact OH-CA 3.38Å; Y495-D532 WeakPolarHBondContact OH-CB 3.42Å; Y495-D532 PolarHBondContact OH-OD2 3.3Å; Y495-M533 HydrophobicContact CE2-CE 4.38Å
496	D	91.9	Very high	89.1	Confident	83 Å²	83	41.2 Å²	41.2	44%	0.444	21%	0.21	S	C	.	.	H	α-helix	trans	-64.7	-38.9	-178	-67.2	-22	0	0	0	112	Q492 K499 S500	Q492-D496 PolarHBondContact NE2-OD1 3.43Å; Q492-D496 PolarHBondContact O-N 3.25Å; D496-K499 PolarHBondContact O-N 3.45Å; D496-S500 PolarHBondContact O-N 2.95Å
497	L	91.8	Very high	89.1	Confident	28 Å²	28	42.4 Å²	42.4	15%	0.147	22%	0.22	C	C	.	.	H	α-helix	trans	-65.2	-46.2	174.5	-178.4	64.2	0	0	0	111.6	L463 L466 D493 V494 Y495 K499 S500 N501	L463-L497 HydrophobicContact CD2-CD2 4.09Å; L463-L497 HydrophobicContact CG-CD2 3.75Å; L466-L497 HydrophobicContact CB-CD2 4.33Å; L466-L497 HydrophobicContact CD2-CD2 3.97Å; L466-L497 HydrophobicContact CD2-CG 4.32Å; L466-L497 HydrophobicContact CG-CD2 4.34Å; D493-L497 PolarHBondContact O-N 2.97Å; V494-L497 PolarHBondContact O-N 2.86Å; Y495-L497 PolarHBondContact O-N 3.13Å; L497-K499 VanDerWaalsContact C-N 3.31Å; L497-K499 PolarHBondContact O-N 3.01Å; L497-S500 WeakPolarHBondContact O-CB 3.49Å; L497-S500 PolarHBondContact O-N 3.08Å; L497-S500 PolarHBondContact O-OG 3.04Å; L497-N501 PolarHBondContact O-N 3.24Å; L497-N501 VanDerWaalsContact O-N 3.13Å
498	L	91.7	Very high	89.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.6	-36.7	178.2	-70.9	172.2	0	0	0	111.7	L466 A479 L482 V494 Y495 S500 N501 L502 A516 L517 V520	L466-L498 HydrophobicContact CD2-CD2 4.14Å; A479-L498 HydrophobicContact CB-CD2 3.83Å; L482-L498 HydrophobicContact CD2-CD2 4.49Å; V494-L498 HydrophobicContact CG1-CD1 3.84Å; V494-L498 HydrophobicContact CG1-CG 4.35Å; V494-L498 WeakPolarHBondContact O-CB 3.48Å; V494-L498 VanDerWaalsContact O-CG 3.27Å; V494-L498 WeakPolarHBondContact O-CG 3.48Å; V494-L498 PolarHBondContact O-N 2.93Å; Y495-L498 PolarHBondContact O-N 2.79Å; L498-S500 VanDerWaalsContact C-N 3.34Å; L498-N501 PolarHBondContact O-N 3.27Å; L498-L502 PolarHBondContact O-N 3.09Å; L498-A516 HydrophobicContact CD1-CB 3.64Å; L498-A516 HydrophobicContact CD2-CB 3.95Å; L498-A516 HydrophobicContact CG-CB 4.44Å; L498-L517 HydrophobicContact CB-CD2 3.55Å; L498-L517 HydrophobicContact CB-CG 3.87Å; L498-L517 HydrophobicContact CD1-CD2 4.34Å; L498-L517 HydrophobicContact CD1-CG 4.5Å; L498-V520 HydrophobicContact CD1-CG2 4.26Å
499	K	92.1	Very high	89.4	Confident	47 Å²	47	43.5 Å²	43.5	20%	0.204	23%	0.226	C	C	.	.	H	α-helix	trans	-60.5	-42.7	172.2	-176.5	176	-176.3	172	0	111.3	Y495 D496 L497 N501 L502 Y503 D532	Y495-K499 HydrophobicContact CE1-CD 4.04Å; Y495-K499 VanDerWaalsContact O-CB 3.31Å; Y495-K499 WeakPolarHBondContact O-CB 3.45Å; Y495-K499 PolarHBondContact O-N 2.99Å; D496-K499 PolarHBondContact O-N 3.45Å; L497-K499 VanDerWaalsContact C-N 3.31Å; L497-K499 PolarHBondContact O-N 3.01Å; K499-N501 VanDerWaalsContact C-N 3.28Å; K499-N501 PolarHBondContact O-N 2.93Å; K499-L502 WeakPolarHBondContact O-CB 3.18Å; K499-L502 PolarHBondContact O-N 3.14Å; K499-Y503 HydrophobicContact CD-CE2 4.14Å; K499-Y503 VanDerWaalsContact CE-CE2 3.43Å; K499-Y503 VanDerWaalsContact CE-CZ 3.45Å; K499-Y503 WeakPolarHBondContact CE-OH 3.46Å; K499-Y503 HydrophobicContact CG-CD2 4.19Å; K499-Y503 HydrophobicContact CG-CE2 3.7Å; K499-Y503 PolarHBondContact O-N 3.23Å; K499-D532 WeakPolarHBondContact CE-OD2 3.46Å; K499-D532 IonicContact NZ-OD1 3.83Å; K499-D532 PolarHBondContact NZ-OD1 3.49Å; K499-D532 IonicContact NZ-OD2 3.29Å; K499-D532 PolarHBondContact NZ-OD2 3.03Å
500	S	91.4	Very high	89.6	Confident	51 Å²	51	41.8 Å²	41.8	36%	0.357	22%	0.215	S	C	.	.	H	α-helix	trans	-62.8	-34.4	175.9	80.9	0	0	0	0	112.9	D496 L497 L498 Q504	D496-S500 PolarHBondContact O-N 2.95Å; L497-S500 WeakPolarHBondContact O-CB 3.49Å; L497-S500 PolarHBondContact O-N 3.08Å; L497-S500 PolarHBondContact O-OG 3.04Å; L498-S500 VanDerWaalsContact C-N 3.34Å; S500-Q504 WeakPolarHBondContact O-CG 3.22Å; S500-Q504 PolarHBondContact O-N 3.47Å
501	N	88.8	Confident	89.8	Confident	5 Å²	5	40.3 Å²	40.3	3%	0.027	20%	0.202	C	C	.	.	H	α-helix	trans	-74.1	-31.6	175.4	-73.7	-13.8	0	0	0	112.4	L497 L498 K499 Q504 T509 A513	L497-N501 PolarHBondContact O-N 3.24Å; L497-N501 VanDerWaalsContact O-N 3.13Å; L498-N501 PolarHBondContact O-N 3.27Å; K499-N501 VanDerWaalsContact C-N 3.28Å; K499-N501 PolarHBondContact O-N 2.93Å; N501-Q504 PolarHBondContact O-N 3.47Å; N501-Q504 PolarHBondContact OD1-NE2 3.21Å; N501-T509 HydrophobicContact CB-CG2 4.25Å; N501-A513 HydrophobicContact CB-CB 4.45Å
502	L	88.9	Confident	90	Very high	4 Å²	4	36.7 Å²	36.7	2%	0.021	19%	0.188	C	C	.	.	H	α-helix	trans	-65.2	-45.4	174.5	-174.1	68.4	0	0	0	110.7	L498 K499 Q504 D505 A513 L517 Y536 I545 L549	L498-L502 PolarHBondContact O-N 3.09Å; K499-L502 WeakPolarHBondContact O-CB 3.18Å; K499-L502 PolarHBondContact O-N 3.14Å; L502-Q504 PolarHBondContact O-N 3.18Å; L502-D505 PolarHBondContact O-N 2.99Å; L502-D505 VanDerWaalsContact O-N 3.08Å; L502-A513 HydrophobicContact CB-CB 4.44Å; L502-L517 HydrophobicContact CD2-CD1 3.93Å; L502-Y536 HydrophobicContact CD1-CD1 4.04Å; L502-Y536 HydrophobicContact CD1-CE1 3.84Å; L502-Y536 HydrophobicContact CD2-CD1 3.62Å; L502-Y536 HydrophobicContact CD2-CE1 4.1Å; L502-Y536 HydrophobicContact CD2-CG 4.29Å; L502-Y536 HydrophobicContact CG-CD1 3.59Å; L502-Y536 HydrophobicContact CG-CE1 3.51Å; L502-Y536 PolarHBondContact O-OH 3.1Å; L502-I545 HydrophobicContact CD1-CG2 3.61Å; L502-L549 HydrophobicContact CD1-CD1 4.34Å; L502-L549 HydrophobicContact CD1-CD2 4.2Å; L502-L549 HydrophobicContact CD1-CG 4.39Å; L502-L549 HydrophobicContact CD2-CD1 4.48Å; L502-L549 HydrophobicContact CD2-CD2 3.77Å
503	Y	89.6	Confident	90.2	Very high	115 Å²	115	33.1 Å²	33.1	45%	0.451	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-7.4	179.1	-65.7	-24.2	0	0	0	115.3	K499 D505 Y536	K499-Y503 HydrophobicContact CD-CE2 4.14Å; K499-Y503 VanDerWaalsContact CE-CE2 3.43Å; K499-Y503 VanDerWaalsContact CE-CZ 3.45Å; K499-Y503 WeakPolarHBondContact CE-OH 3.46Å; K499-Y503 HydrophobicContact CG-CD2 4.19Å; K499-Y503 HydrophobicContact CG-CE2 3.7Å; K499-Y503 PolarHBondContact O-N 3.23Å; Y503-D505 PolarHBondContact O-N 3.47Å; Y503-Y536 AromaticContact CD1-CD2 3.77Å; Y503-Y536 HydrophobicContact CD1-CD2 3.77Å; Y503-Y536 AromaticContact CD1-CE2 3.67Å; Y503-Y536 HydrophobicContact CD1-CE2 3.67Å; Y503-Y536 HydrophobicContact CD1-CG 4.32Å; Y503-Y536 AromaticContact CE1-CD2 3.67Å; Y503-Y536 HydrophobicContact CE1-CD2 3.67Å; Y503-Y536 HydrophobicContact CE1-CE2 4.08Å; Y503-Y536 HydrophobicContact CE1-CG 4.06Å
504	Q	87.9	Confident	90.2	Very high	93 Å²	93	28.6 Å²	28.6	44%	0.435	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-12.7	168.6	-71.5	168.6	28.6	0	0	112.4	S500 N501 L502 D506	S500-Q504 WeakPolarHBondContact O-CG 3.22Å; S500-Q504 PolarHBondContact O-N 3.47Å; N501-Q504 PolarHBondContact O-N 3.47Å; N501-Q504 PolarHBondContact OD1-NE2 3.21Å; L502-Q504 PolarHBondContact O-N 3.18Å; Q504-D506 PolarHBondContact O-N 3.47Å
505	D	86.6	Confident	90.3	Very high	71 Å²	71	28.8 Å²	28.8	38%	0.38	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	32.4	175.8	-155.4	30.3	0	0	0	114.1	L502 Y503 Y536 T540 H542	L502-D505 PolarHBondContact O-N 2.99Å; L502-D505 VanDerWaalsContact O-N 3.08Å; Y503-D505 PolarHBondContact O-N 3.47Å; D505-Y536 PolarHBondContact OD1-OH 3.04Å; D505-T540 PolarHBondContact OD1-OG1 3.42Å; D505-H542 IonicContact OD1-CD2 3.55Å; D505-H542 PolarHBondContact OD1-CD2 3.1Å
506	D	89.2	Confident	90.3	Very high	41 Å²	41	28.5 Å²	28.5	22%	0.219	15%	0.147	C	C	.	.			trans	-85.4	130.8	169.9	172.7	46	0	0	0	111.1	D472 Q504 V508 T509 G510	D472-D506 WeakPolarHBondContact CB-OD2 3.4Å; Q504-D506 PolarHBondContact O-N 3.47Å; D506-V508 PolarHBondContact O-N 3.1Å; D506-T509 WeakPolarHBondContact OD2-CB 3.45Å; D506-T509 PolarHBondContact OD2-N 3.13Å; D506-T509 PolarHBondContact OD2-OG1 3.05Å; D506-G510 WeakPolarHBondContact O-CA 3.38Å; D506-G510 PolarHBondContact O-N 3.36Å
507	A	88.1	Confident	90.4	Very high	24 Å²	24	24.6 Å²	24.6	20%	0.198	13%	0.127	C	C	.	.	H	α-helix	trans	-64.8	-35.5	-172.1	0	0	0	0	0	113.8	K544	A507-K544 HydrophobicContact CB-CD 4.39Å; A507-K544 WeakPolarHBondContact O-CB 3.43Å; A507-K544 WeakPolarHBondContact O-CD 2.94Å
508	V	88.9	Confident	90.3	Very high	28 Å²	28	23.3 Å²	23.3	17%	0.17	12%	0.12	C	C	.	.	H	α-helix	trans	-86.5	-44.6	-177.1	178	0	0	0	0	110.7	W400 H476 D506 G510	W400-V508 HydrophobicContact CH2-CG1 3.86Å; W400-V508 HydrophobicContact CZ2-CG1 4.12Å; H476-V508 HydrophobicContact CB-CG1 3.95Å; H476-V508 PolarHBondContact ND1-O 3.43Å; D506-V508 PolarHBondContact O-N 3.1Å; V508-G510 VanDerWaalsContact C-N 3.34Å
509	T	90.1	Very high	90.3	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-65	-39.7	176.9	-54.6	0	0	0	0	111.2	D472 R475 N501 D506 E511 A512 A513	D472-T509 PolarHBondContact O-OG1 3.43Å; R475-T509 HydrophobicContact CB-CG2 3.69Å; N501-T509 HydrophobicContact CB-CG2 4.25Å; D506-T509 WeakPolarHBondContact OD2-CB 3.45Å; D506-T509 PolarHBondContact OD2-N 3.13Å; D506-T509 PolarHBondContact OD2-OG1 3.05Å; T509-E511 PolarHBondContact O-N 3.46Å; T509-A512 PolarHBondContact O-N 3.38Å; T509-A513 WeakPolarHBondContact O-CB 3.09Å; T509-A513 PolarHBondContact O-N 3.42Å
510	G	88.4	Confident	90.3	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-66.6	-30.6	-178.6	0	0	0	0	0	114.5	D506 V508 G514	D506-G510 WeakPolarHBondContact O-CA 3.38Å; D506-G510 PolarHBondContact O-N 3.36Å; V508-G510 VanDerWaalsContact C-N 3.34Å; G510-G514 PolarHBondContact O-N 2.89Å
511	E	89.9	Confident	90.2	Very high	5 Å²	5	19 Å²	19	2%	0.023	10%	0.095	C	C	.	.	H	α-helix	trans	-64.6	-44.5	172.6	-172.4	166.5	-142.3	0	0	111.1	T509 L515 K544 R547	T509-E511 PolarHBondContact O-N 3.46Å; E511-L515 WeakPolarHBondContact O-CG 3.4Å; E511-L515 PolarHBondContact O-N 3.32Å; E511-K544 HydrophobicContact CB-CB 4.11Å; E511-K544 WeakPolarHBondContact CB-O 3.4Å; E511-K544 WeakPolarHBondContact CG-O 3.44Å; E511-R547 IonicContact OE1-CZ 3.57Å; E511-R547 IonicContact OE1-NE 3.48Å; E511-R547 IonicContact OE1-NH2 3.47Å; E511-R547 PolarHBondContact OE1-NH2 2.97Å; E511-R547 VanDerWaalsContact OE1-NH2 3.14Å
512	A	91.3	Very high	90.3	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-67.7	-42.6	176	0	0	0	0	0	112.4	H476 A479 L480 T509 L515 A516	H476-A512 HydrophobicContact CB-CB 4.4Å; H476-A512 WeakPolarHBondContact ND1-CB 3.34Å; H476-A512 WeakPolarHBondContact O-CB 3.22Å; A479-A512 HydrophobicContact CB-CB 4.02Å; L480-A512 HydrophobicContact CD1-CB 4.44Å; L480-A512 HydrophobicContact CD2-CB 3.92Å; L480-A512 HydrophobicContact CG-CB 3.68Å; T509-A512 PolarHBondContact O-N 3.38Å; A512-L515 PolarHBondContact O-N 3.4Å; A512-A516 WeakPolarHBondContact O-CB 3.37Å; A512-A516 PolarHBondContact O-N 3.16Å
513	A	92.5	Very high	90.1	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-64	-44.9	178.4	0	0	0	0	0	111.5	N501 L502 T509 L515 A516 L517	N501-A513 HydrophobicContact CB-CB 4.45Å; L502-A513 HydrophobicContact CB-CB 4.44Å; T509-A513 WeakPolarHBondContact O-CB 3.09Å; T509-A513 PolarHBondContact O-N 3.42Å; A513-L515 PolarHBondContact O-N 3.37Å; A513-A516 PolarHBondContact O-N 3.45Å; A513-L517 WeakPolarHBondContact O-CB 3.41Å; A513-L517 VanDerWaalsContact O-CG 3.24Å; A513-L517 WeakPolarHBondContact O-CG 3.37Å; A513-L517 PolarHBondContact O-N 3.44Å
514	G	91.9	Very high	89.7	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-60.6	-43.7	176.8	0	0	0	0	0	112.9	G510 G518 G548	G510-G514 PolarHBondContact O-N 2.89Å; G514-G518 PolarHBondContact O-N 3.19Å; G514-G548 CarbonylContact C-O 3.57Å
515	L	92.8	Very high	89.5	Confident	4 Å²	4	15 Å²	15	2%	0.021	9%	0.085	C	C	.	.	H	α-helix	trans	-63.5	-47.2	173.5	-76	167.3	0	0	0	111.7	L480 E511 A512 A513 L517 G518 L519 G548 V551 L776	L480-L515 HydrophobicContact CD2-CB 4.3Å; L480-L515 HydrophobicContact CD2-CD1 4.21Å; E511-L515 WeakPolarHBondContact O-CG 3.4Å; E511-L515 PolarHBondContact O-N 3.32Å; A512-L515 PolarHBondContact O-N 3.4Å; A513-L515 PolarHBondContact O-N 3.37Å; L515-L517 PolarHBondContact O-N 2.86Å; L515-G518 PolarHBondContact O-N 3.07Å; L515-L519 WeakPolarHBondContact O-CG 3.34Å; L515-L519 PolarHBondContact O-N 2.71Å; L515-G548 PolarHBondContact N-O 3.35Å; L515-V551 HydrophobicContact CD2-CB 3.58Å; L515-V551 HydrophobicContact CD2-CG1 3.59Å; L515-V551 HydrophobicContact CD2-CG2 4.18Å; L515-L776 HydrophobicContact CD1-CD2 3.91Å
516	A	93.4	Very high	89.5	Confident	0 Å²	0	13 Å²	13	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-62.6	-41	-178.7	0	0	0	0	0	112.3	A479 L498 A512 A513 G518 L519 V520	A479-A516 VanDerWaalsContact O-CB 3.24Å; A479-A516 WeakPolarHBondContact O-CB 3.07Å; L498-A516 HydrophobicContact CD1-CB 3.64Å; L498-A516 HydrophobicContact CD2-CB 3.95Å; L498-A516 HydrophobicContact CG-CB 4.44Å; A512-A516 WeakPolarHBondContact O-CB 3.37Å; A512-A516 PolarHBondContact O-N 3.16Å; A513-A516 PolarHBondContact O-N 3.45Å; A516-G518 VanDerWaalsContact C-N 3.29Å; A516-G518 PolarHBondContact O-N 3.01Å; A516-L519 PolarHBondContact O-N 3.39Å; A516-L519 VanDerWaalsContact O-N 3.13Å; A516-V520 WeakPolarHBondContact O-CG2 3.38Å; A516-V520 PolarHBondContact O-N 2.82Å
517	L	92.6	Very high	89.4	Confident	1 Å²	1	14 Å²	14	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-56.2	-44.6	174.9	-74.7	168.4	0	0	0	111.5	Y495 L498 L502 A513 L515 M521 M533	Y495-L517 HydrophobicContact CD2-CD2 3.38Å; Y495-L517 HydrophobicContact CE2-CD2 3.56Å; Y495-L517 HydrophobicContact CG-CD2 4.01Å; L498-L517 HydrophobicContact CB-CD2 3.55Å; L498-L517 HydrophobicContact CB-CG 3.87Å; L498-L517 HydrophobicContact CD1-CD2 4.34Å; L498-L517 HydrophobicContact CD1-CG 4.5Å; L502-L517 HydrophobicContact CD2-CD1 3.93Å; A513-L517 WeakPolarHBondContact O-CB 3.41Å; A513-L517 VanDerWaalsContact O-CG 3.24Å; A513-L517 WeakPolarHBondContact O-CG 3.37Å; A513-L517 PolarHBondContact O-N 3.44Å; L515-L517 PolarHBondContact O-N 2.86Å; L517-M521 WeakPolarHBondContact O-CB 3.35Å; L517-M521 PolarHBondContact O-N 2.93Å; L517-M521 VanDerWaalsContact O-N 3.07Å; L517-M533 HydrophobicContact CB-CE 4.2Å; L517-M533 HydrophobicContact CB-SD 4.21Å
518	G	90.8	Very high	89.4	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-68.8	-34.4	176	0	0	0	0	0	114.3	G514 L515 A516 L522 G552	G514-G518 PolarHBondContact O-N 3.19Å; L515-G518 PolarHBondContact O-N 3.07Å; A516-G518 VanDerWaalsContact C-N 3.29Å; A516-G518 PolarHBondContact O-N 3.01Å; G518-L522 WeakPolarHBondContact O-CA 3.18Å; G518-L522 PolarHBondContact O-N 3.08Å; G518-G552 WeakPolarHBondContact CA-O 3.48Å
519	L	91.6	Very high	89.4	Confident	1 Å²	1	17.5 Å²	17.5	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-67.3	-41.6	175.5	-68.6	170.7	0	0	0	111.8	G483 L487 G488 L515 A516 L522 L555 V762 F779	G483-L519 WeakPolarHBondContact O-CB 3.44Å; L487-L519 WeakPolarHBondContact CA-O 3.23Å; L487-L519 HydrophobicContact CD1-CD2 4.09Å; G488-L519 PolarHBondContact N-O 3.2Å; L515-L519 WeakPolarHBondContact O-CG 3.34Å; L515-L519 PolarHBondContact O-N 2.71Å; A516-L519 PolarHBondContact O-N 3.39Å; A516-L519 VanDerWaalsContact O-N 3.13Å; L519-L522 VanDerWaalsContact O-CB 3.31Å; L519-L522 WeakPolarHBondContact O-CB 3.37Å; L519-L555 HydrophobicContact CD2-CD1 3.92Å; L519-L555 HydrophobicContact CG-CD1 4.24Å; L519-V762 HydrophobicContact CD2-CG1 3.5Å; L519-V762 VanDerWaalsContact CD2-CG1 3.5Å; L519-F779 HydrophobicContact CD1-CE1 3.91Å; L519-F779 HydrophobicContact CD1-CZ 4.28Å
520	V	91.8	Very high	89.3	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-67.9	-43.2	177.8	177.7	0	0	0	0	111.4	A486 A490 V494 L498 A516 L522	A486-V520 HydrophobicContact CB-CG2 3.79Å; A490-V520 PolarHBondContact N-O 3.06Å; A490-V520 VanDerWaalsContact N-O 3.08Å; V494-V520 HydrophobicContact CG1-CG2 3.86Å; L498-V520 HydrophobicContact CD1-CG2 4.26Å; A516-V520 WeakPolarHBondContact O-CG2 3.38Å; A516-V520 PolarHBondContact O-N 2.82Å; V520-L522 VanDerWaalsContact C-N 3.29Å; V520-L522 PolarHBondContact O-N 2.89Å
521	M	89.9	Confident	89.4	Confident	8 Å²	8	25.3 Å²	25.3	4%	0.039	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	16.6	-177.3	-61.1	-57.1	-76.4	0	0	113.6	A490 Y495 L517 G523 S524 A529 V556	A490-M521 HydrophobicContact CB-SD 4.3Å; Y495-M521 HydrophobicContact CD2-CG 3.65Å; Y495-M521 HydrophobicContact CD2-SD 4.26Å; Y495-M521 HydrophobicContact CE2-CG 4.13Å; L517-M521 WeakPolarHBondContact O-CB 3.35Å; L517-M521 PolarHBondContact O-N 2.93Å; L517-M521 VanDerWaalsContact O-N 3.07Å; M521-G523 PolarHBondContact O-N 3.09Å; M521-S524 WeakPolarHBondContact O-CB 3.3Å; M521-S524 PolarHBondContact O-N 2.78Å; M521-S524 VanDerWaalsContact O-N 3.12Å; M521-S524 PolarHBondContact O-OG 3.13Å; M521-A529 HydrophobicContact CE-CB 4.28Å; M521-A529 HydrophobicContact CG-CB 4.31Å; M521-V556 HydrophobicContact CB-CG2 3.88Å
522	L	89.9	Confident	89.5	Confident	6 Å²	6	27.1 Å²	27.1	3%	0.031	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	123.4	-177.9	-177.4	72.4	0	0	0	111.6	L487 G518 L519 V520 S524 L555 M758 V762	L487-L522 HydrophobicContact CD2-CD2 3.46Å; L487-L522 VanDerWaalsContact CD2-CD2 3.46Å; L487-L522 HydrophobicContact CG-CD2 4.11Å; G518-L522 WeakPolarHBondContact O-CA 3.18Å; G518-L522 PolarHBondContact O-N 3.08Å; L519-L522 VanDerWaalsContact O-CB 3.31Å; L519-L522 WeakPolarHBondContact O-CB 3.37Å; V520-L522 VanDerWaalsContact C-N 3.29Å; V520-L522 PolarHBondContact O-N 2.89Å; L522-S524 PolarHBondContact O-N 2.54Å; L522-S524 VanDerWaalsContact O-N 3.1Å; L522-L555 HydrophobicContact CD1-CB 3.77Å; L522-L555 HydrophobicContact CD1-CD2 3.87Å; L522-L555 HydrophobicContact CD1-CG 4.38Å; L522-L555 WeakPolarHBondContact CD1-O 2.94Å; L522-M758 HydrophobicContact CD2-CE 3.68Å; L522-M758 HydrophobicContact CD2-CG 3.57Å; L522-M758 HydrophobicContact CD2-SD 3.37Å; L522-M758 WeakPolarHBondContact CD2-SD 3.5Å; L522-M758 HydrophobicContact CG-CG 4.31Å; L522-M758 HydrophobicContact CG-SD 3.85Å; L522-V762 HydrophobicContact CD1-CG2 3.69Å; L522-V762 HydrophobicContact CD2-CG2 3.84Å; L522-V762 HydrophobicContact CG-CG2 4.46Å
523	G	83.9	Confident	89.4	Confident	9 Å²	9	27.1 Å²	27.1	9%	0.093	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.5	-2.2	178.9	0	0	0	0	0	115.9	M521 K525 L555 V556 R560	M521-G523 PolarHBondContact O-N 3.09Å; G523-K525 PolarHBondContact O-N 3.2Å; G523-L555 PolarHBondContact N-O 3.34Å; G523-V556 CarbonylContact C-O 3.53Å; G523-V556 WeakPolarHBondContact CA-O 3.39Å; G523-V556 PolarHBondContact N-O 3.2Å; G523-R560 PolarHBondContact O-NE 3.16Å; G523-R560 PolarHBondContact O-NH2 2.74Å
524	S	81.8	Confident	89.3	Confident	30 Å²	30	28.1 Å²	28.1	21%	0.21	15%	0.153	C	C	.	.			trans	-72.9	-25	-175.1	65.7	0	0	0	0	114.4	M521 L522 S526	M521-S524 WeakPolarHBondContact O-CB 3.3Å; M521-S524 PolarHBondContact O-N 2.78Å; M521-S524 VanDerWaalsContact O-N 3.12Å; M521-S524 PolarHBondContact O-OG 3.13Å; L522-S524 PolarHBondContact O-N 2.54Å; L522-S524 VanDerWaalsContact O-N 3.1Å; S524-S526 PolarHBondContact O-N 3.27Å; S524-S526 PolarHBondContact OG-N 3Å
525	K	84.6	Confident	89.2	Confident	88 Å²	88	29.5 Å²	29.5	38%	0.383	17%	0.167	S	C	.	.			trans	50.7	37.4	-171	-163.3	-153.9	176.5	174.7	0	113	G523 A527 M557 R560 E563	G523-K525 PolarHBondContact O-N 3.2Å; K525-A527 PolarHBondContact O-N 3.21Å; K525-A527 VanDerWaalsContact O-N 3.16Å; K525-M557 HydrophobicContact CG-SD 4.16Å; K525-R560 HydrophobicContact CB-CG 4.37Å; K525-E563 VanDerWaalsContact CD-OE2 3.3Å; K525-E563 WeakPolarHBondContact CD-OE2 3.45Å; K525-E563 WeakPolarHBondContact CE-OE2 3.24Å; K525-E563 IonicContact NZ-OE2 3.34Å; K525-E563 PolarHBondContact NZ-OE2 3.13Å
526	S	86.4	Confident	89.2	Confident	28 Å²	28	30.4 Å²	30.4	20%	0.196	17%	0.171	C	C	.	.			trans	-66	116.6	174.2	177.6	0	0	0	0	110.4	S524 Q528 A529 I530	S524-S526 PolarHBondContact O-N 3.27Å; S524-S526 PolarHBondContact OG-N 3Å; S526-Q528 VanDerWaalsContact C-N 3.28Å; S526-Q528 PolarHBondContact O-N 3.03Å; S526-A529 PolarHBondContact O-N 2.92Å; S526-I530 WeakPolarHBondContact O-CD1 3.5Å; S526-I530 WeakPolarHBondContact O-CG1 3.22Å; S526-I530 PolarHBondContact O-N 3.45Å
527	A	87	Confident	89	Confident	61 Å²	61	30.5 Å²	30.5	50%	0.504	17%	0.171	S	C	.	.	H	α-helix	trans	-59.3	-41.1	178.8	0	0	0	0	0	111.6	K525 A529 I530 E531	K525-A527 PolarHBondContact O-N 3.21Å; K525-A527 VanDerWaalsContact O-N 3.16Å; A527-A529 VanDerWaalsContact C-N 3.33Å; A527-A529 PolarHBondContact O-N 2.81Å; A527-I530 PolarHBondContact O-N 3.06Å; A527-E531 WeakPolarHBondContact O-CG 3.49Å; A527-E531 PolarHBondContact O-N 2.99Å
528	Q	88.4	Confident	88.8	Confident	126 Å²	126	35.2 Å²	35.2	59%	0.589	19%	0.193	S	C	*	.	H	α-helix	trans	-58.8	-45.2	177.1	-66.2	178.3	-7.3	0	0	111.5	S526 I530 E531 D532	S526-Q528 VanDerWaalsContact C-N 3.28Å; S526-Q528 PolarHBondContact O-N 3.03Å; Q528-I530 VanDerWaalsContact C-N 3.32Å; Q528-I530 PolarHBondContact O-N 3.07Å; Q528-E531 PolarHBondContact O-N 3.12Å; Q528-D532 VanDerWaalsContact O-CB 3.32Å; Q528-D532 WeakPolarHBondContact O-CB 3.46Å; Q528-D532 PolarHBondContact O-N 3.43Å
529	A	88.4	Confident	88.7	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.008	23%	0.226	C	C	.	.	H	α-helix	trans	-64.6	-38.2	-179.5	0	0	0	0	0	112.5	Y495 M521 S526 A527 M533	Y495-A529 HydrophobicContact CE2-CB 3.75Å; Y495-A529 WeakPolarHBondContact OH-CA 3.38Å; M521-A529 HydrophobicContact CE-CB 4.28Å; M521-A529 HydrophobicContact CG-CB 4.31Å; S526-A529 PolarHBondContact O-N 2.92Å; A527-A529 VanDerWaalsContact C-N 3.33Å; A527-A529 PolarHBondContact O-N 2.81Å; A529-M533 HydrophobicContact CB-CE 3.77Å; A529-M533 VanDerWaalsContact O-CB 3.3Å; A529-M533 WeakPolarHBondContact O-CB 3.21Å; A529-M533 WeakPolarHBondContact O-CE 3.37Å; A529-M533 WeakPolarHBondContact O-CG 3.43Å; A529-M533 PolarHBondContact O-N 3.03Å; A529-M533 VanDerWaalsContact O-N 3.1Å
530	I	89.1	Confident	88.6	Confident	20 Å²	20	43.1 Å²	43.1	10%	0.103	23%	0.231	C	C	.	.	H	α-helix	trans	-70	-46.3	178.5	-64	153.9	0	0	0	110.6	S526 A527 Q528 M533 V534 V556 M557 L567	S526-I530 WeakPolarHBondContact O-CD1 3.5Å; S526-I530 WeakPolarHBondContact O-CG1 3.22Å; S526-I530 PolarHBondContact O-N 3.45Å; A527-I530 PolarHBondContact O-N 3.06Å; Q528-I530 VanDerWaalsContact C-N 3.32Å; Q528-I530 PolarHBondContact O-N 3.07Å; I530-M533 PolarHBondContact O-N 3.12Å; I530-V534 HydrophobicContact CG2-CG2 4.14Å; I530-V534 VanDerWaalsContact O-CB 3.3Å; I530-V534 WeakPolarHBondContact O-CB 3.4Å; I530-V534 WeakPolarHBondContact O-CG2 3.31Å; I530-V534 PolarHBondContact O-N 3.27Å; I530-V556 HydrophobicContact CD1-CG1 4.2Å; I530-V556 HydrophobicContact CG1-CG1 3.97Å; I530-M557 HydrophobicContact CD1-CE 3.29Å; I530-M557 HydrophobicContact CD1-SD 4.22Å; I530-M557 HydrophobicContact CG1-CE 4.16Å; I530-L567 HydrophobicContact CG2-CD1 3.97Å; I530-L567 HydrophobicContact CG2-CD2 3.9Å
531	E	90	Very high	88.3	Confident	143 Å²	143	52.1 Å²	52.1	67%	0.668	27%	0.273	S	S	*	.	H	α-helix	trans	-62.6	-46.2	179.3	-74.3	179.2	-179.1	0	0	111.8	A527 Q528 G535	A527-E531 WeakPolarHBondContact O-CG 3.49Å; A527-E531 PolarHBondContact O-N 2.99Å; Q528-E531 PolarHBondContact O-N 3.12Å; E531-G535 PolarHBondContact O-N 3.32Å
532	D	90.7	Very high	88.3	Confident	43 Å²	43	55.4 Å²	55.4	23%	0.23	29%	0.288	C	S	.	.	H	α-helix	trans	-59.3	-48.7	176.8	-75	-33.4	0	0	0	111.6	Y495 K499 Q528 Y536	Y495-D532 WeakPolarHBondContact OH-CB 3.42Å; Y495-D532 PolarHBondContact OH-OD2 3.3Å; K499-D532 WeakPolarHBondContact CE-OD2 3.46Å; K499-D532 IonicContact NZ-OD1 3.83Å; K499-D532 PolarHBondContact NZ-OD1 3.49Å; K499-D532 IonicContact NZ-OD2 3.29Å; K499-D532 PolarHBondContact NZ-OD2 3.03Å; Q528-D532 VanDerWaalsContact O-CB 3.32Å; Q528-D532 WeakPolarHBondContact O-CB 3.46Å; Q528-D532 PolarHBondContact O-N 3.43Å; D532-Y536 WeakPolarHBondContact O-CB 3.33Å; D532-Y536 PolarHBondContact O-N 3.45Å
533	M	90.3	Very high	88.2	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-69.7	-42.8	-176.7	-74.3	-172.3	-115.3	0	0	112.3	Y495 L517 A529 I530 A537 L549 I553 V556	Y495-M533 HydrophobicContact CE2-CE 4.38Å; L517-M533 HydrophobicContact CB-CE 4.2Å; L517-M533 HydrophobicContact CB-SD 4.21Å; A529-M533 HydrophobicContact CB-CE 3.77Å; A529-M533 VanDerWaalsContact O-CB 3.3Å; A529-M533 WeakPolarHBondContact O-CB 3.21Å; A529-M533 WeakPolarHBondContact O-CE 3.37Å; A529-M533 WeakPolarHBondContact O-CG 3.43Å; A529-M533 PolarHBondContact O-N 3.03Å; A529-M533 VanDerWaalsContact O-N 3.1Å; I530-M533 PolarHBondContact O-N 3.12Å; M533-A537 WeakPolarHBondContact O-CB 3.43Å; M533-A537 PolarHBondContact O-N 3.09Å; M533-L549 HydrophobicContact CB-CD2 4.11Å; M533-L549 HydrophobicContact CG-CD2 3.87Å; M533-L549 HydrophobicContact SD-CD2 4.39Å; M533-I553 HydrophobicContact CB-CD1 4.21Å; M533-I553 HydrophobicContact CB-CG1 3.79Å; M533-I553 HydrophobicContact SD-CG1 4.32Å; M533-V556 HydrophobicContact CE-CG2 3.8Å
534	V	90.3	Very high	88.5	Confident	20 Å²	20	62.4 Å²	62.4	12%	0.121	32%	0.317	C	S	.	.	H	α-helix	trans	-68.5	-43.7	178.9	173.4	0	0	0	0	110.5	I530 A537 Q538 I553 L567	I530-V534 HydrophobicContact CG2-CG2 4.14Å; I530-V534 VanDerWaalsContact O-CB 3.3Å; I530-V534 WeakPolarHBondContact O-CB 3.4Å; I530-V534 WeakPolarHBondContact O-CG2 3.31Å; I530-V534 PolarHBondContact O-N 3.27Å; V534-A537 PolarHBondContact O-N 2.85Å; V534-Q538 WeakPolarHBondContact O-CG 3.24Å; V534-Q538 PolarHBondContact O-N 3.32Å; V534-Q538 VanDerWaalsContact O-N 3.15Å; V534-I553 HydrophobicContact CG2-CD1 3.77Å; V534-I553 HydrophobicContact CG2-CG1 4.3Å; V534-L567 HydrophobicContact CG2-CD1 4.07Å
535	G	90	Very high	89.1	Confident	29 Å²	29	61 Å²	61	30%	0.299	31%	0.307	S	S	.	.	H	α-helix	trans	-58.6	-49.9	176.8	0	0	0	0	0	111.5	E531 A537 Q538 E539	E531-G535 PolarHBondContact O-N 3.32Å; G535-A537 PolarHBondContact O-N 2.82Å; G535-Q538 PolarHBondContact O-N 3.08Å; G535-E539 WeakPolarHBondContact O-CG 3.46Å; G535-E539 PolarHBondContact O-N 3.27Å
536	Y	92.1	Very high	89.4	Confident	24 Å²	24	57.5 Å²	57.5	9%	0.094	29%	0.293	C	S	.	.	H	α-helix	trans	-69.1	-32.7	179.8	-165.8	-108	0	0	0	113.2	L502 Y503 D505 D532 Q538 E539 T540 I545 L549	L502-Y536 HydrophobicContact CD1-CD1 4.04Å; L502-Y536 HydrophobicContact CD1-CE1 3.84Å; L502-Y536 HydrophobicContact CD2-CD1 3.62Å; L502-Y536 HydrophobicContact CD2-CE1 4.1Å; L502-Y536 HydrophobicContact CD2-CG 4.29Å; L502-Y536 HydrophobicContact CG-CD1 3.59Å; L502-Y536 HydrophobicContact CG-CE1 3.51Å; L502-Y536 PolarHBondContact O-OH 3.1Å; Y503-Y536 AromaticContact CD1-CD2 3.77Å; Y503-Y536 HydrophobicContact CD1-CD2 3.77Å; Y503-Y536 AromaticContact CD1-CE2 3.67Å; Y503-Y536 HydrophobicContact CD1-CE2 3.67Å; Y503-Y536 HydrophobicContact CD1-CG 4.32Å; Y503-Y536 AromaticContact CE1-CD2 3.67Å; Y503-Y536 HydrophobicContact CE1-CD2 3.67Å; Y503-Y536 HydrophobicContact CE1-CE2 4.08Å; Y503-Y536 HydrophobicContact CE1-CG 4.06Å; D505-Y536 PolarHBondContact OD1-OH 3.04Å; D532-Y536 WeakPolarHBondContact O-CB 3.33Å; D532-Y536 PolarHBondContact O-N 3.45Å; Y536-Q538 VanDerWaalsContact C-N 3.27Å; Y536-Q538 PolarHBondContact O-N 3.05Å; Y536-E539 PolarHBondContact O-N 3.43Å; Y536-T540 WeakPolarHBondContact O-CG2 3.41Å; Y536-T540 PolarHBondContact O-N 2.96Å; Y536-I545 HydrophobicContact CD1-CG2 4.46Å; Y536-I545 HydrophobicContact CE1-CG2 4.01Å; Y536-L549 HydrophobicContact CD1-CD1 3.88Å
537	A	89.6	Confident	89.5	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.008	29%	0.288	C	S	.	.	H	α-helix	trans	-63.8	-31.3	175.2	0	0	0	0	0	112.9	M533 V534 G535 L546 L549 L579	M533-A537 WeakPolarHBondContact O-CB 3.43Å; M533-A537 PolarHBondContact O-N 3.09Å; V534-A537 PolarHBondContact O-N 2.85Å; G535-A537 PolarHBondContact O-N 2.82Å; A537-L546 HydrophobicContact CB-CD1 3.65Å; A537-L546 VanDerWaalsContact O-CD1 3.28Å; A537-L546 WeakPolarHBondContact O-CD1 3.34Å; A537-L549 HydrophobicContact CB-CB 4.29Å; A537-L549 HydrophobicContact CB-CD1 3.95Å; A537-L579 HydrophobicContact CB-CD2 4Å
538	Q	88.2	Confident	89.7	Confident	101 Å²	101	54.4 Å²	54.4	47%	0.472	27%	0.265	S	S	.	.	H	α-helix	trans	-78.4	-23.1	175.6	-70.1	179	-12.7	0	0	113	V534 G535 Y536 D574 L579	V534-Q538 WeakPolarHBondContact O-CG 3.24Å; V534-Q538 PolarHBondContact O-N 3.32Å; V534-Q538 VanDerWaalsContact O-N 3.15Å; G535-Q538 PolarHBondContact O-N 3.08Å; Y536-Q538 VanDerWaalsContact C-N 3.27Å; Y536-Q538 PolarHBondContact O-N 3.05Å; Q538-D574 PolarHBondContact NE2-OD2 3.08Å; Q538-L579 HydrophobicContact CG-CD1 3.96Å
539	E	89.1	Confident	89.9	Confident	149 Å²	149	48.4 Å²	48.4	70%	0.696	24%	0.236	S	C	*	.	H	α-helix	trans	-87.8	-37.9	-178.8	-69.8	178.5	176.5	0	0	113.3	G535 Y536	G535-E539 WeakPolarHBondContact O-CG 3.46Å; G535-E539 PolarHBondContact O-N 3.27Å; Y536-E539 PolarHBondContact O-N 3.43Å
540	T	88.7	Confident	90.1	Very high	17 Å²	17	48.4 Å²	48.4	10%	0.104	24%	0.236	C	C	.	.			trans	-71.1	140.5	-174	-171.5	0	0	0	0	112.6	D505 Y536 H542 I545 L546	D505-T540 PolarHBondContact OD1-OG1 3.42Å; Y536-T540 WeakPolarHBondContact O-CG2 3.41Å; Y536-T540 PolarHBondContact O-N 2.96Å; T540-H542 PolarHBondContact OG1-N 3.09Å; T540-I545 HydrophobicContact CG2-CB 4.32Å; T540-I545 HydrophobicContact CG2-CG2 4.18Å; T540-L546 HydrophobicContact CG2-CB 4.4Å
541	Q	86	Confident	90.2	Very high	190 Å²	190	47.5 Å²	47.5	89%	0.888	23%	0.232	S	C	*	.			trans	-94	-9.2	172.8	-62.1	-170.3	-0.2	0	0	112.6	E543	Q541-E543 PolarHBondContact O-N 3.09Å
542	H	90	Very high	90.3	Very high	76 Å²	76	40.7 Å²	40.7	35%	0.352	20%	0.2	S	C	.	.			trans	-82.2	111.6	-176.5	-72.5	-58.1	0	0	0	111.2	D505 T540 K544 I545 L546	D505-H542 IonicContact OD1-CD2 3.55Å; D505-H542 PolarHBondContact OD1-CD2 3.1Å; T540-H542 PolarHBondContact OG1-N 3.09Å; H542-K544 VanDerWaalsContact C-N 3.26Å; H542-K544 PolarHBondContact O-N 3.28Å; H542-I545 HydrophobicContact CB-CB 4.17Å; H542-I545 HydrophobicContact CB-CD1 3.77Å; H542-I545 HydrophobicContact CB-CG1 3.71Å; H542-I545 PolarHBondContact O-N 3.42Å; H542-I545 VanDerWaalsContact O-N 3.11Å; H542-L546 PolarHBondContact O-N 3.33Å
543	E	88.7	Confident	90.3	Very high	100 Å²	100	38.7 Å²	38.7	47%	0.467	19%	0.189	S	C	.	.	H	α-helix	trans	-54	-41.8	-179.6	-160.5	-161	137.7	0	0	112.4	Q541 I545 L546 R547 I578	Q541-E543 PolarHBondContact O-N 3.09Å; E543-I545 PolarHBondContact O-N 3.39Å; E543-L546 PolarHBondContact O-N 3.05Å; E543-R547 VanDerWaalsContact O-CG 3.26Å; E543-R547 WeakPolarHBondContact O-CG 3.15Å; E543-R547 PolarHBondContact O-N 3.39Å; E543-R547 IonicContact OE1-CZ 3.85Å; E543-R547 IonicContact OE1-NH1 3.92Å; E543-R547 PolarHBondContact OE1-NH1 3.16Å; E543-R547 IonicContact OE2-NH1 3.19Å; E543-I578 HydrophobicContact CG-CD1 3.42Å; E543-I578 VanDerWaalsContact CG-CD1 3.42Å
544	K	90.3	Very high	90.4	Very high	62 Å²	62	38.7 Å²	38.7	27%	0.27	19%	0.189	S	C	.	.	H	α-helix	trans	-60.3	-43.2	179.8	-64.9	-167.9	177.2	-175.6	0	112.9	A507 E511 H542 R547 G548	A507-K544 HydrophobicContact CB-CD 4.39Å; A507-K544 WeakPolarHBondContact O-CB 3.43Å; A507-K544 WeakPolarHBondContact O-CD 2.94Å; E511-K544 HydrophobicContact CB-CB 4.11Å; E511-K544 WeakPolarHBondContact CB-O 3.4Å; E511-K544 WeakPolarHBondContact CG-O 3.44Å; H542-K544 VanDerWaalsContact C-N 3.26Å; H542-K544 PolarHBondContact O-N 3.28Å; K544-R547 PolarHBondContact O-N 3.04Å; K544-G548 PolarHBondContact O-N 3.12Å
545	I	92.4	Very high	90.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.4	-47.3	177.8	-55.5	-172.4	0	0	0	109.1	L502 Y536 T540 H542 E543 R547 G548 L549	L502-I545 HydrophobicContact CD1-CG2 3.61Å; Y536-I545 HydrophobicContact CD1-CG2 4.46Å; Y536-I545 HydrophobicContact CE1-CG2 4.01Å; T540-I545 HydrophobicContact CG2-CB 4.32Å; T540-I545 HydrophobicContact CG2-CG2 4.18Å; H542-I545 HydrophobicContact CB-CB 4.17Å; H542-I545 HydrophobicContact CB-CD1 3.77Å; H542-I545 HydrophobicContact CB-CG1 3.71Å; H542-I545 PolarHBondContact O-N 3.42Å; H542-I545 VanDerWaalsContact O-N 3.11Å; E543-I545 PolarHBondContact O-N 3.39Å; I545-R547 VanDerWaalsContact C-N 3.28Å; I545-R547 PolarHBondContact O-N 3.47Å; I545-G548 PolarHBondContact O-N 2.8Å; I545-G548 VanDerWaalsContact O-N 3.12Å; I545-L549 HydrophobicContact CG2-CD1 3.84Å; I545-L549 HydrophobicContact CG2-CG 4.38Å; I545-L549 WeakPolarHBondContact O-CG 3.47Å; I545-L549 PolarHBondContact O-N 3.16Å
546	L	91.4	Very high	90.5	Very high	16 Å²	16	36.3 Å²	36.3	8%	0.084	17%	0.169	C	C	.	.	H	α-helix	trans	-58.8	-38.9	177.4	-173.8	54.6	0	0	0	112.2	A537 T540 H542 E543 A550 I578 L579	A537-L546 HydrophobicContact CB-CD1 3.65Å; A537-L546 VanDerWaalsContact O-CD1 3.28Å; A537-L546 WeakPolarHBondContact O-CD1 3.34Å; T540-L546 HydrophobicContact CG2-CB 4.4Å; H542-L546 PolarHBondContact O-N 3.33Å; E543-L546 PolarHBondContact O-N 3.05Å; L546-A550 WeakPolarHBondContact O-CB 3.25Å; L546-A550 PolarHBondContact O-N 3.4Å; L546-I578 HydrophobicContact CB-CG2 4.47Å; L546-I578 HydrophobicContact CD2-CB 3.86Å; L546-I578 HydrophobicContact CD2-CD1 3.84Å; L546-I578 HydrophobicContact CD2-CG1 4.39Å; L546-I578 HydrophobicContact CD2-CG2 4.24Å; L546-I578 HydrophobicContact CG-CB 3.9Å; L546-I578 HydrophobicContact CG-CD1 4.22Å; L546-I578 HydrophobicContact CG-CG2 3.71Å; L546-L579 HydrophobicContact CD1-CD2 3.8Å; L546-L579 HydrophobicContact CD1-CG 4.19Å
547	R	89.8	Confident	90.3	Very high	23 Å²	23	35.6 Å²	35.6	9%	0.087	17%	0.167	C	C	.	.	H	α-helix	trans	-66.5	-45.6	173.8	-67.6	-167.4	-53.8	-125.3	6.5	112.1	E511 E543 K544 I545 L549 A550 V551 I578 R581	E511-R547 IonicContact OE1-CZ 3.57Å; E511-R547 IonicContact OE1-NE 3.48Å; E511-R547 IonicContact OE1-NH2 3.47Å; E511-R547 PolarHBondContact OE1-NH2 2.97Å; E511-R547 VanDerWaalsContact OE1-NH2 3.14Å; E543-R547 VanDerWaalsContact O-CG 3.26Å; E543-R547 WeakPolarHBondContact O-CG 3.15Å; E543-R547 PolarHBondContact O-N 3.39Å; E543-R547 IonicContact OE1-CZ 3.85Å; E543-R547 IonicContact OE1-NH1 3.92Å; E543-R547 PolarHBondContact OE1-NH1 3.16Å; E543-R547 IonicContact OE2-NH1 3.19Å; K544-R547 PolarHBondContact O-N 3.04Å; I545-R547 VanDerWaalsContact C-N 3.28Å; I545-R547 PolarHBondContact O-N 3.47Å; R547-L549 VanDerWaalsContact C-N 3.33Å; R547-L549 PolarHBondContact O-N 3.46Å; R547-A550 WeakPolarHBondContact O-CB 3.32Å; R547-A550 PolarHBondContact O-N 3.01Å; R547-V551 WeakPolarHBondContact O-CG2 3.08Å; R547-V551 PolarHBondContact O-N 3.31Å; R547-I578 HydrophobicContact CG-CD1 4.29Å; R547-I578 HydrophobicContact CG-CG2 4.2Å; R547-R581 VanDerWaalsContact CG-NH2 3.29Å
548	G	90.3	Very high	90.2	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.01	17%	0.17	C	C	.	.	H	α-helix	trans	-59.3	-45.1	177.3	0	0	0	0	0	112.1	G514 L515 K544 I545 V551 G552	G514-G548 CarbonylContact C-O 3.57Å; L515-G548 PolarHBondContact N-O 3.35Å; K544-G548 PolarHBondContact O-N 3.12Å; I545-G548 PolarHBondContact O-N 2.8Å; I545-G548 VanDerWaalsContact O-N 3.12Å; G548-V551 PolarHBondContact O-N 3.12Å; G548-G552 PolarHBondContact O-N 3.13Å
549	L	92.7	Very high	89.9	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-66.9	-39.5	176.2	-68.7	169	0	0	0	112.9	L502 M533 Y536 A537 I545 R547 V551 G552 I553	L502-L549 HydrophobicContact CD1-CD1 4.34Å; L502-L549 HydrophobicContact CD1-CD2 4.2Å; L502-L549 HydrophobicContact CD1-CG 4.39Å; L502-L549 HydrophobicContact CD2-CD1 4.48Å; L502-L549 HydrophobicContact CD2-CD2 3.77Å; M533-L549 HydrophobicContact CB-CD2 4.11Å; M533-L549 HydrophobicContact CG-CD2 3.87Å; M533-L549 HydrophobicContact SD-CD2 4.39Å; Y536-L549 HydrophobicContact CD1-CD1 3.88Å; A537-L549 HydrophobicContact CB-CB 4.29Å; A537-L549 HydrophobicContact CB-CD1 3.95Å; I545-L549 HydrophobicContact CG2-CD1 3.84Å; I545-L549 HydrophobicContact CG2-CG 4.38Å; I545-L549 WeakPolarHBondContact O-CG 3.47Å; I545-L549 PolarHBondContact O-N 3.16Å; R547-L549 VanDerWaalsContact C-N 3.33Å; R547-L549 PolarHBondContact O-N 3.46Å; L549-V551 VanDerWaalsContact C-N 3.26Å; L549-V551 PolarHBondContact O-N 3.33Å; L549-G552 PolarHBondContact O-N 3.06Å; L549-G552 VanDerWaalsContact O-N 3.09Å; L549-I553 WeakPolarHBondContact O-CD1 3.37Å; L549-I553 VanDerWaalsContact O-CG1 3.25Å; L549-I553 WeakPolarHBondContact O-CG1 3.46Å; L549-I553 PolarHBondContact O-N 2.86Å
550	A	92	Very high	89.5	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.008	14%	0.137	C	C	.	.	H	α-helix	trans	-55.7	-43.6	177	0	0	0	0	0	111.7	L546 R547 A554 I578 S582	L546-A550 WeakPolarHBondContact O-CB 3.25Å; L546-A550 PolarHBondContact O-N 3.4Å; R547-A550 WeakPolarHBondContact O-CB 3.32Å; R547-A550 PolarHBondContact O-N 3.01Å; A550-A554 PolarHBondContact O-N 3.49Å; A550-I578 HydrophobicContact CB-CG2 3.9Å; A550-S582 WeakPolarHBondContact CA-OG 3.43Å; A550-S582 PolarHBondContact O-OG 3.47Å
551	V	92.3	Very high	89.3	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.006	14%	0.138	C	C	.	.	H	α-helix	trans	-73.5	-39.6	176.3	-174.1	0	0	0	0	111	L515 R547 G548 L549 I553 A554 L555 L765 V766	L515-V551 HydrophobicContact CD2-CB 3.58Å; L515-V551 HydrophobicContact CD2-CG1 3.59Å; L515-V551 HydrophobicContact CD2-CG2 4.18Å; R547-V551 WeakPolarHBondContact O-CG2 3.08Å; R547-V551 PolarHBondContact O-N 3.31Å; G548-V551 PolarHBondContact O-N 3.12Å; L549-V551 VanDerWaalsContact C-N 3.26Å; L549-V551 PolarHBondContact O-N 3.33Å; V551-I553 VanDerWaalsContact C-N 3.34Å; V551-I553 PolarHBondContact O-N 3.49Å; V551-A554 WeakPolarHBondContact O-CB 3.17Å; V551-A554 PolarHBondContact O-N 2.88Å; V551-A554 VanDerWaalsContact O-N 3.16Å; V551-L555 HydrophobicContact CG1-CD1 4.07Å; V551-L555 HydrophobicContact CG1-CG 4.29Å; V551-L555 WeakPolarHBondContact O-CG 3.49Å; V551-L555 PolarHBondContact O-N 3.21Å; V551-L765 HydrophobicContact CG1-CD2 4.39Å; V551-V766 HydrophobicContact CG1-CG2 4.41Å
552	G	91.6	Very high	89.1	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-56	-47.7	177.8	0	0	0	0	0	112.4	G518 G548 L549 A554 L555 V556	G518-G552 WeakPolarHBondContact CA-O 3.48Å; G548-G552 PolarHBondContact O-N 3.13Å; L549-G552 PolarHBondContact O-N 3.06Å; L549-G552 VanDerWaalsContact O-N 3.09Å; G552-A554 VanDerWaalsContact C-N 3.34Å; G552-A554 PolarHBondContact O-N 3.39Å; G552-L555 PolarHBondContact O-N 3.18Å; G552-V556 WeakPolarHBondContact O-CG2 3.37Å; G552-V556 PolarHBondContact O-N 2.95Å; G552-V556 VanDerWaalsContact O-N 3.15Å
553	I	91.6	Very high	88.7	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-60.8	-42.2	176.8	-65.2	159.9	0	0	0	111.2	M533 V534 L549 V551 L555 V556 L567 L571	M533-I553 HydrophobicContact CB-CD1 4.21Å; M533-I553 HydrophobicContact CB-CG1 3.79Å; M533-I553 HydrophobicContact SD-CG1 4.32Å; V534-I553 HydrophobicContact CG2-CD1 3.77Å; V534-I553 HydrophobicContact CG2-CG1 4.3Å; L549-I553 WeakPolarHBondContact O-CD1 3.37Å; L549-I553 VanDerWaalsContact O-CG1 3.25Å; L549-I553 WeakPolarHBondContact O-CG1 3.46Å; L549-I553 PolarHBondContact O-N 2.86Å; V551-I553 VanDerWaalsContact C-N 3.34Å; V551-I553 PolarHBondContact O-N 3.49Å; I553-L555 VanDerWaalsContact C-N 3.34Å; I553-L555 PolarHBondContact O-N 3.47Å; I553-V556 PolarHBondContact O-N 2.89Å; I553-L567 HydrophobicContact CG2-CD2 3.79Å; I553-L571 HydrophobicContact CG2-CD1 4.2Å
554	A	91.9	Very high	88.7	Confident	0 Å²	0	21 Å²	21	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-62.9	-39.3	177.2	0	0	0	0	0	112.7	A550 V551 G552 M557 M589	A550-A554 PolarHBondContact O-N 3.49Å; V551-A554 WeakPolarHBondContact O-CB 3.17Å; V551-A554 PolarHBondContact O-N 2.88Å; V551-A554 VanDerWaalsContact O-N 3.16Å; G552-A554 VanDerWaalsContact C-N 3.34Å; G552-A554 PolarHBondContact O-N 3.39Å; A554-M557 PolarHBondContact O-N 3.26Å; A554-M589 HydrophobicContact CB-CG 4.5Å; A554-M589 WeakPolarHBondContact O-CB 3.46Å
555	L	91	Very high	88.5	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-66.8	-41.2	178.8	-69.4	172.9	0	0	0	112.1	L519 L522 G523 V551 G552 I553 M557 Y558 V762 L765	L519-L555 HydrophobicContact CD2-CD1 3.92Å; L519-L555 HydrophobicContact CG-CD1 4.24Å; L522-L555 HydrophobicContact CD1-CB 3.77Å; L522-L555 HydrophobicContact CD1-CD2 3.87Å; L522-L555 HydrophobicContact CD1-CG 4.38Å; L522-L555 WeakPolarHBondContact CD1-O 2.94Å; G523-L555 PolarHBondContact N-O 3.34Å; V551-L555 HydrophobicContact CG1-CD1 4.07Å; V551-L555 HydrophobicContact CG1-CG 4.29Å; V551-L555 WeakPolarHBondContact O-CG 3.49Å; V551-L555 PolarHBondContact O-N 3.21Å; G552-L555 PolarHBondContact O-N 3.18Å; I553-L555 VanDerWaalsContact C-N 3.34Å; I553-L555 PolarHBondContact O-N 3.47Å; L555-M557 PolarHBondContact O-N 3.13Å; L555-M557 VanDerWaalsContact O-N 3.08Å; L555-Y558 WeakPolarHBondContact O-CB 3.3Å; L555-Y558 PolarHBondContact O-N 3.01Å; L555-Y558 VanDerWaalsContact O-N 3.12Å; L555-V762 HydrophobicContact CD2-CB 4.26Å; L555-V762 HydrophobicContact CD2-CG1 3.85Å; L555-V762 HydrophobicContact CD2-CG2 3.73Å; L555-L765 HydrophobicContact CD2-CD2 3.95Å
556	V	90.8	Very high	88.4	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-57.4	-30.1	179.9	176.3	0	0	0	0	112.6	M521 G523 I530 M533 G552 I553 Y558	M521-V556 HydrophobicContact CB-CG2 3.88Å; G523-V556 CarbonylContact C-O 3.53Å; G523-V556 WeakPolarHBondContact CA-O 3.39Å; G523-V556 PolarHBondContact N-O 3.2Å; I530-V556 HydrophobicContact CD1-CG1 4.2Å; I530-V556 HydrophobicContact CG1-CG1 3.97Å; M533-V556 HydrophobicContact CE-CG2 3.8Å; G552-V556 WeakPolarHBondContact O-CG2 3.37Å; G552-V556 PolarHBondContact O-N 2.95Å; G552-V556 VanDerWaalsContact O-N 3.15Å; I553-V556 PolarHBondContact O-N 2.89Å; V556-Y558 PolarHBondContact O-N 3.44Å
557	M	87.6	Confident	88.3	Confident	8 Å²	8	22.8 Å²	22.8	4%	0.039	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	12	-177.4	-70.1	-60.8	-166.5	0	0	115.3	K525 I530 A554 L555 G559 R560 A564 L567 T586 A590	K525-M557 HydrophobicContact CG-SD 4.16Å; I530-M557 HydrophobicContact CD1-CE 3.29Å; I530-M557 HydrophobicContact CD1-SD 4.22Å; I530-M557 HydrophobicContact CG1-CE 4.16Å; A554-M557 PolarHBondContact O-N 3.26Å; L555-M557 PolarHBondContact O-N 3.13Å; L555-M557 VanDerWaalsContact O-N 3.08Å; M557-G559 PolarHBondContact O-N 3.36Å; M557-R560 PolarHBondContact O-N 3.09Å; M557-A564 HydrophobicContact CB-CB 4.29Å; M557-A564 HydrophobicContact CG-CB 4.3Å; M557-A564 HydrophobicContact SD-CB 4.27Å; M557-L567 HydrophobicContact CE-CB 4.24Å; M557-L567 HydrophobicContact CE-CD2 3.48Å; M557-L567 VanDerWaalsContact CE-CD2 3.48Å; M557-L567 HydrophobicContact CG-CD2 4.11Å; M557-T586 HydrophobicContact CB-CG2 3.86Å; M557-T586 HydrophobicContact CG-CG2 3.92Å; M557-A590 WeakPolarHBondContact O-CA 3.37Å
558	Y	87.7	Confident	88.3	Confident	19 Å²	19	21.7 Å²	21.7	8%	0.075	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	123.2	-178.8	-174.8	-96.8	0	0	0	113.1	L555 V556 R560 M589 C592 T756 M758 V761	L555-Y558 WeakPolarHBondContact O-CB 3.3Å; L555-Y558 PolarHBondContact O-N 3.01Å; L555-Y558 VanDerWaalsContact O-N 3.12Å; V556-Y558 PolarHBondContact O-N 3.44Å; Y558-R560 VanDerWaalsContact C-N 3.3Å; Y558-R560 PolarHBondContact O-N 2.94Å; Y558-M589 HydrophobicContact CD2-SD 4.23Å; Y558-C592 HydrophobicContact CE2-CB 4.32Å; Y558-T756 VanDerWaalsContact OH-CB 3.32Å; Y558-T756 WeakPolarHBondContact OH-CB 3.26Å; Y558-T756 PolarHBondContact OH-OG1 3.49Å; Y558-M758 HydrophobicContact CD1-CG 4.25Å; Y558-M758 HydrophobicContact CD1-SD 4.37Å; Y558-M758 HydrophobicContact CE1-CB 4.1Å; Y558-M758 HydrophobicContact CE1-CG 3.97Å; Y558-M758 HydrophobicContact CE1-SD 4.44Å; Y558-V761 HydrophobicContact CE2-CB 4.04Å; Y558-V761 HydrophobicContact CE2-CG1 3.86Å; Y558-V761 HydrophobicContact CE2-CG2 4.3Å
559	G	81.5	Confident	88.3	Confident	28 Å²	28	27.2 Å²	27.2	29%	0.289	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	15.8	173.7	0	0	0	0	0	116.3	M557 M589	M557-G559 PolarHBondContact O-N 3.36Å; G559-M589 PolarHBondContact N-O 3.35Å; G559-M589 VanDerWaalsContact N-O 3.08Å
560	R	82.1	Confident	88.2	Confident	50 Å²	50	30.3 Å²	30.3	19%	0.189	17%	0.169	C	C	.	.			trans	-93.4	-2.4	-178	-59	-61.2	176.5	-141.8	16.1	115	G523 K525 M557 Y558 E562 E563	G523-R560 PolarHBondContact O-NE 3.16Å; G523-R560 PolarHBondContact O-NH2 2.74Å; K525-R560 HydrophobicContact CB-CG 4.37Å; M557-R560 PolarHBondContact O-N 3.09Å; Y558-R560 VanDerWaalsContact C-N 3.3Å; Y558-R560 PolarHBondContact O-N 2.94Å; R560-E562 PolarHBondContact O-N 3Å; R560-E563 HydrophobicContact CB-CB 4.3Å; R560-E563 WeakPolarHBondContact O-CB 3.32Å; R560-E563 PolarHBondContact O-N 3.18Å; R560-E563 VanDerWaalsContact O-N 3.16Å
561	M	84.5	Confident	88.2	Confident	27 Å²	27	30.2 Å²	30.2	13%	0.133	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	46.3	-122.8	173.7	-58.9	-178.5	178.8	0	0	112.9	K192 E563 A564 A590 Y591	K192-M561 HydrophobicContact CB-SD 3.99Å; M561-E563 PolarHBondContact O-N 2.79Å; M561-A564 PolarHBondContact O-N 3.05Å; M561-A564 VanDerWaalsContact O-N 3.11Å; M561-A590 WeakPolarHBondContact CA-O 3.29Å; M561-A590 PolarHBondContact N-O 2.94Å; M561-Y591 HydrophobicContact CB-CD1 4.42Å; M561-Y591 HydrophobicContact CB-CE1 4.08Å; M561-Y591 HydrophobicContact CG-CD1 4.5Å
562	E	82.1	Confident	88.1	Confident	114 Å²	114	31.9 Å²	31.9	53%	0.533	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-60.5	-24.9	-175	-62	178.9	174.3	0	0	113.5	R560 A564 D565	R560-E562 PolarHBondContact O-N 3Å; E562-A564 PolarHBondContact O-N 3.06Å; E562-A564 VanDerWaalsContact O-N 3.15Å; E562-D565 WeakPolarHBondContact O-CB 3.43Å; E562-D565 PolarHBondContact O-N 3.18Å
563	E	81.7	Confident	88	Confident	89 Å²	89	42.7 Å²	42.7	42%	0.416	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-65.1	-20	178.4	-59.2	174.8	-152.2	0	0	112.6	K525 R560 M561	K525-E563 VanDerWaalsContact CD-OE2 3.3Å; K525-E563 WeakPolarHBondContact CD-OE2 3.45Å; K525-E563 WeakPolarHBondContact CE-OE2 3.24Å; K525-E563 IonicContact NZ-OE2 3.34Å; K525-E563 PolarHBondContact NZ-OE2 3.13Å; R560-E563 HydrophobicContact CB-CB 4.3Å; R560-E563 WeakPolarHBondContact O-CB 3.32Å; R560-E563 PolarHBondContact O-N 3.18Å; R560-E563 VanDerWaalsContact O-N 3.16Å; M561-E563 PolarHBondContact O-N 2.79Å
564	A	86.8	Confident	87.9	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-86.4	-12.4	176.1	0	0	0	0	0	113.1	M557 M561 E562 A566 L567 I568 T586 A590	M557-A564 HydrophobicContact CB-CB 4.29Å; M557-A564 HydrophobicContact CG-CB 4.3Å; M557-A564 HydrophobicContact SD-CB 4.27Å; M561-A564 PolarHBondContact O-N 3.05Å; M561-A564 VanDerWaalsContact O-N 3.11Å; E562-A564 PolarHBondContact O-N 3.06Å; E562-A564 VanDerWaalsContact O-N 3.15Å; A564-A566 VanDerWaalsContact C-N 3.31Å; A564-A566 PolarHBondContact O-N 3.48Å; A564-L567 PolarHBondContact O-N 3.19Å; A564-L567 VanDerWaalsContact O-N 3.16Å; A564-I568 HydrophobicContact CB-CD1 3.83Å; A564-I568 HydrophobicContact CB-CG1 4.47Å; A564-I568 WeakPolarHBondContact O-CD1 3.15Å; A564-I568 VanDerWaalsContact O-CG1 3.25Å; A564-I568 WeakPolarHBondContact O-CG1 3.39Å; A564-I568 PolarHBondContact O-N 3.05Å; A564-T586 HydrophobicContact CB-CG2 4.4Å; A564-A590 HydrophobicContact CB-CB 3.66Å
565	D	87.2	Confident	87.8	Confident	14 Å²	14	53.8 Å²	53.8	8%	0.075	27%	0.27	C	S	.	.	H	α-helix	trans	-59.6	-39.3	-171.6	-91.4	-21.3	0	0	0	112.5	E562 L567 I568 E569 Y591 K598 R602	E562-D565 WeakPolarHBondContact O-CB 3.43Å; E562-D565 PolarHBondContact O-N 3.18Å; D565-L567 PolarHBondContact O-N 3.16Å; D565-I568 PolarHBondContact O-N 3.29Å; D565-E569 WeakPolarHBondContact O-CG 3.13Å; D565-E569 PolarHBondContact O-N 3.46Å; D565-Y591 PolarHBondContact OD1-OH 3.14Å; D565-Y591 PolarHBondContact OD2-OH 3.25Å; D565-K598 IonicContact OD2-NZ 2.65Å; D565-K598 PolarHBondContact OD2-NZ 2.93Å; D565-R602 IonicContact OD1-CZ 3.1Å; D565-R602 IonicContact OD1-NH1 3.99Å; D565-R602 PolarHBondContact OD1-NH1 3.37Å; D565-R602 IonicContact OD1-NH2 3.12Å
566	A	89.8	Confident	87.7	Confident	78 Å²	78	57.4 Å²	57.4	65%	0.645	29%	0.289	S	S	*	.	H	α-helix	trans	-62.7	-43.1	178.6	0	0	0	0	0	112.4	A564 S570	A564-A566 VanDerWaalsContact C-N 3.31Å; A564-A566 PolarHBondContact O-N 3.48Å; A566-S570 PolarHBondContact O-N 3.29Å
567	L	88.6	Confident	87.8	Confident	25 Å²	25	59.5 Å²	59.5	13%	0.131	30%	0.303	C	S	.	.	H	α-helix	trans	-67.6	-42.3	176.4	179.2	64.9	0	0	0	110.9	I530 V534 I553 M557 A564 D565 E569 S570 L571 T586	I530-L567 HydrophobicContact CG2-CD1 3.97Å; I530-L567 HydrophobicContact CG2-CD2 3.9Å; V534-L567 HydrophobicContact CG2-CD1 4.07Å; I553-L567 HydrophobicContact CG2-CD2 3.79Å; M557-L567 HydrophobicContact CE-CB 4.24Å; M557-L567 HydrophobicContact CE-CD2 3.48Å; M557-L567 VanDerWaalsContact CE-CD2 3.48Å; M557-L567 HydrophobicContact CG-CD2 4.11Å; A564-L567 PolarHBondContact O-N 3.19Å; A564-L567 VanDerWaalsContact O-N 3.16Å; D565-L567 PolarHBondContact O-N 3.16Å; L567-E569 VanDerWaalsContact C-N 3.33Å; L567-E569 PolarHBondContact O-N 3Å; L567-S570 WeakPolarHBondContact O-CB 3.35Å; L567-S570 PolarHBondContact O-N 2.95Å; L567-L571 HydrophobicContact CD1-CD1 4.17Å; L567-L571 HydrophobicContact CD1-CG 4.17Å; L567-L571 HydrophobicContact CD2-CD1 4.37Å; L567-L571 HydrophobicContact CG-CD1 3.86Å; L567-L571 HydrophobicContact CG-CG 4.29Å; L567-L571 WeakPolarHBondContact O-CG 3.48Å; L567-L571 PolarHBondContact O-N 3.49Å; L567-T586 HydrophobicContact CD2-CG2 4.47Å
568	I	90.3	Very high	87.9	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-59.5	-44.8	178.6	-69.8	159.8	0	0	0	110.5	A564 D565 S570 L571 C572 T586 V587	A564-I568 HydrophobicContact CB-CD1 3.83Å; A564-I568 HydrophobicContact CB-CG1 4.47Å; A564-I568 WeakPolarHBondContact O-CD1 3.15Å; A564-I568 VanDerWaalsContact O-CG1 3.25Å; A564-I568 WeakPolarHBondContact O-CG1 3.39Å; A564-I568 PolarHBondContact O-N 3.05Å; D565-I568 PolarHBondContact O-N 3.29Å; I568-S570 VanDerWaalsContact C-N 3.33Å; I568-S570 PolarHBondContact O-N 2.77Å; I568-L571 PolarHBondContact O-N 3.33Å; I568-C572 VanDerWaalsContact O-CB 3.32Å; I568-C572 WeakPolarHBondContact O-CB 3.43Å; I568-C572 PolarHBondContact O-N 3.07Å; I568-C572 PolarHBondContact O-SG 3.22Å; I568-T586 HydrophobicContact CD1-CG2 4.31Å; I568-T586 HydrophobicContact CG1-CG2 3.85Å; I568-V587 HydrophobicContact CB-CG2 4.33Å; I568-V587 HydrophobicContact CD1-CB 4.36Å; I568-V587 HydrophobicContact CD1-CG2 3.61Å; I568-V587 HydrophobicContact CG1-CG2 3.9Å; I568-V587 HydrophobicContact CG2-CG2 3.46Å; I568-V587 VanDerWaalsContact CG2-CG2 3.46Å
569	E	90.4	Very high	88.1	Confident	116 Å²	116	59.4 Å²	59.4	54%	0.542	30%	0.304	S	S	.	.	H	α-helix	trans	-63.9	-38.6	179	-75.5	-177.3	-176.9	0	0	112.5	D565 L567 R573 R602	D565-E569 WeakPolarHBondContact O-CG 3.13Å; D565-E569 PolarHBondContact O-N 3.46Å; L567-E569 VanDerWaalsContact C-N 3.33Å; L567-E569 PolarHBondContact O-N 3Å; E569-R573 WeakPolarHBondContact O-CB 3.48Å; E569-R573 PolarHBondContact O-N 3.4Å; E569-R602 IonicContact OE1-NH2 2.99Å; E569-R602 PolarHBondContact OE1-NH2 3.13Å
570	S	91.6	Very high	88.7	Confident	65 Å²	65	60 Å²	60	46%	0.455	30%	0.297	S	S	.	.	H	α-helix	trans	-61.3	-54.7	172.9	-167.4	0	0	0	0	111.2	A566 L567 I568 C572 R573 D574	A566-S570 PolarHBondContact O-N 3.29Å; L567-S570 WeakPolarHBondContact O-CB 3.35Å; L567-S570 PolarHBondContact O-N 2.95Å; I568-S570 VanDerWaalsContact C-N 3.33Å; I568-S570 PolarHBondContact O-N 2.77Å; S570-C572 VanDerWaalsContact C-N 3.33Å; S570-C572 PolarHBondContact O-N 2.79Å; S570-R573 PolarHBondContact O-N 3.06Å; S570-R573 VanDerWaalsContact O-N 3.13Å; S570-D574 PolarHBondContact O-N 3.47Å
571	L	90.5	Very high	89.2	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-62.6	-35.5	-177.8	-69.1	174.3	0	0	0	113.2	I553 L567 I568 R573 L579 R580	I553-L571 HydrophobicContact CG2-CD1 4.2Å; L567-L571 HydrophobicContact CD1-CD1 4.17Å; L567-L571 HydrophobicContact CD1-CG 4.17Å; L567-L571 HydrophobicContact CD2-CD1 4.37Å; L567-L571 HydrophobicContact CG-CD1 3.86Å; L567-L571 HydrophobicContact CG-CG 4.29Å; L567-L571 WeakPolarHBondContact O-CG 3.48Å; L567-L571 PolarHBondContact O-N 3.49Å; I568-L571 PolarHBondContact O-N 3.33Å; L571-R573 VanDerWaalsContact C-N 3.32Å; L571-L579 HydrophobicContact CD2-CB 4.39Å; L571-L579 HydrophobicContact CD2-CD2 4.26Å; L571-R580 WeakPolarHBondContact O-CA 3.45Å
572	C	89.9	Confident	89.5	Confident	35 Å²	35	56.6 Å²	56.6	24%	0.236	28%	0.283	C	S	.	.	H	α-helix	trans	-72.5	-26.2	178.9	-68.1	0	0	0	0	112.9	I568 S570 R580 M584	I568-C572 VanDerWaalsContact O-CB 3.32Å; I568-C572 WeakPolarHBondContact O-CB 3.43Å; I568-C572 PolarHBondContact O-N 3.07Å; I568-C572 PolarHBondContact O-SG 3.22Å; S570-C572 VanDerWaalsContact C-N 3.33Å; S570-C572 PolarHBondContact O-N 2.79Å; C572-R580 WeakPolarHBondContact O-CD 3.22Å; C572-M584 WeakPolarHBondContact SG-CE 3.18Å
573	R	91.2	Very high	90	Very high	227 Å²	227	51.1 Å²	51.1	86%	0.857	26%	0.258	S	S	*	.	H	α-helix	trans	-84.3	-16	179.8	-173.1	175.2	-88.8	-175	-3.2	112.3	E569 S570 L571	E569-R573 WeakPolarHBondContact O-CB 3.48Å; E569-R573 PolarHBondContact O-N 3.4Å; S570-R573 PolarHBondContact O-N 3.06Å; S570-R573 VanDerWaalsContact O-N 3.13Å; L571-R573 VanDerWaalsContact C-N 3.32Å
574	D	89.6	Confident	90.6	Very high	40 Å²	40	47 Å²	47	21%	0.214	24%	0.238	C	C	.	.	S	Bend	trans	-63.1	147.7	179.4	-92.6	-34.3	0	0	0	113.4	Q538 S570 D576 L579 R580	Q538-D574 PolarHBondContact NE2-OD2 3.08Å; S570-D574 PolarHBondContact O-N 3.47Å; D574-D576 VanDerWaalsContact C-N 3.31Å; D574-D576 PolarHBondContact O-N 3.04Å; D574-L579 HydrophobicContact CB-CB 4.16Å; D574-L579 HydrophobicContact CB-CD1 4.2Å; D574-R580 WeakPolarHBondContact O-CD 3.28Å; D574-R580 WeakPolarHBondContact O-CG 3.41Å; D574-R580 PolarHBondContact O-NH1 3.24Å
575	K	88.3	Confident	90.9	Very high	194 Å²	194	47.1 Å²	47.1	84%	0.843	24%	0.239	S	C	*	.	S	Bend	trans	-70.5	-30.3	-178.9	-67	-178.9	-177.2	174.4	0	112	P577 R580	K575-P577 WeakPolarHBondContact O-CD 3.28Å; K575-R580 VanDerWaalsContact C-NH1 3.3Å; K575-R580 PolarHBondContact O-NH1 3.26Å
576	D	89.8	Confident	91.2	Very high	76 Å²	76	46.5 Å²	46.5	41%	0.406	24%	0.235	S	C	.	.			trans	-75.1	123.4	-176.7	-67.7	-46.1	0	0	0	111.8	D574 I578 L579 R580	D574-D576 VanDerWaalsContact C-N 3.31Å; D574-D576 PolarHBondContact O-N 3.04Å; D576-I578 PolarHBondContact O-N 3.21Å; D576-L579 HydrophobicContact CB-CB 4.37Å; D576-L579 HydrophobicContact CB-CD1 4.2Å; D576-L579 HydrophobicContact CB-CG 4.21Å; D576-L579 PolarHBondContact O-N 3.33Å; D576-R580 PolarHBondContact O-N 3.33Å; D576-R580 VanDerWaalsContact O-N 3.15Å
577	P	91.9	Very high	91.3	Very high	44 Å²	44	42.8 Å²	42.8	29%	0.286	21%	0.205	S	C	.	.	H	α-helix	trans	-61.7	-30.2	-178.9	-23.9	33.7	0	0	0	113.9	K575 R580 R581 N612 V615	K575-P577 WeakPolarHBondContact O-CD 3.28Å; P577-R580 PolarHBondContact O-N 2.97Å; P577-R581 WeakPolarHBondContact O-CB 3.39Å; P577-R581 PolarHBondContact O-N 3.01Å; P577-N612 HydrophobicContact CB-CB 4.09Å; P577-N612 VanDerWaalsContact CB-ND2 3.31Å; P577-N612 WeakPolarHBondContact CB-ND2 3.45Å; P577-V615 HydrophobicContact CB-CG2 4.3Å; P577-V615 VanDerWaalsContact O-CG2 3.28Å; P577-V615 WeakPolarHBondContact O-CG2 3.49Å
578	I	90.9	Very high	91.3	Very high	26 Å²	26	41.6 Å²	41.6	13%	0.133	20%	0.198	C	C	.	.	H	α-helix	trans	-72.4	-34.2	-178.9	-60.2	166	0	0	0	110.8	E543 L546 R547 A550 D576 R581 S582	E543-I578 HydrophobicContact CG-CD1 3.42Å; E543-I578 VanDerWaalsContact CG-CD1 3.42Å; L546-I578 HydrophobicContact CB-CG2 4.47Å; L546-I578 HydrophobicContact CD2-CB 3.86Å; L546-I578 HydrophobicContact CD2-CD1 3.84Å; L546-I578 HydrophobicContact CD2-CG1 4.39Å; L546-I578 HydrophobicContact CD2-CG2 4.24Å; L546-I578 HydrophobicContact CG-CB 3.9Å; L546-I578 HydrophobicContact CG-CD1 4.22Å; L546-I578 HydrophobicContact CG-CG2 3.71Å; R547-I578 HydrophobicContact CG-CD1 4.29Å; R547-I578 HydrophobicContact CG-CG2 4.2Å; A550-I578 HydrophobicContact CB-CG2 3.9Å; D576-I578 PolarHBondContact O-N 3.21Å; I578-R581 WeakPolarHBondContact O-CB 3.37Å; I578-R581 PolarHBondContact O-N 2.92Å; I578-S582 PolarHBondContact O-N 3.25Å
579	L	91.4	Very high	91.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-70	-39.4	172.4	-67.5	-179.6	0	0	0	111.5	A537 Q538 L546 L571 D574 D576 R581 S582 G583	A537-L579 HydrophobicContact CB-CD2 4Å; Q538-L579 HydrophobicContact CG-CD1 3.96Å; L546-L579 HydrophobicContact CD1-CD2 3.8Å; L546-L579 HydrophobicContact CD1-CG 4.19Å; L571-L579 HydrophobicContact CD2-CB 4.39Å; L571-L579 HydrophobicContact CD2-CD2 4.26Å; D574-L579 HydrophobicContact CB-CB 4.16Å; D574-L579 HydrophobicContact CB-CD1 4.2Å; D576-L579 HydrophobicContact CB-CB 4.37Å; D576-L579 HydrophobicContact CB-CD1 4.2Å; D576-L579 HydrophobicContact CB-CG 4.21Å; D576-L579 PolarHBondContact O-N 3.33Å; L579-R581 VanDerWaalsContact C-N 3.3Å; L579-R581 PolarHBondContact O-N 3.21Å; L579-S582 WeakPolarHBondContact O-CA 3.48Å; L579-S582 WeakPolarHBondContact O-CB 2.88Å; L579-S582 PolarHBondContact O-N 3.39Å; L579-S582 VanDerWaalsContact O-N 3.16Å; L579-G583 PolarHBondContact O-N 2.82Å
580	R	93.3	Very high	91.3	Very high	39 Å²	39	36.1 Å²	36.1	15%	0.147	17%	0.173	C	C	.	.	H	α-helix	trans	-62	-39.9	171.2	-64.3	-159.2	-57.6	-77.6	0.9	112.1	L571 C572 D574 K575 D576 P577 G583 M584 D610 V615	L571-R580 WeakPolarHBondContact O-CA 3.45Å; C572-R580 WeakPolarHBondContact O-CD 3.22Å; D574-R580 WeakPolarHBondContact O-CD 3.28Å; D574-R580 WeakPolarHBondContact O-CG 3.41Å; D574-R580 PolarHBondContact O-NH1 3.24Å; K575-R580 VanDerWaalsContact C-NH1 3.3Å; K575-R580 PolarHBondContact O-NH1 3.26Å; D576-R580 PolarHBondContact O-N 3.33Å; D576-R580 VanDerWaalsContact O-N 3.15Å; P577-R580 PolarHBondContact O-N 2.97Å; R580-G583 PolarHBondContact O-N 2.86Å; R580-M584 PolarHBondContact O-N 2.75Å; R580-M584 VanDerWaalsContact O-N 3.16Å; R580-D610 IonicContact CZ-OD2 3.18Å; R580-D610 IonicContact NE-OD1 3.69Å; R580-D610 IonicContact NE-OD2 2.79Å; R580-D610 PolarHBondContact NE-OD2 2.99Å; R580-D610 IonicContact NH2-OD1 3.76Å; R580-D610 PolarHBondContact NH2-OD1 2.93Å; R580-D610 IonicContact NH2-OD2 2.74Å; R580-D610 PolarHBondContact NH2-OD2 2.82Å; R580-V615 HydrophobicContact CB-CG1 4.27Å; R580-V615 HydrophobicContact CB-CG2 4.17Å
581	R	92.9	Very high	91.1	Very high	6 Å²	6	33.1 Å²	33.1	2%	0.023	15%	0.152	C	C	.	.	H	α-helix	trans	-62.5	-42.1	172.9	-169.8	176.1	70.1	-169	5.8	111.8	R547 P577 I578 L579 G583 M584 Y585 D614 V615 A618	R547-R581 VanDerWaalsContact CG-NH2 3.29Å; P577-R581 WeakPolarHBondContact O-CB 3.39Å; P577-R581 PolarHBondContact O-N 3.01Å; I578-R581 WeakPolarHBondContact O-CB 3.37Å; I578-R581 PolarHBondContact O-N 2.92Å; L579-R581 VanDerWaalsContact C-N 3.3Å; L579-R581 PolarHBondContact O-N 3.21Å; R581-G583 VanDerWaalsContact C-N 3.3Å; R581-G583 PolarHBondContact O-N 3.22Å; R581-M584 WeakPolarHBondContact O-CB 3.41Å; R581-M584 PolarHBondContact O-N 3.48Å; R581-M584 VanDerWaalsContact O-N 3.12Å; R581-Y585 HydrophobicContact CG-CD2 4.23Å; R581-Y585 HydrophobicContact CG-CE2 3.82Å; R581-Y585 PolarHBondContact O-N 3.24Å; R581-Y585 VanDerWaalsContact O-N 3.15Å; R581-D614 IonicContact NH1-OD2 2.64Å; R581-V615 HydrophobicContact CB-CG2 4.17Å; R581-A618 HydrophobicContact CG-CB 3.6Å
582	S	91.8	Very high	90.8	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-52.7	-50.8	171.1	-175.1	0	0	0	0	110.2	A550 I578 L579 M584 Y585 T586	A550-S582 WeakPolarHBondContact CA-OG 3.43Å; A550-S582 PolarHBondContact O-OG 3.47Å; I578-S582 PolarHBondContact O-N 3.25Å; L579-S582 WeakPolarHBondContact O-CA 3.48Å; L579-S582 WeakPolarHBondContact O-CB 2.88Å; L579-S582 PolarHBondContact O-N 3.39Å; L579-S582 VanDerWaalsContact O-N 3.16Å; S582-M584 VanDerWaalsContact C-N 3.26Å; S582-M584 PolarHBondContact O-N 3.25Å; S582-Y585 CarbonylContact O-C 3.5Å; S582-Y585 PolarHBondContact O-N 3.24Å; S582-T586 PolarHBondContact O-N 3.39Å; S582-T586 PolarHBondContact O-OG1 3.27Å
583	G	92	Very high	90.3	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-54.4	-38.2	176.9	0	0	0	0	0	113.6	L579 R580 R581 T586 V587	L579-G583 PolarHBondContact O-N 2.82Å; R580-G583 PolarHBondContact O-N 2.86Å; R581-G583 VanDerWaalsContact C-N 3.3Å; R581-G583 PolarHBondContact O-N 3.22Å; G583-T586 PolarHBondContact O-N 3.49Å; G583-V587 VanDerWaalsContact O-CG2 3.25Å; G583-V587 WeakPolarHBondContact O-CG2 3.31Å; G583-V587 PolarHBondContact O-N 2.93Å
584	M	93.8	Very high	89.7	Confident	2 Å²	2	22.4 Å²	22.4	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-68.1	-38.8	176.4	-61.5	-55.8	102.8	0	0	112.5	C572 R580 R581 S582 G588 L603 V606 V615 A618 A619 S622	C572-M584 WeakPolarHBondContact SG-CE 3.18Å; R580-M584 PolarHBondContact O-N 2.75Å; R580-M584 VanDerWaalsContact O-N 3.16Å; R581-M584 WeakPolarHBondContact O-CB 3.41Å; R581-M584 PolarHBondContact O-N 3.48Å; R581-M584 VanDerWaalsContact O-N 3.12Å; S582-M584 VanDerWaalsContact C-N 3.26Å; S582-M584 PolarHBondContact O-N 3.25Å; M584-G588 PolarHBondContact O-N 2.93Å; M584-L603 HydrophobicContact CB-CD2 4.32Å; M584-L603 HydrophobicContact SD-CD2 3.62Å; M584-V606 HydrophobicContact CE-CB 4.3Å; M584-V606 HydrophobicContact CE-CG1 4.03Å; M584-V606 HydrophobicContact CE-CG2 4Å; M584-V606 HydrophobicContact CG-CG1 4.41Å; M584-V606 HydrophobicContact SD-CB 3.83Å; M584-V606 HydrophobicContact SD-CG1 3.64Å; M584-V606 HydrophobicContact SD-CG2 4.14Å; M584-V615 HydrophobicContact CG-CG1 3.97Å; M584-A618 HydrophobicContact CB-CB 4.23Å; M584-A619 HydrophobicContact CG-CB 4.06Å; M584-A619 HydrophobicContact SD-CB 3.93Å; M584-S622 PolarHBondContact O-OG 3.11Å
585	Y	93.1	Very high	89.1	Confident	3 Å²	3	21.5 Å²	21.5	1%	0.012	11%	0.112	C	C	.	.	H	α-helix	trans	-72	-35.5	174.3	-68.9	-47.2	0	0	0	112	R581 S582 V587 G588 M589 A618 E621 L765	R581-Y585 HydrophobicContact CG-CD2 4.23Å; R581-Y585 HydrophobicContact CG-CE2 3.82Å; R581-Y585 PolarHBondContact O-N 3.24Å; R581-Y585 VanDerWaalsContact O-N 3.15Å; S582-Y585 CarbonylContact O-C 3.5Å; S582-Y585 PolarHBondContact O-N 3.24Å; Y585-V587 VanDerWaalsContact C-N 3.34Å; Y585-V587 PolarHBondContact O-N 3.2Å; Y585-G588 PolarHBondContact O-N 3.41Å; Y585-G588 VanDerWaalsContact O-N 3.16Å; Y585-M589 WeakPolarHBondContact O-CG 3.08Å; Y585-M589 PolarHBondContact O-N 3.01Å; Y585-A618 HydrophobicContact CD1-CB 4.41Å; Y585-A618 HydrophobicContact CE1-CB 3.82Å; Y585-A618 HydrophobicContact CE2-CB 4.08Å; Y585-E621 PolarHBondContact OH-OE2 3.47Å; Y585-E621 VanDerWaalsContact OH-OE2 3.11Å; Y585-L765 HydrophobicContact CD1-CD1 3.49Å; Y585-L765 VanDerWaalsContact CD1-CD1 3.49Å; Y585-L765 HydrophobicContact CE1-CD1 3.8Å; Y585-L765 HydrophobicContact CG-CD1 4.07Å
586	T	93.3	Very high	88.9	Confident	0 Å²	0	13.2 Å²	13.2	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-61.2	-43	172.7	-50.1	0	0	0	0	110.8	M557 A564 L567 I568 S582 G583 M589 A590	M557-T586 HydrophobicContact CB-CG2 3.86Å; M557-T586 HydrophobicContact CG-CG2 3.92Å; A564-T586 HydrophobicContact CB-CG2 4.4Å; L567-T586 HydrophobicContact CD2-CG2 4.47Å; I568-T586 HydrophobicContact CD1-CG2 4.31Å; I568-T586 HydrophobicContact CG1-CG2 3.85Å; S582-T586 PolarHBondContact O-N 3.39Å; S582-T586 PolarHBondContact O-OG1 3.27Å; G583-T586 PolarHBondContact O-N 3.49Å; T586-M589 PolarHBondContact O-N 2.75Å; T586-A590 WeakPolarHBondContact O-CB 3.47Å; T586-A590 PolarHBondContact O-N 3.42Å
587	V	92.8	Very high	88.7	Confident	0 Å²	0	15 Å²	15	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-59.3	-48.1	171.9	174.9	0	0	0	0	110.6	I568 G583 Y585 M589 Y591 A599 L603 I626	I568-V587 HydrophobicContact CB-CG2 4.33Å; I568-V587 HydrophobicContact CD1-CB 4.36Å; I568-V587 HydrophobicContact CD1-CG2 3.61Å; I568-V587 HydrophobicContact CG1-CG2 3.9Å; I568-V587 HydrophobicContact CG2-CG2 3.46Å; I568-V587 VanDerWaalsContact CG2-CG2 3.46Å; G583-V587 VanDerWaalsContact O-CG2 3.25Å; G583-V587 WeakPolarHBondContact O-CG2 3.31Å; G583-V587 PolarHBondContact O-N 2.93Å; Y585-V587 VanDerWaalsContact C-N 3.34Å; Y585-V587 PolarHBondContact O-N 3.2Å; V587-M589 PolarHBondContact O-N 3.01Å; V587-Y591 HydrophobicContact CG1-CD2 4.27Å; V587-Y591 WeakPolarHBondContact O-CB 3.2Å; V587-Y591 PolarHBondContact O-N 3.25Å; V587-Y591 VanDerWaalsContact O-N 3.08Å; V587-A599 HydrophobicContact CG1-CB 3.97Å; V587-L603 HydrophobicContact CB-CD2 4.1Å; V587-L603 HydrophobicContact CG1-CD1 3.99Å; V587-L603 HydrophobicContact CG1-CD2 3.92Å; V587-L603 HydrophobicContact CG1-CG 3.86Å; V587-I626 HydrophobicContact CG1-CD1 4.19Å
588	G	89.5	Confident	88.5	Confident	0 Å²	0	18 Å²	18	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-55.7	-49.3	178.7	0	0	0	0	0	112.6	M584 Y585 C592	M584-G588 PolarHBondContact O-N 2.93Å; Y585-G588 PolarHBondContact O-N 3.41Å; Y585-G588 VanDerWaalsContact O-N 3.16Å; G588-C592 PolarHBondContact O-N 3.07Å; G588-C592 PolarHBondContact O-SG 3.34Å
589	M	89.6	Confident	88.3	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-75	-36.3	-177.6	-67.4	-59.9	111.1	0	0	113.8	A554 Y558 G559 Y585 T586 V587 C592 F625 V761 L765	A554-M589 HydrophobicContact CB-CG 4.5Å; A554-M589 WeakPolarHBondContact O-CB 3.46Å; Y558-M589 HydrophobicContact CD2-SD 4.23Å; G559-M589 PolarHBondContact N-O 3.35Å; G559-M589 VanDerWaalsContact N-O 3.08Å; Y585-M589 WeakPolarHBondContact O-CG 3.08Å; Y585-M589 PolarHBondContact O-N 3.01Å; T586-M589 PolarHBondContact O-N 2.75Å; V587-M589 PolarHBondContact O-N 3.01Å; M589-C592 VanDerWaalsContact CA-SG 3.59Å; M589-F625 HydrophobicContact CE-CB 4.14Å; M589-F625 HydrophobicContact CE-CD1 3.71Å; M589-F625 HydrophobicContact CE-CD2 3.81Å; M589-F625 HydrophobicContact CE-CE1 3.99Å; M589-F625 HydrophobicContact CE-CE2 4.1Å; M589-F625 HydrophobicContact CE-CG 3.61Å; M589-F625 HydrophobicContact CE-CZ 4.19Å; M589-V761 HydrophobicContact CE-CG1 3.74Å; M589-V761 HydrophobicContact SD-CG1 3.69Å; M589-L765 HydrophobicContact CE-CB 4.06Å; M589-L765 HydrophobicContact CE-CD1 4.11Å; M589-L765 HydrophobicContact CE-CD2 3.85Å; M589-L765 HydrophobicContact CE-CG 4.21Å; M589-L765 HydrophobicContact CG-CD2 3.78Å; M589-L765 HydrophobicContact SD-CD2 3.72Å
590	A	89.8	Confident	88.2	Confident	1 Å²	1	17.7 Å²	17.7	1%	0.008	9%	0.093	C	C	.	.	H	α-helix	trans	-68.7	-36.3	178.4	0	0	0	0	0	112.1	M557 M561 A564 T586	M557-A590 WeakPolarHBondContact O-CA 3.37Å; M561-A590 WeakPolarHBondContact CA-O 3.29Å; M561-A590 PolarHBondContact N-O 2.94Å; A564-A590 HydrophobicContact CB-CB 3.66Å; T586-A590 WeakPolarHBondContact O-CB 3.47Å; T586-A590 PolarHBondContact O-N 3.42Å
591	Y	87.7	Confident	88	Confident	2 Å²	2	25.6 Å²	25.6	1%	0.008	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	17.1	-177.2	-71.7	-82.8	0	0	0	114.2	M561 D565 V587 G593 S594 N596 A599	M561-Y591 HydrophobicContact CB-CD1 4.42Å; M561-Y591 HydrophobicContact CB-CE1 4.08Å; M561-Y591 HydrophobicContact CG-CD1 4.5Å; D565-Y591 PolarHBondContact OD1-OH 3.14Å; D565-Y591 PolarHBondContact OD2-OH 3.25Å; V587-Y591 HydrophobicContact CG1-CD2 4.27Å; V587-Y591 WeakPolarHBondContact O-CB 3.2Å; V587-Y591 PolarHBondContact O-N 3.25Å; V587-Y591 VanDerWaalsContact O-N 3.08Å; Y591-G593 PolarHBondContact O-N 3.44Å; Y591-G593 VanDerWaalsContact O-N 3.17Å; Y591-S594 WeakPolarHBondContact O-CB 3.21Å; Y591-S594 PolarHBondContact O-N 3.21Å; Y591-S594 PolarHBondContact O-OG 2.93Å; Y591-N596 HydrophobicContact CD1-CB 3.93Å; Y591-N596 HydrophobicContact CE1-CB 4.2Å; Y591-A599 HydrophobicContact CD1-CB 4.17Å; Y591-A599 HydrophobicContact CD2-CB 3.83Å; Y591-A599 HydrophobicContact CE2-CB 4.25Å; Y591-A599 HydrophobicContact CG-CB 3.78Å
592	C	84.7	Confident	87.9	Confident	13 Å²	13	27.5 Å²	27.5	9%	0.088	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.8	118.9	178	-86.8	0	0	0	0	112.7	Y558 G588 M589 S594 F625 F628	Y558-C592 HydrophobicContact CE2-CB 4.32Å; G588-C592 PolarHBondContact O-N 3.07Å; G588-C592 PolarHBondContact O-SG 3.34Å; M589-C592 VanDerWaalsContact CA-SG 3.59Å; C592-S594 PolarHBondContact O-N 2.72Å; C592-F625 WeakPolarHBondContact CA-O 3.5Å; C592-F628 HydrophobicContact CB-CE1 4.18Å
593	G	78.3	Confident	87.8	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.01	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	11	175.9	0	0	0	0	0	115.7	Y591 F625 I626 R629	Y591-G593 PolarHBondContact O-N 3.44Å; Y591-G593 VanDerWaalsContact O-N 3.17Å; G593-F625 PolarHBondContact N-O 2.9Å; G593-F625 VanDerWaalsContact N-O 3.1Å; G593-I626 WeakPolarHBondContact CA-O 3.47Å; G593-I626 PolarHBondContact N-O 3.4Å; G593-R629 WeakPolarHBondContact O-CD 3.49Å; G593-R629 VanDerWaalsContact O-CZ 3.27Å; G593-R629 PolarHBondContact O-NE 3.08Å; G593-R629 PolarHBondContact O-NH1 3.18Å
594	S	78.6	Confident	87.7	Confident	24 Å²	24	30.1 Å²	30.1	17%	0.168	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-28.7	-179.7	68.7	0	0	0	0	114	Y591 C592 N596	Y591-S594 WeakPolarHBondContact O-CB 3.21Å; Y591-S594 PolarHBondContact O-N 3.21Å; Y591-S594 PolarHBondContact O-OG 2.93Å; C592-S594 PolarHBondContact O-N 2.72Å; S594-N596 PolarHBondContact O-N 2.84Å; S594-N596 PolarHBondContact OG-N 2.85Å
595	G	78.8	Confident	87.6	Confident	20 Å²	20	36.1 Å²	36.1	21%	0.206	17%	0.172	C	C	.	.			trans	63.7	22.3	-174	0	0	0	0	0	114.8	N597 I626	G595-N597 PolarHBondContact O-N 3.08Å; G595-I626 PolarHBondContact N-O 2.93Å
596	N	84	Confident	87.4	Confident	21 Å²	21	37 Å²	37	11%	0.112	18%	0.177	C	C	.	.			trans	-70	123.8	-176.4	-169.2	-23.7	0	0	0	112.2	Y591 S594 K598 A599 I600	Y591-N596 HydrophobicContact CD1-CB 3.93Å; Y591-N596 HydrophobicContact CE1-CB 4.2Å; S594-N596 PolarHBondContact O-N 2.84Å; S594-N596 PolarHBondContact OG-N 2.85Å; N596-K598 VanDerWaalsContact C-N 3.29Å; N596-K598 PolarHBondContact O-N 3.46Å; N596-K598 WeakPolarHBondContact OD1-CB 3.01Å; N596-K598 PolarHBondContact OD1-N 3.41Å; N596-A599 PolarHBondContact O-N 2.93Å; N596-I600 WeakPolarHBondContact O-CG1 3.11Å; N596-I600 PolarHBondContact O-N 3.26Å
597	N	85.6	Confident	87.2	Confident	114 Å²	114	37 Å²	37	61%	0.61	18%	0.178	S	C	*	.	H	α-helix	trans	-61.8	-31.4	179	-70.7	-28	0	0	0	113.6	G595 I600 R601	G595-N597 PolarHBondContact O-N 3.08Å; N597-I600 PolarHBondContact O-N 3.2Å; N597-R601 VanDerWaalsContact O-CB 3.25Å; N597-R601 WeakPolarHBondContact O-CB 3.48Å; N597-R601 PolarHBondContact O-N 3.17Å
598	K	86	Confident	87	Confident	107 Å²	107	42 Å²	42	47%	0.465	21%	0.209	S	C	.	.	H	α-helix	trans	-62.2	-45.3	177.7	-173.1	-172.8	179.3	-166.5	0	110.9	D565 N596 R602	D565-K598 IonicContact OD2-NZ 2.65Å; D565-K598 PolarHBondContact OD2-NZ 2.93Å; N596-K598 VanDerWaalsContact C-N 3.29Å; N596-K598 PolarHBondContact O-N 3.46Å; N596-K598 WeakPolarHBondContact OD1-CB 3.01Å; N596-K598 PolarHBondContact OD1-N 3.41Å; K598-R602 PolarHBondContact O-N 3.2Å; K598-R602 VanDerWaalsContact O-N 3.09Å
599	A	88.1	Confident	87	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.008	23%	0.231	C	C	.	.	H	α-helix	trans	-66.3	-46.5	178.7	0	0	0	0	0	111.2	V587 Y591 N596 R601 R602 L603 I626	V587-A599 HydrophobicContact CG1-CB 3.97Å; Y591-A599 HydrophobicContact CD1-CB 4.17Å; Y591-A599 HydrophobicContact CD2-CB 3.83Å; Y591-A599 HydrophobicContact CE2-CB 4.25Å; Y591-A599 HydrophobicContact CG-CB 3.78Å; N596-A599 PolarHBondContact O-N 2.93Å; A599-R601 PolarHBondContact O-N 3.45Å; A599-R602 PolarHBondContact O-N 3.39Å; A599-L603 WeakPolarHBondContact O-CG 3.46Å; A599-L603 PolarHBondContact O-N 3.45Å; A599-I626 HydrophobicContact CB-CD1 3.9Å
600	I	88.8	Confident	87.1	Confident	17 Å²	17	46.5 Å²	46.5	9%	0.087	24%	0.238	C	C	.	.	H	α-helix	trans	-60.6	-45.6	177.9	-62.8	167	0	0	0	110.9	N596 N597 R602 L603 L604 I626 L627	N596-I600 WeakPolarHBondContact O-CG1 3.11Å; N596-I600 PolarHBondContact O-N 3.26Å; N597-I600 PolarHBondContact O-N 3.2Å; I600-R602 VanDerWaalsContact C-N 3.33Å; I600-R602 PolarHBondContact O-N 2.95Å; I600-L603 PolarHBondContact O-N 2.83Å; I600-L604 HydrophobicContact CG2-CD1 3.79Å; I600-L604 HydrophobicContact CG2-CG 4.22Å; I600-L604 WeakPolarHBondContact O-CB 3.35Å; I600-L604 WeakPolarHBondContact O-CG 3.43Å; I600-L604 PolarHBondContact O-N 3.26Å; I600-I626 HydrophobicContact CD1-CG2 4.31Å; I600-I626 HydrophobicContact CG1-CG2 4.08Å; I600-L627 HydrophobicContact CD1-CD1 4.44Å; I600-L627 HydrophobicContact CD1-CD2 3.67Å; I600-L627 HydrophobicContact CD1-CG 4.17Å
601	R	89.9	Confident	87.1	Confident	205 Å²	205	52.9 Å²	52.9	77%	0.774	28%	0.276	S	S	*	.	H	α-helix	trans	-60.2	-42.5	177.9	-177.6	177.6	178.3	167.8	0.1	112	N597 A599 H605	N597-R601 VanDerWaalsContact O-CB 3.25Å; N597-R601 WeakPolarHBondContact O-CB 3.48Å; N597-R601 PolarHBondContact O-N 3.17Å; A599-R601 PolarHBondContact O-N 3.45Å; R601-H605 WeakPolarHBondContact O-CB 3.34Å; R601-H605 PolarHBondContact O-N 3.17Å
602	R	89.3	Confident	87.4	Confident	46 Å²	46	55.2 Å²	55.2	17%	0.174	29%	0.289	C	S	.	.	H	α-helix	trans	-63.7	-47.3	177.3	-171.7	-175.4	-76.3	153	-8.9	110.8	D565 E569 K598 A599 I600 H605 V606	D565-R602 IonicContact OD1-CZ 3.1Å; D565-R602 IonicContact OD1-NH1 3.99Å; D565-R602 PolarHBondContact OD1-NH1 3.37Å; D565-R602 IonicContact OD1-NH2 3.12Å; E569-R602 IonicContact OE1-NH2 2.99Å; E569-R602 PolarHBondContact OE1-NH2 3.13Å; K598-R602 PolarHBondContact O-N 3.2Å; K598-R602 VanDerWaalsContact O-N 3.09Å; A599-R602 PolarHBondContact O-N 3.39Å; I600-R602 VanDerWaalsContact C-N 3.33Å; I600-R602 PolarHBondContact O-N 2.95Å; R602-H605 PolarHBondContact O-N 2.65Å; R602-V606 WeakPolarHBondContact O-CG2 3.44Å; R602-V606 PolarHBondContact O-N 3.31Å
603	L	90	Very high	87.7	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.2	-46.1	177.6	-70.1	175.3	0	0	0	112.2	M584 V587 A599 I600 H605 V606 A607 A619 I623 I626	M584-L603 HydrophobicContact CB-CD2 4.32Å; M584-L603 HydrophobicContact SD-CD2 3.62Å; V587-L603 HydrophobicContact CB-CD2 4.1Å; V587-L603 HydrophobicContact CG1-CD1 3.99Å; V587-L603 HydrophobicContact CG1-CD2 3.92Å; V587-L603 HydrophobicContact CG1-CG 3.86Å; A599-L603 WeakPolarHBondContact O-CG 3.46Å; A599-L603 PolarHBondContact O-N 3.45Å; I600-L603 PolarHBondContact O-N 2.83Å; L603-H605 VanDerWaalsContact C-N 3.32Å; L603-H605 PolarHBondContact O-N 3.42Å; L603-V606 PolarHBondContact O-N 3.47Å; L603-A607 VanDerWaalsContact O-CB 3.32Å; L603-A607 WeakPolarHBondContact O-CB 3.42Å; L603-A607 PolarHBondContact O-N 3.24Å; L603-A619 HydrophobicContact CD2-CB 4.41Å; L603-I623 HydrophobicContact CD1-CG1 4.33Å; L603-I626 HydrophobicContact CD1-CD1 3.41Å; L603-I626 VanDerWaalsContact CD1-CD1 3.41Å
604	L	90.1	Very high	88.3	Confident	55 Å²	55	59.4 Å²	59.4	29%	0.288	31%	0.31	S	S	.	.	H	α-helix	trans	-62.2	-39.7	177.4	-72.8	174.1	0	0	0	112.1	I600 A607 V608 I623 V637 L641	I600-L604 HydrophobicContact CG2-CD1 3.79Å; I600-L604 HydrophobicContact CG2-CG 4.22Å; I600-L604 WeakPolarHBondContact O-CB 3.35Å; I600-L604 WeakPolarHBondContact O-CG 3.43Å; I600-L604 PolarHBondContact O-N 3.26Å; L604-A607 PolarHBondContact O-N 3Å; L604-V608 PolarHBondContact O-N 3.41Å; L604-I623 HydrophobicContact CD2-CD1 3.79Å; L604-I623 HydrophobicContact CG-CD1 4.4Å; L604-V637 HydrophobicContact CD1-CG1 4.42Å; L604-V637 HydrophobicContact CD2-CG1 4.44Å; L604-L641 HydrophobicContact CD2-CD1 3.86Å; L604-L641 HydrophobicContact CD2-CD2 4.49Å
605	H	90.9	Very high	88.9	Confident	128 Å²	128	58.2 Å²	58.2	59%	0.593	30%	0.302	S	S	*	.	H	α-helix	trans	-62	-48	175.5	178.8	-86.8	0	0	0	111.4	R601 R602 L603 A607 V608 S609	R601-H605 WeakPolarHBondContact O-CB 3.34Å; R601-H605 PolarHBondContact O-N 3.17Å; R602-H605 PolarHBondContact O-N 2.65Å; L603-H605 VanDerWaalsContact C-N 3.32Å; L603-H605 PolarHBondContact O-N 3.42Å; H605-A607 PolarHBondContact O-N 2.89Å; H605-V608 PolarHBondContact O-N 3.47Å; H605-S609 PolarHBondContact CE1-OG 2.93Å; H605-S609 PolarHBondContact ND1-OG 2.93Å; H605-S609 WeakPolarHBondContact O-CB 3.19Å; H605-S609 PolarHBondContact O-N 3.06Å; H605-S609 PolarHBondContact O-OG 3.07Å
606	V	90.1	Very high	89.6	Confident	21 Å²	21	58.5 Å²	58.5	13%	0.127	30%	0.297	C	S	.	.	H	α-helix	trans	-66.6	-36.8	179.3	177.1	0	0	0	0	111.6	M584 R602 L603 V608 S609 D610 V615	M584-V606 HydrophobicContact CE-CB 4.3Å; M584-V606 HydrophobicContact CE-CG1 4.03Å; M584-V606 HydrophobicContact CE-CG2 4Å; M584-V606 HydrophobicContact CG-CG1 4.41Å; M584-V606 HydrophobicContact SD-CB 3.83Å; M584-V606 HydrophobicContact SD-CG1 3.64Å; M584-V606 HydrophobicContact SD-CG2 4.14Å; R602-V606 WeakPolarHBondContact O-CG2 3.44Å; R602-V606 PolarHBondContact O-N 3.31Å; L603-V606 PolarHBondContact O-N 3.47Å; V606-V608 PolarHBondContact O-N 3Å; V606-V608 VanDerWaalsContact O-N 3.15Å; V606-S609 PolarHBondContact O-N 2.9Å; V606-D610 HydrophobicContact CG1-CB 4.18Å; V606-D610 WeakPolarHBondContact O-CB 3.36Å; V606-D610 PolarHBondContact O-N 3.45Å; V606-D610 VanDerWaalsContact O-N 3.07Å; V606-V615 HydrophobicContact CG1-CG1 3.77Å
607	A	88.9	Confident	90	Very high	2 Å²	2	57.7 Å²	57.7	2%	0.017	29%	0.292	C	S	.	.	H	α-helix	trans	-60.3	-24.6	176.7	0	0	0	0	0	113.8	L603 L604 H605 R616 A619 V620	L603-A607 VanDerWaalsContact O-CB 3.32Å; L603-A607 WeakPolarHBondContact O-CB 3.42Å; L603-A607 PolarHBondContact O-N 3.24Å; L604-A607 PolarHBondContact O-N 3Å; H605-A607 PolarHBondContact O-N 2.89Å; A607-R616 PolarHBondContact O-NE 2.82Å; A607-R616 PolarHBondContact O-NH2 2.83Å; A607-A619 HydrophobicContact CB-CB 3.97Å; A607-V620 HydrophobicContact CB-CG2 3.93Å
608	V	87.7	Confident	90.3	Very high	105 Å²	105	52.2 Å²	52.2	64%	0.636	26%	0.263	S	S	*	.	H	α-helix	trans	-100.5	-39.1	177.9	179.3	0	0	0	0	112.3	L604 H605 V606	L604-V608 PolarHBondContact O-N 3.41Å; H605-V608 PolarHBondContact O-N 3.47Å; V606-V608 PolarHBondContact O-N 3Å; V606-V608 VanDerWaalsContact O-N 3.15Å
609	S	89.6	Confident	90.7	Very high	69 Å²	69	47.1 Å²	47.1	48%	0.483	24%	0.241	S	C	.	.	H	α-helix	trans	-85.6	-28.8	-171.1	57.7	0	0	0	0	115	H605 V606	H605-S609 PolarHBondContact CE1-OG 2.93Å; H605-S609 PolarHBondContact ND1-OG 2.93Å; H605-S609 WeakPolarHBondContact O-CB 3.19Å; H605-S609 PolarHBondContact O-N 3.06Å; H605-S609 PolarHBondContact O-OG 3.07Å; V606-S609 PolarHBondContact O-N 2.9Å
610	D	92.2	Very high	90.9	Very high	24 Å²	24	47.1 Å²	47.1	13%	0.128	24%	0.241	C	C	.	.			trans	-73.1	145.4	-179.3	-153.7	-53.4	0	0	0	111.1	R580 V606 N612 V615 R616	R580-D610 IonicContact CZ-OD2 3.18Å; R580-D610 IonicContact NE-OD1 3.69Å; R580-D610 IonicContact NE-OD2 2.79Å; R580-D610 PolarHBondContact NE-OD2 2.99Å; R580-D610 IonicContact NH2-OD1 3.76Å; R580-D610 PolarHBondContact NH2-OD1 2.93Å; R580-D610 IonicContact NH2-OD2 2.74Å; R580-D610 PolarHBondContact NH2-OD2 2.82Å; V606-D610 HydrophobicContact CG1-CB 4.18Å; V606-D610 WeakPolarHBondContact O-CB 3.36Å; V606-D610 PolarHBondContact O-N 3.45Å; V606-D610 VanDerWaalsContact O-N 3.07Å; D610-N612 PolarHBondContact OD1-N 3.45Å; D610-V615 HydrophobicContact CB-CG1 4.36Å; D610-R616 HydrophobicContact CB-CG 4.46Å; D610-R616 WeakPolarHBondContact O-CD 3.47Å
611	V	90.8	Very high	91.1	Very high	136 Å²	136	46.5 Å²	46.5	82%	0.824	24%	0.237	S	C	*	.	S	Bend	trans	-84.4	-26.1	179.8	-173.1	0	0	0	0	110.9
612	N	93.1	Very high	91.2	Very high	51 Å²	51	36.8 Å²	36.8	27%	0.273	20%	0.201	S	C	.	.			trans	-86.2	122.9	-176.7	-170.1	-59.7	0	0	0	112	P577 D610 D614 V615 R616	P577-N612 HydrophobicContact CB-CB 4.09Å; P577-N612 VanDerWaalsContact CB-ND2 3.31Å; P577-N612 WeakPolarHBondContact CB-ND2 3.45Å; D610-N612 PolarHBondContact OD1-N 3.45Å; N612-D614 VanDerWaalsContact C-N 3.34Å; N612-D614 PolarHBondContact O-N 3.23Å; N612-D614 WeakPolarHBondContact OD1-CB 3.34Å; N612-D614 PolarHBondContact OD1-N 3.07Å; N612-V615 HydrophobicContact CB-CG2 4.04Å; N612-V615 PolarHBondContact O-N 3.43Å; N612-R616 WeakPolarHBondContact O-CG 3.35Å; N612-R616 PolarHBondContact O-N 2.83Å; N612-R616 VanDerWaalsContact O-N 3.17Å
613	D	91.3	Very high	91.3	Very high	60 Å²	60	34.6 Å²	34.6	32%	0.321	19%	0.193	S	C	.	.	H	α-helix	trans	-65.4	-29.7	-176	-68.3	-34	0	0	0	114.7	R616 R617 N646 H648	D613-R616 PolarHBondContact O-N 3Å; D613-R617 WeakPolarHBondContact O-CB 3.21Å; D613-R617 PolarHBondContact O-N 3.47Å; D613-N646 PolarHBondContact OD1-ND2 3.06Å; D613-H648 HydrophobicContact CB-CB 3.93Å; D613-H648 VanDerWaalsContact CB-CD2 3.42Å; D613-H648 WeakPolarHBondContact CB-CD2 3.35Å; D613-H648 IonicContact OD2-CD2 3.86Å
614	D	90	Very high	91.2	Very high	41 Å²	41	34.6 Å²	34.6	22%	0.219	19%	0.193	C	C	.	.	H	α-helix	trans	-69.6	-35.6	176.6	-79.7	-36.1	0	0	0	112	R581 N612 R617 A618	R581-D614 IonicContact NH1-OD2 2.64Å; N612-D614 VanDerWaalsContact C-N 3.34Å; N612-D614 PolarHBondContact O-N 3.23Å; N612-D614 WeakPolarHBondContact OD1-CB 3.34Å; N612-D614 PolarHBondContact OD1-N 3.07Å; D614-R617 IonicContact OD1-CZ 3.04Å; D614-R617 IonicContact OD1-NE 2.76Å; D614-R617 IonicContact OD1-NH2 3.71Å; D614-R617 PolarHBondContact OD1-NH2 3.47Å; D614-A618 WeakPolarHBondContact O-CB 3.34Å; D614-A618 PolarHBondContact O-N 3.42Å
615	V	92.6	Very high	91.3	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-68.5	-43.1	174.7	-175.7	0	0	0	0	109.6	P577 R580 R581 M584 V606 D610 N612 R617 A618 A619	P577-V615 HydrophobicContact CB-CG2 4.3Å; P577-V615 VanDerWaalsContact O-CG2 3.28Å; P577-V615 WeakPolarHBondContact O-CG2 3.49Å; R580-V615 HydrophobicContact CB-CG1 4.27Å; R580-V615 HydrophobicContact CB-CG2 4.17Å; R581-V615 HydrophobicContact CB-CG2 4.17Å; M584-V615 HydrophobicContact CG-CG1 3.97Å; V606-V615 HydrophobicContact CG1-CG1 3.77Å; D610-V615 HydrophobicContact CB-CG1 4.36Å; N612-V615 HydrophobicContact CB-CG2 4.04Å; N612-V615 PolarHBondContact O-N 3.43Å; V615-R617 PolarHBondContact O-N 2.94Å; V615-A618 PolarHBondContact O-N 3.39Å; V615-A619 WeakPolarHBondContact O-CB 3.42Å; V615-A619 PolarHBondContact O-N 3.46Å
616	R	93.4	Very high	91.2	Very high	26 Å²	26	25.9 Å²	25.9	10%	0.098	15%	0.151	C	C	.	.	H	α-helix	trans	-61	-44.2	177.6	-63.2	176.9	78.9	171.9	7.8	111.7	A607 D610 N612 D613 A619 V620 Y645 N646 V649	A607-R616 PolarHBondContact O-NE 2.82Å; A607-R616 PolarHBondContact O-NH2 2.83Å; D610-R616 HydrophobicContact CB-CG 4.46Å; D610-R616 WeakPolarHBondContact O-CD 3.47Å; N612-R616 WeakPolarHBondContact O-CG 3.35Å; N612-R616 PolarHBondContact O-N 2.83Å; N612-R616 VanDerWaalsContact O-N 3.17Å; D613-R616 PolarHBondContact O-N 3Å; R616-A619 PolarHBondContact O-N 3.41Å; R616-V620 WeakPolarHBondContact O-CG2 3.37Å; R616-V620 PolarHBondContact O-N 3.29Å; R616-Y645 PolarHBondContact NH1-OH 2.81Å; R616-N646 PolarHBondContact NH1-ND2 2.89Å; R616-V649 HydrophobicContact CB-CG2 4.08Å
617	R	92.1	Very high	91.1	Very high	3 Å²	3	25 Å²	25	1%	0.011	15%	0.145	C	C	.	.	H	α-helix	trans	-59.7	-52.2	175.1	175.8	174.6	55	139.6	-9.9	111.4	D613 D614 V615 A619 V620 E621 H648	D613-R617 WeakPolarHBondContact O-CB 3.21Å; D613-R617 PolarHBondContact O-N 3.47Å; D614-R617 IonicContact OD1-CZ 3.04Å; D614-R617 IonicContact OD1-NE 2.76Å; D614-R617 IonicContact OD1-NH2 3.71Å; D614-R617 PolarHBondContact OD1-NH2 3.47Å; V615-R617 PolarHBondContact O-N 2.94Å; R617-A619 VanDerWaalsContact C-N 3.28Å; R617-A619 PolarHBondContact O-N 3.09Å; R617-V620 PolarHBondContact O-N 3.1Å; R617-V620 VanDerWaalsContact O-N 3.17Å; R617-E621 WeakPolarHBondContact CD-OE1 3.48Å; R617-E621 HydrophobicContact CG-CG 4.29Å; R617-E621 WeakPolarHBondContact CG-OE1 3.45Å; R617-E621 WeakPolarHBondContact O-CG 3.47Å; R617-E621 PolarHBondContact O-N 2.75Å; R617-H648 HydrophobicContact CB-CB 4.39Å
618	A	92.3	Very high	91	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-60.7	-37.5	179.9	0	0	0	0	0	112.2	R581 M584 Y585 D614 V615 V620 E621 S622	R581-A618 HydrophobicContact CG-CB 3.6Å; M584-A618 HydrophobicContact CB-CB 4.23Å; Y585-A618 HydrophobicContact CD1-CB 4.41Å; Y585-A618 HydrophobicContact CE1-CB 3.82Å; Y585-A618 HydrophobicContact CE2-CB 4.08Å; D614-A618 WeakPolarHBondContact O-CB 3.34Å; D614-A618 PolarHBondContact O-N 3.42Å; V615-A618 PolarHBondContact O-N 3.39Å; A618-V620 VanDerWaalsContact C-N 3.33Å; A618-V620 PolarHBondContact O-N 3.01Å; A618-E621 PolarHBondContact O-N 3.23Å; A618-S622 WeakPolarHBondContact O-CB 3.31Å; A618-S622 PolarHBondContact O-N 3.01Å; A618-S622 PolarHBondContact O-OG 3.42Å; A618-S622 VanDerWaalsContact O-OG 3.12Å
619	A	93.1	Very high	90.9	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.3	-41.1	177.1	0	0	0	0	0	112.3	M584 L603 A607 V615 R616 R617	M584-A619 HydrophobicContact CG-CB 4.06Å; M584-A619 HydrophobicContact SD-CB 3.93Å; L603-A619 HydrophobicContact CD2-CB 4.41Å; A607-A619 HydrophobicContact CB-CB 3.97Å; V615-A619 WeakPolarHBondContact O-CB 3.42Å; V615-A619 PolarHBondContact O-N 3.46Å; R616-A619 PolarHBondContact O-N 3.41Å; R617-A619 VanDerWaalsContact C-N 3.28Å; R617-A619 PolarHBondContact O-N 3.09Å
620	V	93.4	Very high	90.6	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-74.5	-40.5	177	-177.9	0	0	0	0	111.5	A607 R616 R617 A618 S622 I623 L641 V649 A653 A656	A607-V620 HydrophobicContact CB-CG2 3.93Å; R616-V620 WeakPolarHBondContact O-CG2 3.37Å; R616-V620 PolarHBondContact O-N 3.29Å; R617-V620 PolarHBondContact O-N 3.1Å; R617-V620 VanDerWaalsContact O-N 3.17Å; A618-V620 VanDerWaalsContact C-N 3.33Å; A618-V620 PolarHBondContact O-N 3.01Å; V620-S622 VanDerWaalsContact C-N 3.28Å; V620-S622 PolarHBondContact O-N 2.72Å; V620-I623 VanDerWaalsContact O-CB 3.3Å; V620-I623 WeakPolarHBondContact O-CB 3.42Å; V620-I623 PolarHBondContact O-N 2.85Å; V620-I623 VanDerWaalsContact O-N 3.1Å; V620-L641 HydrophobicContact CG1-CD1 4.01Å; V620-L641 HydrophobicContact CG2-CD1 4.14Å; V620-V649 HydrophobicContact CG2-CG1 4.18Å; V620-A653 HydrophobicContact CG1-CB 4.16Å; V620-A656 WeakPolarHBondContact O-CB 3.27Å
621	E	92.4	Very high	90.2	Very high	4 Å²	4	22.9 Å²	22.9	2%	0.019	12%	0.124	C	C	.	.	H	α-helix	trans	-56.9	-42.1	174.5	-73.6	172.2	179	0	0	111.6	Y585 R617 A618 I623 G624 M655	Y585-E621 PolarHBondContact OH-OE2 3.47Å; Y585-E621 VanDerWaalsContact OH-OE2 3.11Å; R617-E621 WeakPolarHBondContact CD-OE1 3.48Å; R617-E621 HydrophobicContact CG-CG 4.29Å; R617-E621 WeakPolarHBondContact CG-OE1 3.45Å; R617-E621 WeakPolarHBondContact O-CG 3.47Å; R617-E621 PolarHBondContact O-N 2.75Å; A618-E621 PolarHBondContact O-N 3.23Å; E621-I623 PolarHBondContact O-N 3.19Å; E621-G624 PolarHBondContact O-N 2.95Å; E621-M655 HydrophobicContact CG-CB 4.19Å; E621-M655 HydrophobicContact CG-CG 4.38Å
622	S	91.9	Very high	90	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.007	12%	0.119	C	C	.	.	H	α-helix	trans	-60	-24	177.5	-73.1	0	0	0	0	114.2	M584 A618 V620 G624 F625 I626	M584-S622 PolarHBondContact O-OG 3.11Å; A618-S622 WeakPolarHBondContact O-CB 3.31Å; A618-S622 PolarHBondContact O-N 3.01Å; A618-S622 PolarHBondContact O-OG 3.42Å; A618-S622 VanDerWaalsContact O-OG 3.12Å; V620-S622 VanDerWaalsContact C-N 3.28Å; V620-S622 PolarHBondContact O-N 2.72Å; S622-G624 PolarHBondContact O-N 3.26Å; S622-F625 PolarHBondContact O-N 3.07Å; S622-I626 WeakPolarHBondContact O-CG1 3.14Å; S622-I626 PolarHBondContact O-N 3.41Å
623	I	91.2	Very high	89.6	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-62.2	-37.3	174.2	-61.2	174.2	0	0	0	110.4	L603 L604 V620 E621 F625 I626 L627 V638 L641	L603-I623 HydrophobicContact CD1-CG1 4.33Å; L604-I623 HydrophobicContact CD2-CD1 3.79Å; L604-I623 HydrophobicContact CG-CD1 4.4Å; V620-I623 VanDerWaalsContact O-CB 3.3Å; V620-I623 WeakPolarHBondContact O-CB 3.42Å; V620-I623 PolarHBondContact O-N 2.85Å; V620-I623 VanDerWaalsContact O-N 3.1Å; E621-I623 PolarHBondContact O-N 3.19Å; I623-F625 VanDerWaalsContact C-N 3.32Å; I623-F625 PolarHBondContact O-N 3.31Å; I623-I626 PolarHBondContact O-N 2.82Å; I623-L627 HydrophobicContact CG2-CD1 3.61Å; I623-L627 HydrophobicContact CG2-CG 4.25Å; I623-L627 WeakPolarHBondContact O-CB 3.37Å; I623-L627 PolarHBondContact O-N 3.22Å; I623-V638 HydrophobicContact CG2-CG2 4.46Å; I623-L641 HydrophobicContact CD1-CD1 4.04Å
624	G	89.1	Confident	89.5	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.1	-39.6	177.8	0	0	0	0	0	112.5	E621 S622 F628	E621-G624 PolarHBondContact O-N 2.95Å; S622-G624 PolarHBondContact O-N 3.26Å; G624-F628 PolarHBondContact O-N 3.01Å
625	F	90.9	Very high	89.5	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-72.3	-26	176.9	-67.3	-66.6	0	0	0	113.7	M589 C592 G593 S622 I623 F628 I659 V761 L764 L765	M589-F625 HydrophobicContact CE-CB 4.14Å; M589-F625 HydrophobicContact CE-CD1 3.71Å; M589-F625 HydrophobicContact CE-CD2 3.81Å; M589-F625 HydrophobicContact CE-CE1 3.99Å; M589-F625 HydrophobicContact CE-CE2 4.1Å; M589-F625 HydrophobicContact CE-CG 3.61Å; M589-F625 HydrophobicContact CE-CZ 4.19Å; C592-F625 WeakPolarHBondContact CA-O 3.5Å; G593-F625 PolarHBondContact N-O 2.9Å; G593-F625 VanDerWaalsContact N-O 3.1Å; S622-F625 PolarHBondContact O-N 3.07Å; I623-F625 VanDerWaalsContact C-N 3.32Å; I623-F625 PolarHBondContact O-N 3.31Å; F625-F628 WeakPolarHBondContact O-CD1 3.22Å; F625-F628 WeakPolarHBondContact O-CE1 3.36Å; F625-I659 HydrophobicContact CD1-CG2 3.92Å; F625-I659 HydrophobicContact CE1-CD1 4.44Å; F625-I659 HydrophobicContact CE1-CG2 3.76Å; F625-I659 HydrophobicContact CE2-CD1 3.93Å; F625-I659 HydrophobicContact CG-CG2 4.47Å; F625-I659 HydrophobicContact CZ-CD1 3.77Å; F625-I659 HydrophobicContact CZ-CG2 4.15Å; F625-V761 HydrophobicContact CD1-CG1 3.96Å; F625-V761 HydrophobicContact CE1-CG1 4.15Å; F625-L764 HydrophobicContact CE1-CB 4.17Å; F625-L764 HydrophobicContact CZ-CB 4.33Å; F625-L765 HydrophobicContact CE1-CB 4.46Å; F625-L765 HydrophobicContact CE2-CB 4.43Å; F625-L765 HydrophobicContact CE2-CD1 3.93Å; F625-L765 HydrophobicContact CZ-CB 3.9Å; F625-L765 HydrophobicContact CZ-CD1 4.26Å
626	I	90.1	Very high	89.3	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-82.3	-39.2	177.1	-64.1	171.8	0	0	0	111.1	V587 G593 G595 A599 I600 L603 S622 I623	V587-I626 HydrophobicContact CG1-CD1 4.19Å; G593-I626 WeakPolarHBondContact CA-O 3.47Å; G593-I626 PolarHBondContact N-O 3.4Å; G595-I626 PolarHBondContact N-O 2.93Å; A599-I626 HydrophobicContact CB-CD1 3.9Å; I600-I626 HydrophobicContact CD1-CG2 4.31Å; I600-I626 HydrophobicContact CG1-CG2 4.08Å; L603-I626 HydrophobicContact CD1-CD1 3.41Å; L603-I626 VanDerWaalsContact CD1-CD1 3.41Å; S622-I626 WeakPolarHBondContact O-CG1 3.14Å; S622-I626 PolarHBondContact O-N 3.41Å; I623-I626 PolarHBondContact O-N 2.82Å
627	L	87.4	Confident	89	Confident	3 Å²	3	26.7 Å²	26.7	2%	0.016	14%	0.142	C	C	.	.	H	α-helix	trans	-95.2	0.1	-170.9	-68.3	-179.7	0	0	0	115.2	I600 I623 R629 T630 C634 V637 C660	I600-L627 HydrophobicContact CD1-CD1 4.44Å; I600-L627 HydrophobicContact CD1-CD2 3.67Å; I600-L627 HydrophobicContact CD1-CG 4.17Å; I623-L627 HydrophobicContact CG2-CD1 3.61Å; I623-L627 HydrophobicContact CG2-CG 4.25Å; I623-L627 WeakPolarHBondContact O-CB 3.37Å; I623-L627 PolarHBondContact O-N 3.22Å; L627-R629 PolarHBondContact O-N 2.75Å; L627-T630 CarbonylContact O-C 3.55Å; L627-T630 VanDerWaalsContact O-C 3.25Å; L627-T630 PolarHBondContact O-N 3.24Å; L627-C634 HydrophobicContact CB-CB 4.33Å; L627-C634 HydrophobicContact CD1-CB 4.37Å; L627-V637 HydrophobicContact CD1-CG2 4.43Å; L627-C660 VanDerWaalsContact C-SG 3.54Å; L627-C660 PolarHBondContact O-SG 2.9Å; L627-C660 VanDerWaalsContact O-SG 3.39Å
628	F	87.2	Confident	88.8	Confident	5 Å²	5	26.6 Å²	26.6	2%	0.022	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-14.5	-178.7	76.1	-93.8	0	0	0	115	C592 G624 F625 C660 L749 Q750 T756	C592-F628 HydrophobicContact CB-CE1 4.18Å; G624-F628 PolarHBondContact O-N 3.01Å; F625-F628 WeakPolarHBondContact O-CD1 3.22Å; F625-F628 WeakPolarHBondContact O-CE1 3.36Å; F628-C660 VanDerWaalsContact CA-SG 3.59Å; F628-L749 HydrophobicContact CB-CB 4.45Å; F628-L749 HydrophobicContact CB-CD1 3.65Å; F628-L749 HydrophobicContact CD1-CB 4.48Å; F628-L749 HydrophobicContact CD1-CD1 4.04Å; F628-L749 HydrophobicContact CD2-CB 3.47Å; F628-L749 VanDerWaalsContact CD2-CB 3.47Å; F628-L749 HydrophobicContact CD2-CD1 4.17Å; F628-L749 HydrophobicContact CD2-CG 4.48Å; F628-L749 HydrophobicContact CE2-CB 3.7Å; F628-L749 HydrophobicContact CG-CB 3.91Å; F628-L749 HydrophobicContact CG-CD1 3.71Å; F628-L749 HydrophobicContact CG-CG 4.48Å; F628-L749 HydrophobicContact CZ-CB 4.31Å; F628-Q750 HydrophobicContact CD2-CG 3.72Å; F628-Q750 HydrophobicContact CE2-CG 3.5Å; F628-Q750 PolarHBondContact O-NE2 3.39Å; F628-T756 HydrophobicContact CE2-CG2 4.14Å; F628-T756 HydrophobicContact CZ-CG2 3.58Å
629	R	84.4	Confident	88.7	Confident	61 Å²	61	28.7 Å²	28.7	23%	0.23	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-33.5	172.1	-167	166.8	-79.8	156.9	-2.6	112.7	G593 L627 P631 Q750	G593-R629 WeakPolarHBondContact O-CD 3.49Å; G593-R629 VanDerWaalsContact O-CZ 3.27Å; G593-R629 PolarHBondContact O-NE 3.08Å; G593-R629 PolarHBondContact O-NH1 3.18Å; L627-R629 PolarHBondContact O-N 2.75Å; R629-P631 WeakPolarHBondContact O-CD 3.48Å; R629-Q750 VanDerWaalsContact CA-NE2 3.35Å
630	T	84.6	Confident	88.5	Confident	58 Å²	58	35.2 Å²	35.2	36%	0.356	19%	0.19	S	C	.	.	S	Bend	trans	-123.7	75.4	178.6	43.1	0	0	0	0	110.1	L627 E632 Q633	L627-T630 CarbonylContact O-C 3.55Å; L627-T630 VanDerWaalsContact O-C 3.25Å; L627-T630 PolarHBondContact O-N 3.24Å; T630-E632 PolarHBondContact O-N 2.92Å; T630-Q633 PolarHBondContact O-N 3.33Å; T630-Q633 PolarHBondContact OG1-OE1 2.96Å
631	P	83.1	Confident	88.2	Confident	32 Å²	32	36.2 Å²	36.2	21%	0.208	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-15.8	-172	26.8	-35.6	0	0	0	114.4	R629 P635 C661 T664	R629-P631 WeakPolarHBondContact O-CD 3.48Å; P631-P635 WeakPolarHBondContact O-CD 3Å; P631-C661 PolarHBondContact O-SG 3.35Å; P631-C661 VanDerWaalsContact O-SG 3.42Å; P631-T664 HydrophobicContact CB-CG2 4.34Å; P631-T664 HydrophobicContact CG-CG2 4.16Å
632	E	86.4	Confident	88	Confident	155 Å²	155	36.7 Å²	36.7	72%	0.724	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-28.3	175.1	-64	177.4	-179.2	0	0	112.8	T630	T630-E632 PolarHBondContact O-N 2.92Å
633	Q	85.8	Confident	87.9	Confident	102 Å²	102	44 Å²	44	48%	0.477	23%	0.234	S	C	.	.	H	α-helix	trans	-79.2	-28	-178.4	-69.3	175.9	-13.8	0	0	112.4	T630 S636 V637	T630-Q633 PolarHBondContact O-N 3.33Å; T630-Q633 PolarHBondContact OG1-OE1 2.96Å; Q633-S636 PolarHBondContact O-N 2.82Å; Q633-S636 PolarHBondContact O-OG 3.38Å; Q633-V637 PolarHBondContact O-N 2.94Å
634	C	87.8	Confident	87.8	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.2	-47.4	-175.6	-177	0	0	0	0	113.4	L627 S636 V637 V638 C660	L627-C634 HydrophobicContact CB-CB 4.33Å; L627-C634 HydrophobicContact CD1-CB 4.37Å; C634-S636 VanDerWaalsContact C-N 3.27Å; C634-S636 PolarHBondContact O-N 3.45Å; C634-V637 PolarHBondContact O-N 3.21Å; C634-V638 WeakPolarHBondContact O-CB 3.46Å; C634-V638 VanDerWaalsContact O-CG2 3.3Å; C634-V638 WeakPolarHBondContact O-CG2 3.3Å; C634-V638 PolarHBondContact O-N 3.04Å; C634-C660 HydrophobicContact CB-CB 3.93Å; C634-C660 WeakPolarHBondContact CB-SG 3.39Å
635	P	90.8	Very high	87.8	Confident	4 Å²	4	54.1 Å²	54.1	3%	0.026	28%	0.277	C	S	.	.	H	α-helix	trans	-53.3	-40.9	173.5	-28.6	35.9	0	0	0	113.8	P631 V637 V638 S639 L657 E668 A669 L672	P631-P635 WeakPolarHBondContact O-CD 3Å; P635-V637 PolarHBondContact O-N 3.4Å; P635-V638 PolarHBondContact O-N 3.37Å; P635-S639 VanDerWaalsContact O-CB 3.29Å; P635-S639 WeakPolarHBondContact O-CB 3.39Å; P635-S639 PolarHBondContact O-N 3.33Å; P635-L657 HydrophobicContact CB-CD2 4.31Å; P635-L657 HydrophobicContact CG-CD2 4.06Å; P635-E668 HydrophobicContact CB-CB 4.34Å; P635-A669 HydrophobicContact CG-CB 4.23Å; P635-L672 HydrophobicContact CB-CD1 3.91Å
636	S	88.8	Confident	87.8	Confident	87 Å²	87	54.4 Å²	54.4	61%	0.608	28%	0.279	S	S	*	.	H	α-helix	trans	-64.3	-40	-178.6	74.2	0	0	0	0	113	Q633 C634	Q633-S636 PolarHBondContact O-N 2.82Å; Q633-S636 PolarHBondContact O-OG 3.38Å; C634-S636 VanDerWaalsContact C-N 3.27Å; C634-S636 PolarHBondContact O-N 3.45Å
637	V	86.4	Confident	87.9	Confident	46 Å²	46	55.8 Å²	55.8	28%	0.279	29%	0.287	S	S	.	.	H	α-helix	trans	-76.7	-39.1	179.3	178.2	0	0	0	0	111.2	L604 L627 Q633 C634 P635	L604-V637 HydrophobicContact CD1-CG1 4.42Å; L604-V637 HydrophobicContact CD2-CG1 4.44Å; L627-V637 HydrophobicContact CD1-CG2 4.43Å; Q633-V637 PolarHBondContact O-N 2.94Å; C634-V637 PolarHBondContact O-N 3.21Å; P635-V637 PolarHBondContact O-N 3.4Å
638	V	87.8	Confident	88.1	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-83.1	-19.4	-173.2	178.3	0	0	0	0	112.6	I623 C634 P635 L640 L641 S642 A653 A656 L657	I623-V638 HydrophobicContact CG2-CG2 4.46Å; C634-V638 WeakPolarHBondContact O-CB 3.46Å; C634-V638 VanDerWaalsContact O-CG2 3.3Å; C634-V638 WeakPolarHBondContact O-CG2 3.3Å; C634-V638 PolarHBondContact O-N 3.04Å; P635-V638 PolarHBondContact O-N 3.37Å; V638-L640 VanDerWaalsContact C-N 3.34Å; V638-L640 PolarHBondContact O-N 3.34Å; V638-L641 WeakPolarHBondContact O-CA 3.1Å; V638-L641 WeakPolarHBondContact O-CB 3.33Å; V638-L641 PolarHBondContact O-N 3.33Å; V638-S642 PolarHBondContact O-N 3.31Å; V638-A653 HydrophobicContact CG1-CB 3.38Å; V638-A656 HydrophobicContact CG2-CB 4.47Å; V638-L657 HydrophobicContact CB-CD2 4.24Å; V638-L657 HydrophobicContact CB-CG 4.48Å; V638-L657 HydrophobicContact CG1-CD1 4.3Å; V638-L657 HydrophobicContact CG1-CD2 4.35Å; V638-L657 HydrophobicContact CG1-CG 4.06Å
639	S	90	Very high	88.4	Confident	44 Å²	44	57.3 Å²	57.3	31%	0.308	30%	0.295	S	S	.	.	H	α-helix	trans	-50.4	-50.2	178.3	-176.8	0	0	0	0	112.4	P635 L641 S642	P635-S639 VanDerWaalsContact O-CB 3.29Å; P635-S639 WeakPolarHBondContact O-CB 3.39Å; P635-S639 PolarHBondContact O-N 3.33Å; S639-L641 VanDerWaalsContact C-N 3.31Å; S639-L641 PolarHBondContact O-N 2.63Å; S639-S642 WeakPolarHBondContact O-CB 3.41Å; S639-S642 PolarHBondContact O-N 2.98Å; S639-S642 PolarHBondContact O-OG 3.04Å
640	L	88.1	Confident	88.8	Confident	137 Å²	137	55.8 Å²	55.8	72%	0.717	29%	0.289	S	S	*	.	H	α-helix	trans	-65.7	-32.7	178.3	-175.7	64	0	0	0	113.2	V638 S642	V638-L640 VanDerWaalsContact C-N 3.34Å; V638-L640 PolarHBondContact O-N 3.34Å; L640-S642 VanDerWaalsContact C-N 3.34Å
641	L	87.6	Confident	89.1	Confident	21 Å²	21	53.1 Å²	53.1	11%	0.11	27%	0.273	C	S	.	.	H	α-helix	trans	-73.5	-29.3	179.4	-61.2	173.9	0	0	0	111.8	L604 V620 I623 V638 S639 E643 S644 V649 A653	L604-L641 HydrophobicContact CD2-CD1 3.86Å; L604-L641 HydrophobicContact CD2-CD2 4.49Å; V620-L641 HydrophobicContact CG1-CD1 4.01Å; V620-L641 HydrophobicContact CG2-CD1 4.14Å; I623-L641 HydrophobicContact CD1-CD1 4.04Å; V638-L641 WeakPolarHBondContact O-CA 3.1Å; V638-L641 WeakPolarHBondContact O-CB 3.33Å; V638-L641 PolarHBondContact O-N 3.33Å; S639-L641 VanDerWaalsContact C-N 3.31Å; S639-L641 PolarHBondContact O-N 2.63Å; L641-E643 VanDerWaalsContact C-N 3.26Å; L641-E643 PolarHBondContact O-N 2.93Å; L641-S644 VanDerWaalsContact O-CB 3.27Å; L641-S644 WeakPolarHBondContact O-CB 3.33Å; L641-S644 PolarHBondContact O-N 3.4Å; L641-S644 PolarHBondContact O-OG 3.1Å; L641-V649 HydrophobicContact CB-CG1 4.24Å; L641-V649 HydrophobicContact CD2-CG1 4.43Å; L641-A653 HydrophobicContact CB-CB 4.45Å
642	S	89.3	Confident	89.5	Confident	15 Å²	15	51.6 Å²	51.6	11%	0.105	26%	0.263	C	S	.	.	H	α-helix	trans	-64.9	-28.2	177.5	72.6	0	0	0	0	113.8	V638 S639 L640 S644 R650	V638-S642 PolarHBondContact O-N 3.31Å; S639-S642 WeakPolarHBondContact O-CB 3.41Å; S639-S642 PolarHBondContact O-N 2.98Å; S639-S642 PolarHBondContact O-OG 3.04Å; L640-S642 VanDerWaalsContact C-N 3.34Å; S642-S644 VanDerWaalsContact C-N 3.32Å; S642-R650 WeakPolarHBondContact O-CD 3.46Å; S642-R650 VanDerWaalsContact O-CG 3.28Å; S642-R650 WeakPolarHBondContact O-CG 3.23Å
643	E	89.3	Confident	89.8	Confident	154 Å²	154	44.2 Å²	44.2	72%	0.72	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.6	0.5	-179.8	-60.9	-174.8	163.5	0	0	113	L641	L641-E643 VanDerWaalsContact C-N 3.26Å; L641-E643 PolarHBondContact O-N 2.93Å
644	S	89.4	Confident	90.2	Very high	27 Å²	27	39.4 Å²	39.4	19%	0.189	21%	0.206	C	C	.	.			trans	-62.8	146.8	-178.3	65.3	0	0	0	0	112.5	L641 S642 N646 V649 R650	L641-S644 VanDerWaalsContact O-CB 3.27Å; L641-S644 WeakPolarHBondContact O-CB 3.33Å; L641-S644 PolarHBondContact O-N 3.4Å; L641-S644 PolarHBondContact O-OG 3.1Å; S642-S644 VanDerWaalsContact C-N 3.32Å; S644-N646 PolarHBondContact O-N 2.92Å; S644-V649 WeakPolarHBondContact OG-CB 3.37Å; S644-V649 WeakPolarHBondContact OG-CG1 3.49Å; S644-R650 VanDerWaalsContact O-CD 3.3Å; S644-R650 WeakPolarHBondContact O-CD 3.26Å; S644-R650 WeakPolarHBondContact O-CG 3.29Å; S644-R650 PolarHBondContact O-NH1 3.15Å
645	Y	89.2	Confident	90.4	Very high	186 Å²	186	39.7 Å²	39.7	73%	0.729	21%	0.207	S	C	*	.	S	Bend	trans	-64.6	-27.9	179.2	77	-88.1	0	0	0	112.9	R616 P647 R650	R616-Y645 PolarHBondContact NH1-OH 2.81Å; Y645-P647 WeakPolarHBondContact O-CD 3.22Å; Y645-R650 PolarHBondContact O-NH1 3.33Å
646	N	90.8	Very high	90.5	Very high	6 Å²	6	39.5 Å²	39.5	3%	0.032	21%	0.206	C	C	.	.			trans	-80.3	118.1	-176.2	-173	-18.2	0	0	0	110.9	D613 R616 S644 H648 V649 R650	D613-N646 PolarHBondContact OD1-ND2 3.06Å; R616-N646 PolarHBondContact NH1-ND2 2.89Å; S644-N646 PolarHBondContact O-N 2.92Å; N646-H648 VanDerWaalsContact C-N 3.26Å; N646-H648 PolarHBondContact O-N 3.07Å; N646-H648 WeakPolarHBondContact OD1-CB 3.45Å; N646-H648 PolarHBondContact OD1-N 3.2Å; N646-V649 HydrophobicContact CB-CB 4.33Å; N646-V649 HydrophobicContact CB-CG2 4Å; N646-V649 PolarHBondContact O-N 3.13Å; N646-R650 PolarHBondContact O-N 2.71Å
647	P	92.4	Very high	90.7	Very high	28 Å²	28	35.3 Å²	35.3	18%	0.182	18%	0.177	C	C	.	.	H	α-helix	trans	-67.2	-23.9	-177.8	-7.8	20.8	0	0	0	113.5	Y645 R650 C651 V681 Y683 V684	Y645-P647 WeakPolarHBondContact O-CD 3.22Å; P647-R650 PolarHBondContact O-N 3.13Å; P647-C651 WeakPolarHBondContact O-CB 3.43Å; P647-C651 PolarHBondContact O-N 3.26Å; P647-V681 HydrophobicContact CB-CB 4.11Å; P647-V681 HydrophobicContact CB-CG1 3.92Å; P647-V681 HydrophobicContact CB-CG2 3.93Å; P647-V681 HydrophobicContact CG-CG1 4.42Å; P647-V681 HydrophobicContact CG-CG2 3.83Å; P647-Y683 HydrophobicContact CB-CE2 3.93Å; P647-Y683 WeakPolarHBondContact CB-OH 3.44Å; P647-V684 HydrophobicContact CB-CG2 3.65Å; P647-V684 VanDerWaalsContact O-CG2 3.29Å; P647-V684 WeakPolarHBondContact O-CG2 3.45Å
648	H	91.7	Very high	90.9	Very high	36 Å²	36	33.1 Å²	33.1	17%	0.167	16%	0.164	C	C	.	.	H	α-helix	trans	-66.3	-38.1	174.8	-71.1	-86.2	0	0	0	112.4	D613 R617 N646 C651 G652 Y683	D613-H648 HydrophobicContact CB-CB 3.93Å; D613-H648 VanDerWaalsContact CB-CD2 3.42Å; D613-H648 WeakPolarHBondContact CB-CD2 3.35Å; D613-H648 IonicContact OD2-CD2 3.86Å; R617-H648 HydrophobicContact CB-CB 4.39Å; N646-H648 VanDerWaalsContact C-N 3.26Å; N646-H648 PolarHBondContact O-N 3.07Å; N646-H648 WeakPolarHBondContact OD1-CB 3.45Å; N646-H648 PolarHBondContact OD1-N 3.2Å; H648-C651 PolarHBondContact O-N 3.38Å; H648-G652 PolarHBondContact O-N 3.21Å; H648-Y683 PolarHBondContact CD2-OH 3.46Å; H648-Y683 AromaticContact NE2-CZ 3.95Å; H648-Y683 PolarHBondContact NE2-OH 2.92Å
649	V	92.8	Very high	91	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.024	16%	0.164	C	C	.	.	H	α-helix	trans	-68.5	-41.9	175.2	176.9	0	0	0	0	110.1	R616 V620 L641 S644 N646 C651 G652 A653	R616-V649 HydrophobicContact CB-CG2 4.08Å; V620-V649 HydrophobicContact CG2-CG1 4.18Å; L641-V649 HydrophobicContact CB-CG1 4.24Å; L641-V649 HydrophobicContact CD2-CG1 4.43Å; S644-V649 WeakPolarHBondContact OG-CB 3.37Å; S644-V649 WeakPolarHBondContact OG-CG1 3.49Å; N646-V649 HydrophobicContact CB-CB 4.33Å; N646-V649 HydrophobicContact CB-CG2 4Å; N646-V649 PolarHBondContact O-N 3.13Å; V649-C651 PolarHBondContact O-N 3.22Å; V649-G652 PolarHBondContact O-N 3.01Å; V649-A653 WeakPolarHBondContact O-CB 3.46Å; V649-A653 PolarHBondContact O-N 3.25Å
650	R	93.2	Very high	91	Very high	29 Å²	29	31.4 Å²	31.4	11%	0.109	15%	0.151	C	C	.	.	H	α-helix	trans	-62.4	-41.3	174.5	-61	-159.6	-62.7	-81.1	3.5	112.7	S642 S644 Y645 N646 P647 A653 A654 D679 V684	S642-R650 WeakPolarHBondContact O-CD 3.46Å; S642-R650 VanDerWaalsContact O-CG 3.28Å; S642-R650 WeakPolarHBondContact O-CG 3.23Å; S644-R650 VanDerWaalsContact O-CD 3.3Å; S644-R650 WeakPolarHBondContact O-CD 3.26Å; S644-R650 WeakPolarHBondContact O-CG 3.29Å; S644-R650 PolarHBondContact O-NH1 3.15Å; Y645-R650 PolarHBondContact O-NH1 3.33Å; N646-R650 PolarHBondContact O-N 2.71Å; P647-R650 PolarHBondContact O-N 3.13Å; R650-A653 WeakPolarHBondContact O-CB 3.37Å; R650-A653 PolarHBondContact O-N 3.36Å; R650-A654 PolarHBondContact O-N 2.92Å; R650-D679 IonicContact CZ-OD2 3Å; R650-D679 IonicContact NE-OD2 3.82Å; R650-D679 PolarHBondContact NE-OD2 2.91Å; R650-D679 IonicContact NH2-OD1 3.01Å; R650-D679 PolarHBondContact NH2-OD1 3.4Å; R650-D679 VanDerWaalsContact NH2-OD1 3.1Å; R650-D679 IonicContact NH2-OD2 3.3Å; R650-D679 PolarHBondContact NH2-OD2 3.35Å; R650-V684 HydrophobicContact CB-CG1 4.11Å; R650-V684 HydrophobicContact CB-CG2 4.34Å
651	C	90.8	Very high	91	Very high	3 Å²	3	24.9 Å²	24.9	2%	0.02	12%	0.117	C	C	.	.	H	α-helix	trans	-64.8	-43.4	174.7	-172.7	0	0	0	0	111.9	P647 H648 V649 A653 A654 M655 Y683 V684 W771	P647-C651 WeakPolarHBondContact O-CB 3.43Å; P647-C651 PolarHBondContact O-N 3.26Å; H648-C651 PolarHBondContact O-N 3.38Å; V649-C651 PolarHBondContact O-N 3.22Å; C651-A653 VanDerWaalsContact C-N 3.31Å; C651-A653 PolarHBondContact O-N 3.46Å; C651-A654 WeakPolarHBondContact O-CB 3.46Å; C651-A654 PolarHBondContact O-N 3.45Å; C651-M655 PolarHBondContact O-N 2.71Å; C651-Y683 HydrophobicContact CB-CD2 4.1Å; C651-Y683 HydrophobicContact CB-CE2 4.38Å; C651-V684 HydrophobicContact CB-CG2 4.31Å; C651-W771 HydrophobicContact CB-CH2 4.37Å; C651-W771 VanDerWaalsContact SG-CZ2 3.54Å
652	G	90.9	Very high	90.8	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.7	-38.6	175.2	0	0	0	0	0	112.2	H648 V649 M655 A656	H648-G652 PolarHBondContact O-N 3.21Å; V649-G652 PolarHBondContact O-N 3.01Å; G652-M655 PolarHBondContact O-N 3.08Å; G652-A656 WeakPolarHBondContact O-CB 3.46Å; G652-A656 PolarHBondContact O-N 3Å
653	A	92.7	Very high	90.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62.1	-46.3	173.9	0	0	0	0	0	111.9	V620 V638 L641 V649 R650 C651 M655 A656 L657 M676	V620-A653 HydrophobicContact CG1-CB 4.16Å; V638-A653 HydrophobicContact CG1-CB 3.38Å; L641-A653 HydrophobicContact CB-CB 4.45Å; V649-A653 WeakPolarHBondContact O-CB 3.46Å; V649-A653 PolarHBondContact O-N 3.25Å; R650-A653 WeakPolarHBondContact O-CB 3.37Å; R650-A653 PolarHBondContact O-N 3.36Å; C651-A653 VanDerWaalsContact C-N 3.31Å; C651-A653 PolarHBondContact O-N 3.46Å; A653-M655 VanDerWaalsContact C-N 3.33Å; A653-M655 PolarHBondContact O-N 3.23Å; A653-A656 PolarHBondContact O-N 3.14Å; A653-L657 WeakPolarHBondContact O-CG 3.37Å; A653-L657 PolarHBondContact O-N 2.9Å; A653-L657 VanDerWaalsContact O-N 3.09Å; A653-M676 HydrophobicContact CB-CE 4.1Å
654	A	94.1	Very high	89.7	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-57.3	-47.1	175.4	0	0	0	0	0	111.5	R650 C651 L657 G658 L673 M676 A691	R650-A654 PolarHBondContact O-N 2.92Å; C651-A654 WeakPolarHBondContact O-CB 3.46Å; C651-A654 PolarHBondContact O-N 3.45Å; A654-L657 PolarHBondContact O-N 3.21Å; A654-G658 PolarHBondContact O-N 3.27Å; A654-L673 HydrophobicContact CB-CD2 3.89Å; A654-M676 HydrophobicContact CB-SD 3.59Å; A654-M676 VanDerWaalsContact CB-SD 3.59Å; A654-A691 WeakPolarHBondContact O-CB 3.36Å
655	M	93	Very high	89.1	Confident	6 Å²	6	20.5 Å²	20.5	3%	0.03	11%	0.111	C	C	.	.	H	α-helix	trans	-69.3	-37.6	-178.8	-166.6	56	58.1	0	0	112.4	E621 C651 G652 A653 L657 G658 I659 I690 L694 T768	E621-M655 HydrophobicContact CG-CB 4.19Å; E621-M655 HydrophobicContact CG-CG 4.38Å; C651-M655 PolarHBondContact O-N 2.71Å; G652-M655 PolarHBondContact O-N 3.08Å; A653-M655 VanDerWaalsContact C-N 3.33Å; A653-M655 PolarHBondContact O-N 3.23Å; M655-L657 VanDerWaalsContact C-N 3.34Å; M655-L657 PolarHBondContact O-N 2.91Å; M655-G658 PolarHBondContact O-N 3Å; M655-G658 VanDerWaalsContact O-N 3.16Å; M655-I659 HydrophobicContact CG-CD1 3.79Å; M655-I659 HydrophobicContact CG-CG1 4.33Å; M655-I659 WeakPolarHBondContact O-CB 3.42Å; M655-I659 VanDerWaalsContact O-CG1 3.28Å; M655-I659 WeakPolarHBondContact O-CG1 3.4Å; M655-I659 PolarHBondContact O-N 2.98Å; M655-I659 HydrophobicContact SD-CD1 4.35Å; M655-I659 HydrophobicContact SD-CG1 4.34Å; M655-I690 HydrophobicContact CE-CB 4.5Å; M655-I690 HydrophobicContact CE-CG2 4.19Å; M655-L694 HydrophobicContact SD-CD1 4.33Å; M655-T768 HydrophobicContact CG-CG2 3.91Å; M655-T768 HydrophobicContact SD-CG2 4.28Å
656	A	93	Very high	89	Confident	0 Å²	0	13.1 Å²	13.1	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-60	-43.5	174.5	0	0	0	0	0	111.9	V620 V638 G652 A653 C660	V620-A656 WeakPolarHBondContact O-CB 3.27Å; V638-A656 HydrophobicContact CG2-CB 4.47Å; G652-A656 WeakPolarHBondContact O-CB 3.46Å; G652-A656 PolarHBondContact O-N 3Å; A653-A656 PolarHBondContact O-N 3.14Å; A656-C660 WeakPolarHBondContact O-CB 3.49Å; A656-C660 PolarHBondContact O-N 3.46Å
657	L	92.1	Very high	88.8	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63	-43.7	173	-67.3	172	0	0	0	111.4	P635 V638 A653 A654 M655 I659 C661 A669 L672 L673	P635-L657 HydrophobicContact CB-CD2 4.31Å; P635-L657 HydrophobicContact CG-CD2 4.06Å; V638-L657 HydrophobicContact CB-CD2 4.24Å; V638-L657 HydrophobicContact CB-CG 4.48Å; V638-L657 HydrophobicContact CG1-CD1 4.3Å; V638-L657 HydrophobicContact CG1-CD2 4.35Å; V638-L657 HydrophobicContact CG1-CG 4.06Å; A653-L657 WeakPolarHBondContact O-CG 3.37Å; A653-L657 PolarHBondContact O-N 2.9Å; A653-L657 VanDerWaalsContact O-N 3.09Å; A654-L657 PolarHBondContact O-N 3.21Å; M655-L657 VanDerWaalsContact C-N 3.34Å; M655-L657 PolarHBondContact O-N 2.91Å; L657-I659 PolarHBondContact O-N 3.43Å; L657-C661 VanDerWaalsContact O-CB 3.29Å; L657-C661 WeakPolarHBondContact O-CB 3.26Å; L657-C661 PolarHBondContact O-N 3.25Å; L657-A669 HydrophobicContact CD2-CB 4.42Å; L657-L672 HydrophobicContact CD1-CB 4.02Å; L657-L672 HydrophobicContact CD1-CD1 4.23Å; L657-L672 HydrophobicContact CD2-CD1 4.5Å; L657-L673 HydrophobicContact CD1-CD2 4.2Å; L657-L673 HydrophobicContact CD1-CG 4.43Å
658	G	90.6	Very high	88.6	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59.2	-45.1	177.8	0	0	0	0	0	113.2	A654 M655 A662	A654-G658 PolarHBondContact O-N 3.27Å; M655-G658 PolarHBondContact O-N 3Å; M655-G658 VanDerWaalsContact O-N 3.16Å; G658-A662 WeakPolarHBondContact O-CB 3.32Å; G658-A662 PolarHBondContact O-N 3.17Å
659	I	90.8	Very high	88.5	Confident	1 Å²	1	21.6 Å²	21.6	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-72.3	-47.5	-179.4	-67.1	165.9	0	0	0	110.8	F625 M655 L657 L749 L764 T768	F625-I659 HydrophobicContact CD1-CG2 3.92Å; F625-I659 HydrophobicContact CE1-CD1 4.44Å; F625-I659 HydrophobicContact CE1-CG2 3.76Å; F625-I659 HydrophobicContact CE2-CD1 3.93Å; F625-I659 HydrophobicContact CG-CG2 4.47Å; F625-I659 HydrophobicContact CZ-CD1 3.77Å; F625-I659 HydrophobicContact CZ-CG2 4.15Å; M655-I659 HydrophobicContact CG-CD1 3.79Å; M655-I659 HydrophobicContact CG-CG1 4.33Å; M655-I659 WeakPolarHBondContact O-CB 3.42Å; M655-I659 VanDerWaalsContact O-CG1 3.28Å; M655-I659 WeakPolarHBondContact O-CG1 3.4Å; M655-I659 PolarHBondContact O-N 2.98Å; M655-I659 HydrophobicContact SD-CD1 4.35Å; M655-I659 HydrophobicContact SD-CG1 4.34Å; L657-I659 PolarHBondContact O-N 3.43Å; I659-L749 HydrophobicContact CG2-CD1 3.7Å; I659-L749 WeakPolarHBondContact O-CD1 3.28Å; I659-L764 HydrophobicContact CG2-CD1 4.3Å; I659-T768 HydrophobicContact CD1-CG2 3.86Å
660	C	89.3	Confident	88.3	Confident	6 Å²	6	21.5 Å²	21.5	4%	0.041	12%	0.118	C	C	.	.	H	α-helix	trans	-69.2	-43.1	-175.2	-173.5	0	0	0	0	112.4	L627 F628 C634 A656	L627-C660 VanDerWaalsContact C-SG 3.54Å; L627-C660 PolarHBondContact O-SG 2.9Å; L627-C660 VanDerWaalsContact O-SG 3.39Å; F628-C660 VanDerWaalsContact CA-SG 3.59Å; C634-C660 HydrophobicContact CB-CB 3.93Å; C634-C660 WeakPolarHBondContact CB-SG 3.39Å; A656-C660 WeakPolarHBondContact O-CB 3.49Å; A656-C660 PolarHBondContact O-N 3.46Å
661	C	87.3	Confident	88.2	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	14.8	-175.2	-57	0	0	0	0	113.3	P631 L657 G663 T664 A669 I695	P631-C661 PolarHBondContact O-SG 3.35Å; P631-C661 VanDerWaalsContact O-SG 3.42Å; L657-C661 VanDerWaalsContact O-CB 3.29Å; L657-C661 WeakPolarHBondContact O-CB 3.26Å; L657-C661 PolarHBondContact O-N 3.25Å; C661-G663 PolarHBondContact O-N 2.99Å; C661-T664 PolarHBondContact O-N 3.28Å; C661-T664 PolarHBondContact O-OG1 3.25Å; C661-A669 HydrophobicContact CB-CB 4.27Å; C661-I695 HydrophobicContact CB-CD1 4.42Å; C661-I695 HydrophobicContact CB-CG1 3.99Å
662	A	85.2	Confident	88.2	Confident	13 Å²	13	25.5 Å²	25.5	11%	0.107	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	130.1	178.5	0	0	0	0	0	111.7	G658 T664 L694 I747	G658-A662 WeakPolarHBondContact O-CB 3.32Å; G658-A662 PolarHBondContact O-N 3.17Å; A662-T664 PolarHBondContact O-N 3.03Å; A662-L694 WeakPolarHBondContact CA-O 3.5Å; A662-I747 HydrophobicContact CB-CB 4.44Å; A662-I747 HydrophobicContact CB-CG2 4.02Å
663	G	73.4	Confident	88.2	Confident	32 Å²	32	25.5 Å²	25.5	33%	0.33	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.7	-3.7	178.6	0	0	0	0	0	116.6	C661 L694	C661-G663 PolarHBondContact O-N 2.99Å; G663-L694 PolarHBondContact N-O 3.48Å; G663-L694 VanDerWaalsContact N-O 3.16Å
664	T	80.1	Confident	88	Confident	67 Å²	67	28.5 Å²	28.5	41%	0.411	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-33.5	-179.3	66.2	0	0	0	0	113.2	P631 C661 A662 Q699	P631-T664 HydrophobicContact CB-CG2 4.34Å; P631-T664 HydrophobicContact CG-CG2 4.16Å; C661-T664 PolarHBondContact O-N 3.28Å; C661-T664 PolarHBondContact O-OG1 3.25Å; A662-T664 PolarHBondContact O-N 3.03Å; T664-Q699 PolarHBondContact O-NE2 2.91Å; T664-Q699 VanDerWaalsContact O-NE2 3.15Å
665	G	78.6	Confident	87.8	Confident	13 Å²	13	32.5 Å²	32.5	13%	0.134	18%	0.181	C	C	.	.			trans	68.8	31.8	-175.2	0	0	0	0	0	115.3	K667 I695	G665-K667 PolarHBondContact O-N 3.44Å; G665-K667 VanDerWaalsContact O-N 3.17Å; G665-I695 PolarHBondContact N-O 2.81Å
666	N	85.8	Confident	87.6	Confident	32 Å²	32	32.5 Å²	32.5	17%	0.171	18%	0.182	C	C	.	.			trans	-60.1	121.5	179	-170.7	-8.8	0	0	0	110.8	E668 A669 I670	N666-E668 VanDerWaalsContact C-N 3.29Å; N666-E668 PolarHBondContact O-N 3.01Å; N666-E668 PolarHBondContact OD1-N 3.3Å; N666-E668 VanDerWaalsContact OD1-N 3.1Å; N666-A669 HydrophobicContact CB-CB 4.28Å; N666-A669 PolarHBondContact O-N 3.15Å; N666-I670 WeakPolarHBondContact O-CG1 3.31Å; N666-I670 PolarHBondContact O-N 3.27Å
667	K	86.9	Confident	87.5	Confident	134 Å²	134	33.1 Å²	33.1	58%	0.583	19%	0.185	S	C	*	.	H	α-helix	trans	-63.8	-34.6	-179	-66.8	-179	-179.4	176.1	0	112.3	G665 I670 N671	G665-K667 PolarHBondContact O-N 3.44Å; G665-K667 VanDerWaalsContact O-N 3.17Å; K667-I670 PolarHBondContact O-N 3.41Å; K667-N671 PolarHBondContact O-N 3.3Å; K667-N671 PolarHBondContact O-ND2 3.32Å; K667-N671 PolarHBondContact O-OD1 3.48Å
668	E	88.5	Confident	87.4	Confident	113 Å²	113	39.6 Å²	39.6	53%	0.528	22%	0.22	S	C	.	.	H	α-helix	trans	-64.9	-44.2	179.2	-66.2	-178	173.6	0	0	111.4	P635 N666 I670 N671 L672	P635-E668 HydrophobicContact CB-CB 4.34Å; N666-E668 VanDerWaalsContact C-N 3.29Å; N666-E668 PolarHBondContact O-N 3.01Å; N666-E668 PolarHBondContact OD1-N 3.3Å; N666-E668 VanDerWaalsContact OD1-N 3.1Å; E668-I670 VanDerWaalsContact C-N 3.32Å; E668-I670 PolarHBondContact O-N 2.88Å; E668-N671 PolarHBondContact O-N 3.14Å; E668-L672 PolarHBondContact O-N 3.47Å; E668-L672 VanDerWaalsContact O-N 3.13Å
669	A	89.3	Confident	87.5	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.5	-41.9	175.9	0	0	0	0	0	111.6	P635 L657 C661 N666 N671 L672 L673 I695	P635-A669 HydrophobicContact CG-CB 4.23Å; L657-A669 HydrophobicContact CD2-CB 4.42Å; C661-A669 HydrophobicContact CB-CB 4.27Å; N666-A669 HydrophobicContact CB-CB 4.28Å; N666-A669 PolarHBondContact O-N 3.15Å; A669-N671 PolarHBondContact O-N 3.41Å; A669-L672 PolarHBondContact O-N 3.03Å; A669-L673 WeakPolarHBondContact O-CG 3.43Å; A669-L673 PolarHBondContact O-N 3.42Å; A669-L673 VanDerWaalsContact O-N 3.15Å; A669-I695 HydrophobicContact CB-CD1 4.04Å
670	I	89.8	Confident	87.5	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-64.7	-41.3	177.9	-61.5	169.1	0	0	0	111.2	N666 K667 E668 L672 L673 E674 I695 M696 K706 F710	N666-I670 WeakPolarHBondContact O-CG1 3.31Å; N666-I670 PolarHBondContact O-N 3.27Å; K667-I670 PolarHBondContact O-N 3.41Å; E668-I670 VanDerWaalsContact C-N 3.32Å; E668-I670 PolarHBondContact O-N 2.88Å; I670-L672 VanDerWaalsContact C-N 3.25Å; I670-L672 PolarHBondContact O-N 3.35Å; I670-L673 PolarHBondContact O-N 3.02Å; I670-L673 VanDerWaalsContact O-N 3.14Å; I670-E674 PolarHBondContact O-N 3.14Å; I670-I695 HydrophobicContact CD1-CG2 4.23Å; I670-I695 HydrophobicContact CG1-CG2 3.98Å; I670-M696 HydrophobicContact CD1-CG 4.33Å; I670-K706 HydrophobicContact CG2-CB 4.45Å; I670-K706 HydrophobicContact CG2-CD 3.46Å; I670-K706 VanDerWaalsContact CG2-CD 3.46Å; I670-F710 HydrophobicContact CG2-CE2 3.7Å; I670-F710 HydrophobicContact CG2-CZ 4.23Å
671	N	90.3	Very high	87.7	Confident	84 Å²	84	47.4 Å²	47.4	45%	0.449	27%	0.269	S	S	.	.	H	α-helix	trans	-62.3	-33	177.2	-67.7	-14.3	0	0	0	112.4	K667 E668 A669 P675 K706	K667-N671 PolarHBondContact O-N 3.3Å; K667-N671 PolarHBondContact O-ND2 3.32Å; K667-N671 PolarHBondContact O-OD1 3.48Å; E668-N671 PolarHBondContact O-N 3.14Å; A669-N671 PolarHBondContact O-N 3.41Å; N671-P675 WeakPolarHBondContact O-CD 3.32Å; N671-K706 PolarHBondContact OD1-NZ 3.44Å
672	L	90.5	Very high	87.9	Confident	33 Å²	33	49.5 Å²	49.5	17%	0.173	28%	0.28	C	S	.	.	H	α-helix	trans	-73.5	-30.2	174.8	-68.1	175	0	0	0	112.9	P635 L657 E668 A669 I670 P675	P635-L672 HydrophobicContact CB-CD1 3.91Å; L657-L672 HydrophobicContact CD1-CB 4.02Å; L657-L672 HydrophobicContact CD1-CD1 4.23Å; L657-L672 HydrophobicContact CD2-CD1 4.5Å; E668-L672 PolarHBondContact O-N 3.47Å; E668-L672 VanDerWaalsContact O-N 3.13Å; A669-L672 PolarHBondContact O-N 3.03Å; I670-L672 VanDerWaalsContact C-N 3.25Å; I670-L672 PolarHBondContact O-N 3.35Å; L672-P675 WeakPolarHBondContact O-CD 3.5Å; L672-P675 WeakPolarHBondContact O-CG 3.14Å
673	L	90.6	Very high	88.2	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-79.5	-25.3	179.8	-70.5	179	0	0	0	114	A654 L657 A669 I670 M676 T677 A691 I695	A654-L673 HydrophobicContact CB-CD2 3.89Å; L657-L673 HydrophobicContact CD1-CD2 4.2Å; L657-L673 HydrophobicContact CD1-CG 4.43Å; A669-L673 WeakPolarHBondContact O-CG 3.43Å; A669-L673 PolarHBondContact O-N 3.42Å; A669-L673 VanDerWaalsContact O-N 3.15Å; I670-L673 PolarHBondContact O-N 3.02Å; I670-L673 VanDerWaalsContact O-N 3.14Å; L673-M676 HydrophobicContact CD2-SD 3.78Å; L673-M676 WeakPolarHBondContact O-CB 3.13Å; L673-M676 PolarHBondContact O-N 3.2Å; L673-T677 PolarHBondContact O-N 3.46Å; L673-T677 PolarHBondContact O-OG1 3.43Å; L673-A691 HydrophobicContact CD1-CB 3.91Å; L673-A691 HydrophobicContact CD2-CB 4.1Å; L673-I695 HydrophobicContact CD1-CD1 3.5Å; L673-I695 VanDerWaalsContact CD1-CD1 3.5Å
674	E	88.6	Confident	89.1	Confident	62 Å²	62	49.3 Å²	49.3	29%	0.29	27%	0.267	S	S	.	.	H	α-helix	trans	-55.5	-52.8	177.7	-79.5	177.6	170.8	0	0	114	I670 M676 T677 N678 K706 F710	I670-E674 PolarHBondContact O-N 3.14Å; E674-M676 VanDerWaalsContact C-N 3.28Å; E674-M676 PolarHBondContact O-N 3.14Å; E674-T677 PolarHBondContact O-N 2.83Å; E674-N678 PolarHBondContact O-ND2 2.96Å; E674-K706 VanDerWaalsContact OE1-CD 3.28Å; E674-K706 WeakPolarHBondContact OE1-CD 3.4Å; E674-K706 WeakPolarHBondContact OE1-CE 3.4Å; E674-K706 IonicContact OE1-NZ 3.86Å; E674-K706 PolarHBondContact OE1-NZ 3.46Å; E674-K706 IonicContact OE2-NZ 2.72Å; E674-K706 PolarHBondContact OE2-NZ 2.92Å; E674-F710 HydrophobicContact CG-CZ 4.11Å
675	P	90.8	Very high	89.7	Confident	84 Å²	84	48.3 Å²	48.3	55%	0.545	26%	0.256	S	S	.	.	H	α-helix	trans	-63.8	-34.8	176.7	24.6	-33.5	0	0	0	112.1	N671 L672 T677 N678 D679	N671-P675 WeakPolarHBondContact O-CD 3.32Å; L672-P675 WeakPolarHBondContact O-CD 3.5Å; L672-P675 WeakPolarHBondContact O-CG 3.14Å; P675-T677 PolarHBondContact O-N 3.42Å; P675-N678 PolarHBondContact O-N 3.49Å; P675-N678 VanDerWaalsContact O-N 3.08Å; P675-D679 PolarHBondContact O-N 2.9Å
676	M	89.2	Confident	90.4	Very high	7 Å²	7	48.1 Å²	48.1	3%	0.034	25%	0.251	C	S	.	.	H	α-helix	trans	-64.7	-27.3	177.6	-62.6	-176.9	-178.1	0	0	113.2	A653 A654 L673 E674 N678 D679 V684 A688	A653-M676 HydrophobicContact CB-CE 4.1Å; A654-M676 HydrophobicContact CB-SD 3.59Å; A654-M676 VanDerWaalsContact CB-SD 3.59Å; L673-M676 HydrophobicContact CD2-SD 3.78Å; L673-M676 WeakPolarHBondContact O-CB 3.13Å; L673-M676 PolarHBondContact O-N 3.2Å; E674-M676 VanDerWaalsContact C-N 3.28Å; E674-M676 PolarHBondContact O-N 3.14Å; M676-N678 PolarHBondContact O-N 2.81Å; M676-D679 VanDerWaalsContact O-CB 3.25Å; M676-D679 WeakPolarHBondContact O-CB 3.29Å; M676-D679 PolarHBondContact O-N 3.38Å; M676-V684 HydrophobicContact CB-CG1 4.4Å; M676-A688 HydrophobicContact CB-CB 3.88Å
677	T	90.8	Very high	90.7	Very high	13 Å²	13	46.6 Å²	46.6	8%	0.08	24%	0.243	C	C	.	.	H	α-helix	trans	-72.2	-21.8	177.2	-51.2	0	0	0	0	112	L673 E674 P675 R685 L689 L713	L673-T677 PolarHBondContact O-N 3.46Å; L673-T677 PolarHBondContact O-OG1 3.43Å; E674-T677 PolarHBondContact O-N 2.83Å; P675-T677 PolarHBondContact O-N 3.42Å; T677-R685 VanDerWaalsContact O-CD 3.26Å; T677-R685 WeakPolarHBondContact O-CD 3.42Å; T677-R685 WeakPolarHBondContact O-CG 3.43Å; T677-L689 HydrophobicContact CG2-CD2 3.61Å; T677-L689 HydrophobicContact CG2-CG 4.3Å; T677-L713 HydrophobicContact CG2-CD2 3.59Å
678	N	89.9	Confident	91	Very high	135 Å²	135	40.2 Å²	40.2	72%	0.722	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.4	7.2	175.2	-62	-51.1	0	0	0	112.9	E674 P675 M676	E674-N678 PolarHBondContact O-ND2 2.96Å; P675-N678 PolarHBondContact O-N 3.49Å; P675-N678 VanDerWaalsContact O-N 3.08Å; M676-N678 PolarHBondContact O-N 2.81Å
679	D	92.4	Very high	91.3	Very high	19 Å²	19	35 Å²	35	10%	0.102	19%	0.191	C	C	.	.			trans	-61.4	140.1	178.2	-165	-74.2	0	0	0	110.8	R650 P675 M676 V681 V684 R685	R650-D679 IonicContact CZ-OD2 3Å; R650-D679 IonicContact NE-OD2 3.82Å; R650-D679 PolarHBondContact NE-OD2 2.91Å; R650-D679 IonicContact NH2-OD1 3.01Å; R650-D679 PolarHBondContact NH2-OD1 3.4Å; R650-D679 VanDerWaalsContact NH2-OD1 3.1Å; R650-D679 IonicContact NH2-OD2 3.3Å; R650-D679 PolarHBondContact NH2-OD2 3.35Å; P675-D679 PolarHBondContact O-N 2.9Å; M676-D679 VanDerWaalsContact O-CB 3.25Å; M676-D679 WeakPolarHBondContact O-CB 3.29Å; M676-D679 PolarHBondContact O-N 3.38Å; D679-V681 PolarHBondContact O-N 3.45Å; D679-V681 VanDerWaalsContact OD1-CB 3.27Å; D679-V681 WeakPolarHBondContact OD1-CB 3.4Å; D679-V681 WeakPolarHBondContact OD1-CG2 3.48Å; D679-V681 PolarHBondContact OD1-N 3.05Å; D679-V684 HydrophobicContact CB-CB 4.16Å; D679-V684 HydrophobicContact CB-CG1 3.85Å; D679-R685 HydrophobicContact CB-CG 4.5Å; D679-R685 WeakPolarHBondContact O-CD 3.39Å; D679-R685 VanDerWaalsContact O-CG 3.22Å; D679-R685 WeakPolarHBondContact O-CG 3.45Å
680	P	89.9	Confident	91.5	Very high	119 Å²	119	35 Å²	35	77%	0.773	19%	0.191	S	C	*	.	S	Bend	trans	-63.4	-22	177.5	25.6	-35.8	0	0	0	113.4
681	V	93.9	Very high	91.7	Very high	34 Å²	34	34.9 Å²	34.9	21%	0.206	19%	0.191	C	C	.	.	S	Bend	trans	-86.2	125.8	-176.6	-176.7	0	0	0	0	111.3	P647 D679 Y683 V684 R685	P647-V681 HydrophobicContact CB-CB 4.11Å; P647-V681 HydrophobicContact CB-CG1 3.92Å; P647-V681 HydrophobicContact CB-CG2 3.93Å; P647-V681 HydrophobicContact CG-CG1 4.42Å; P647-V681 HydrophobicContact CG-CG2 3.83Å; D679-V681 PolarHBondContact O-N 3.45Å; D679-V681 VanDerWaalsContact OD1-CB 3.27Å; D679-V681 WeakPolarHBondContact OD1-CB 3.4Å; D679-V681 WeakPolarHBondContact OD1-CG2 3.48Å; D679-V681 PolarHBondContact OD1-N 3.05Å; V681-Y683 HydrophobicContact CG1-CD1 3.53Å; V681-Y683 HydrophobicContact CG1-CD2 4.35Å; V681-Y683 HydrophobicContact CG1-CE1 3.21Å; V681-Y683 HydrophobicContact CG1-CE2 4.13Å; V681-Y683 HydrophobicContact CG1-CG 4.1Å; V681-Y683 PolarHBondContact O-N 2.9Å; V681-V684 HydrophobicContact CB-CB 4.41Å; V681-V684 HydrophobicContact CB-CG2 4.02Å; V681-V684 HydrophobicContact CG1-CG2 4.11Å; V681-V684 PolarHBondContact O-N 3.22Å; V681-R685 PolarHBondContact O-N 3.3Å
682	N	91.5	Very high	91.8	Very high	44 Å²	44	31 Å²	31	24%	0.235	17%	0.17	C	C	.	.	H	α-helix	trans	-60	-42.9	-173.4	58.3	1.2	0	0	0	115.3	R685 Q686 D724 M726	N682-R685 PolarHBondContact O-N 2.81Å; N682-Q686 PolarHBondContact O-N 3.42Å; N682-D724 HydrophobicContact CB-CB 3.9Å; N682-D724 WeakPolarHBondContact CB-OD2 3.32Å; N682-M726 HydrophobicContact CB-CB 4.47Å
683	Y	91.3	Very high	91.9	Very high	41 Å²	41	29.4 Å²	29.4	16%	0.161	16%	0.162	C	C	.	.	H	α-helix	trans	-77.2	-23.4	-178.8	60.2	-96.4	0	0	0	113.3	P647 H648 C651 V681 Q686 G687 W771	P647-Y683 HydrophobicContact CB-CE2 3.93Å; P647-Y683 WeakPolarHBondContact CB-OH 3.44Å; H648-Y683 PolarHBondContact CD2-OH 3.46Å; H648-Y683 AromaticContact NE2-CZ 3.95Å; H648-Y683 PolarHBondContact NE2-OH 2.92Å; C651-Y683 HydrophobicContact CB-CD2 4.1Å; C651-Y683 HydrophobicContact CB-CE2 4.38Å; V681-Y683 HydrophobicContact CG1-CD1 3.53Å; V681-Y683 HydrophobicContact CG1-CD2 4.35Å; V681-Y683 HydrophobicContact CG1-CE1 3.21Å; V681-Y683 HydrophobicContact CG1-CE2 4.13Å; V681-Y683 HydrophobicContact CG1-CG 4.1Å; V681-Y683 PolarHBondContact O-N 2.9Å; Y683-Q686 WeakPolarHBondContact O-CB 3.45Å; Y683-Q686 PolarHBondContact O-N 3.49Å; Y683-G687 PolarHBondContact O-N 2.78Å; Y683-W771 AromaticContact CD2-CH2 3.64Å; Y683-W771 HydrophobicContact CD2-CH2 3.64Å; Y683-W771 HydrophobicContact CD2-CZ2 4.06Å; Y683-W771 HydrophobicContact CD2-CZ3 4.49Å; Y683-W771 HydrophobicContact CE2-CH2 4.28Å; Y683-W771 HydrophobicContact CG-CH2 4.18Å; Y683-W771 HydrophobicContact CG-CZ2 4.32Å
684	V	93.1	Very high	91.9	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-67.7	-46.1	169.9	180	0	0	0	0	109.5	P647 R650 C651 M676 D679 V681 Q686 G687 A688	P647-V684 HydrophobicContact CB-CG2 3.65Å; P647-V684 VanDerWaalsContact O-CG2 3.29Å; P647-V684 WeakPolarHBondContact O-CG2 3.45Å; R650-V684 HydrophobicContact CB-CG1 4.11Å; R650-V684 HydrophobicContact CB-CG2 4.34Å; C651-V684 HydrophobicContact CB-CG2 4.31Å; M676-V684 HydrophobicContact CB-CG1 4.4Å; D679-V684 HydrophobicContact CB-CB 4.16Å; D679-V684 HydrophobicContact CB-CG1 3.85Å; V681-V684 HydrophobicContact CB-CB 4.41Å; V681-V684 HydrophobicContact CB-CG2 4.02Å; V681-V684 HydrophobicContact CG1-CG2 4.11Å; V681-V684 PolarHBondContact O-N 3.22Å; V684-Q686 VanDerWaalsContact C-N 3.31Å; V684-Q686 PolarHBondContact O-N 3.26Å; V684-G687 PolarHBondContact O-N 3.46Å; V684-A688 WeakPolarHBondContact O-CB 3.32Å; V684-A688 PolarHBondContact O-N 2.64Å
685	R	93.1	Very high	92	Very high	46 Å²	46	26.4 Å²	26.4	17%	0.174	15%	0.148	C	C	.	.	H	α-helix	trans	-57.8	-44.1	172.8	-64.2	-165.6	-73.1	164.1	-1.2	111.5	T677 D679 V681 N682 G687 A688 L689 D723 D724 A727	T677-R685 VanDerWaalsContact O-CD 3.26Å; T677-R685 WeakPolarHBondContact O-CD 3.42Å; T677-R685 WeakPolarHBondContact O-CG 3.43Å; D679-R685 HydrophobicContact CB-CG 4.5Å; D679-R685 WeakPolarHBondContact O-CD 3.39Å; D679-R685 VanDerWaalsContact O-CG 3.22Å; D679-R685 WeakPolarHBondContact O-CG 3.45Å; V681-R685 PolarHBondContact O-N 3.3Å; N682-R685 PolarHBondContact O-N 2.81Å; R685-G687 PolarHBondContact O-N 3.47Å; R685-A688 PolarHBondContact O-N 3.28Å; R685-L689 VanDerWaalsContact O-CG 3.23Å; R685-L689 WeakPolarHBondContact O-CG 3.45Å; R685-L689 PolarHBondContact O-N 3.35Å; R685-D723 IonicContact CZ-OD1 3.82Å; R685-D723 IonicContact NH1-OD1 2.91Å; R685-D723 PolarHBondContact NH1-OD1 3.4Å; R685-D723 IonicContact NH2-OD1 3.8Å; R685-D724 IonicContact CZ-OD2 3.39Å; R685-D724 IonicContact NH2-OD2 3.9Å; R685-D724 PolarHBondContact NH2-OD2 3.24Å; R685-A727 HydrophobicContact CB-CB 4.46Å
686	Q	92.9	Very high	91.9	Very high	8 Å²	8	22.4 Å²	22.4	4%	0.037	12%	0.122	C	C	.	.	H	α-helix	trans	-57.7	-49.3	175.7	-178.4	-179.1	16.9	0	0	112.3	N682 Y683 V684 L689 I690 M726 F770	N682-Q686 PolarHBondContact O-N 3.42Å; Y683-Q686 WeakPolarHBondContact O-CB 3.45Å; Y683-Q686 PolarHBondContact O-N 3.49Å; V684-Q686 VanDerWaalsContact C-N 3.31Å; V684-Q686 PolarHBondContact O-N 3.26Å; Q686-L689 PolarHBondContact O-N 3.3Å; Q686-I690 HydrophobicContact CG-CD1 4.16Å; Q686-I690 WeakPolarHBondContact O-CG1 3.15Å; Q686-I690 PolarHBondContact O-N 3.16Å; Q686-M726 WeakPolarHBondContact CG-O 3.43Å; Q686-F770 VanDerWaalsContact NE2-CE2 3.27Å
687	G	91.9	Very high	91.8	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.01	12%	0.121	C	C	.	.	H	α-helix	trans	-62.8	-40.9	178.1	0	0	0	0	0	112.6	Y683 V684 R685 I690 A691	Y683-G687 PolarHBondContact O-N 2.78Å; V684-G687 PolarHBondContact O-N 3.46Å; R685-G687 PolarHBondContact O-N 3.47Å; G687-I690 PolarHBondContact O-N 3.04Å; G687-A691 VanDerWaalsContact O-CB 3.24Å; G687-A691 WeakPolarHBondContact O-CB 3.36Å; G687-A691 PolarHBondContact O-N 2.92Å
688	A	93.8	Very high	91.4	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-63.4	-43.4	178	0	0	0	0	0	112.6	M676 V684 R685 A691 S692	M676-A688 HydrophobicContact CB-CB 3.88Å; V684-A688 WeakPolarHBondContact O-CB 3.32Å; V684-A688 PolarHBondContact O-N 2.64Å; R685-A688 PolarHBondContact O-N 3.28Å; A688-A691 PolarHBondContact O-N 2.97Å; A688-S692 WeakPolarHBondContact O-CB 3.27Å; A688-S692 PolarHBondContact O-N 3.46Å; A688-S692 PolarHBondContact O-OG 3.4Å
689	L	93.9	Very high	90.9	Very high	3 Å²	3	17.4 Å²	17.4	2%	0.016	9%	0.093	C	C	.	.	H	α-helix	trans	-66.8	-38.3	178.3	-65	172.4	0	0	0	112.5	T677 R685 Q686 S692 A693 L713 Y714 A731 A734	T677-L689 HydrophobicContact CG2-CD2 3.61Å; T677-L689 HydrophobicContact CG2-CG 4.3Å; R685-L689 VanDerWaalsContact O-CG 3.23Å; R685-L689 WeakPolarHBondContact O-CG 3.45Å; R685-L689 PolarHBondContact O-N 3.35Å; Q686-L689 PolarHBondContact O-N 3.3Å; L689-S692 WeakPolarHBondContact CA-OG 3.41Å; L689-S692 PolarHBondContact O-OG 3.34Å; L689-A693 PolarHBondContact O-N 3.47Å; L689-L713 HydrophobicContact CD2-CD2 4.19Å; L689-Y714 HydrophobicContact CB-CE1 4.13Å; L689-Y714 HydrophobicContact CD2-CD1 3.83Å; L689-Y714 HydrophobicContact CD2-CE1 3.64Å; L689-Y714 HydrophobicContact CG-CE1 4.45Å; L689-Y714 PolarHBondContact O-OH 2.79Å; L689-A731 HydrophobicContact CD1-CB 4.07Å; L689-A734 HydrophobicContact CB-CB 4.45Å; L689-A734 VanDerWaalsContact O-CB 3.27Å; L689-A734 WeakPolarHBondContact O-CB 3.4Å
690	I	93.9	Very high	90.3	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-68.6	-46.5	175.5	-66.4	169.9	0	0	0	109.7	M655 Q686 G687 S692 A693 L694 L733 I737 F767 F770	M655-I690 HydrophobicContact CE-CB 4.5Å; M655-I690 HydrophobicContact CE-CG2 4.19Å; Q686-I690 HydrophobicContact CG-CD1 4.16Å; Q686-I690 WeakPolarHBondContact O-CG1 3.15Å; Q686-I690 PolarHBondContact O-N 3.16Å; G687-I690 PolarHBondContact O-N 3.04Å; I690-S692 VanDerWaalsContact C-N 3.31Å; I690-S692 PolarHBondContact O-N 2.99Å; I690-A693 WeakPolarHBondContact O-CB 3.5Å; I690-A693 PolarHBondContact O-N 2.94Å; I690-A693 VanDerWaalsContact O-N 3.14Å; I690-L694 HydrophobicContact CG2-CD1 4.24Å; I690-L694 HydrophobicContact CG2-CG 4.46Å; I690-L694 WeakPolarHBondContact O-CG 3.29Å; I690-L694 PolarHBondContact O-N 2.91Å; I690-L733 HydrophobicContact CD1-CD1 4.3Å; I690-L733 HydrophobicContact CG1-CB 4.49Å; I690-I737 HydrophobicContact CG2-CD1 4.12Å; I690-F767 HydrophobicContact CG2-CE1 3.91Å; I690-F767 HydrophobicContact CG2-CZ 3.92Å; I690-F770 HydrophobicContact CD1-CE1 4.03Å; I690-F770 HydrophobicContact CD1-CZ 3.79Å
691	A	93.5	Very high	89.6	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-60.1	-40	178.6	0	0	0	0	0	112.4	A654 L673 G687 A688 A693 L694 I695	A654-A691 WeakPolarHBondContact O-CB 3.36Å; L673-A691 HydrophobicContact CD1-CB 3.91Å; L673-A691 HydrophobicContact CD2-CB 4.1Å; G687-A691 VanDerWaalsContact O-CB 3.24Å; G687-A691 WeakPolarHBondContact O-CB 3.36Å; G687-A691 PolarHBondContact O-N 2.92Å; A688-A691 PolarHBondContact O-N 2.97Å; A691-A693 VanDerWaalsContact C-N 3.34Å; A691-A693 PolarHBondContact O-N 3.07Å; A691-L694 PolarHBondContact O-N 3Å; A691-I695 WeakPolarHBondContact O-CG1 3.24Å; A691-I695 PolarHBondContact O-N 3.46Å
692	S	92.2	Very high	88.7	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.007	10%	0.096	C	C	.	.	H	α-helix	trans	-63.4	-40	176	59.9	0	0	0	0	111.5	A688 L689 I690 I695 M696 Y714	A688-S692 WeakPolarHBondContact O-CB 3.27Å; A688-S692 PolarHBondContact O-N 3.46Å; A688-S692 PolarHBondContact O-OG 3.4Å; L689-S692 WeakPolarHBondContact CA-OG 3.41Å; L689-S692 PolarHBondContact O-OG 3.34Å; I690-S692 VanDerWaalsContact C-N 3.31Å; I690-S692 PolarHBondContact O-N 2.99Å; S692-I695 PolarHBondContact O-N 3.29Å; S692-M696 WeakPolarHBondContact O-CB 3.38Å; S692-M696 WeakPolarHBondContact O-CE 3.16Å; S692-M696 WeakPolarHBondContact O-CG 3.08Å; S692-M696 PolarHBondContact O-N 3.26Å; S692-M696 VanDerWaalsContact O-N 3.12Å; S692-Y714 PolarHBondContact OG-OH 3.21Å
693	A	91.8	Very high	87.8	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-65.4	-39.9	174.5	0	0	0	0	0	113.2	L689 I690 A691 I695 M696 I697 Y714 A734 I737	L689-A693 PolarHBondContact O-N 3.47Å; I690-A693 WeakPolarHBondContact O-CB 3.5Å; I690-A693 PolarHBondContact O-N 2.94Å; I690-A693 VanDerWaalsContact O-N 3.14Å; A691-A693 VanDerWaalsContact C-N 3.34Å; A691-A693 PolarHBondContact O-N 3.07Å; A693-I695 PolarHBondContact O-N 3.31Å; A693-M696 PolarHBondContact O-N 3.28Å; A693-I697 PolarHBondContact O-N 3.25Å; A693-I697 VanDerWaalsContact O-N 3.11Å; A693-Y714 PolarHBondContact N-OH 3.38Å; A693-A734 HydrophobicContact CB-CB 3.78Å; A693-A734 VanDerWaalsContact CB-O 3.3Å; A693-A734 WeakPolarHBondContact CB-O 3.24Å; A693-I737 HydrophobicContact CB-CB 4.13Å; A693-I737 HydrophobicContact CB-CG2 4.08Å
694	L	91.7	Very high	86.9	Confident	0 Å²	0	20 Å²	20	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-61.8	-42.2	176.4	-67.7	173.9	0	0	0	112.1	M655 A662 G663 I690 A691 I697 I737 I747 L764	M655-L694 HydrophobicContact SD-CD1 4.33Å; A662-L694 WeakPolarHBondContact CA-O 3.5Å; G663-L694 PolarHBondContact N-O 3.48Å; G663-L694 VanDerWaalsContact N-O 3.16Å; I690-L694 HydrophobicContact CG2-CD1 4.24Å; I690-L694 HydrophobicContact CG2-CG 4.46Å; I690-L694 WeakPolarHBondContact O-CG 3.29Å; I690-L694 PolarHBondContact O-N 2.91Å; A691-L694 PolarHBondContact O-N 3Å; L694-I697 WeakPolarHBondContact O-CG2 3.15Å; L694-I737 HydrophobicContact CD2-CD1 4.35Å; L694-I737 HydrophobicContact CD2-CG2 3.96Å; L694-I747 HydrophobicContact CD2-CD1 3.29Å; L694-L764 HydrophobicContact CD2-CD2 4.42Å
695	I	90.9	Very high	86.3	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-68	-38.1	179.3	-69.9	160.9	0	0	0	111.7	C661 G665 A669 I670 L673 A691 S692 A693	C661-I695 HydrophobicContact CB-CD1 4.42Å; C661-I695 HydrophobicContact CB-CG1 3.99Å; G665-I695 PolarHBondContact N-O 2.81Å; A669-I695 HydrophobicContact CB-CD1 4.04Å; I670-I695 HydrophobicContact CD1-CG2 4.23Å; I670-I695 HydrophobicContact CG1-CG2 3.98Å; L673-I695 HydrophobicContact CD1-CD1 3.5Å; L673-I695 VanDerWaalsContact CD1-CD1 3.5Å; A691-I695 WeakPolarHBondContact O-CG1 3.24Å; A691-I695 PolarHBondContact O-N 3.46Å; S692-I695 PolarHBondContact O-N 3.29Å; A693-I695 PolarHBondContact O-N 3.31Å
696	M	87.6	Confident	85.8	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	5.7	-173.8	-66.5	-176	-69.2	0	0	114.3	I670 S692 A693 Q698 Q699 V707 F710 L738	I670-M696 HydrophobicContact CD1-CG 4.33Å; S692-M696 WeakPolarHBondContact O-CB 3.38Å; S692-M696 WeakPolarHBondContact O-CE 3.16Å; S692-M696 WeakPolarHBondContact O-CG 3.08Å; S692-M696 PolarHBondContact O-N 3.26Å; S692-M696 VanDerWaalsContact O-N 3.12Å; A693-M696 PolarHBondContact O-N 3.28Å; M696-Q698 PolarHBondContact O-N 3.39Å; M696-Q699 WeakPolarHBondContact O-CB 3.32Å; M696-Q699 PolarHBondContact O-N 3.14Å; M696-V707 HydrophobicContact CB-CG2 4.29Å; M696-V707 HydrophobicContact CG-CG2 4.22Å; M696-V707 HydrophobicContact SD-CB 4.35Å; M696-V707 HydrophobicContact SD-CG2 3.81Å; M696-F710 HydrophobicContact CE-CB 3.64Å; M696-F710 HydrophobicContact CE-CD1 4.39Å; M696-F710 HydrophobicContact CE-CD2 3.55Å; M696-F710 HydrophobicContact CE-CE2 4.32Å; M696-F710 HydrophobicContact CE-CG 3.61Å; M696-F710 HydrophobicContact SD-CB 4.49Å; M696-F710 HydrophobicContact SD-CD2 3.85Å; M696-F710 HydrophobicContact SD-CG 4.44Å; M696-L738 HydrophobicContact CB-CD1 4.05Å; M696-L738 WeakPolarHBondContact O-CD1 3.28Å
697	I	87.3	Confident	85.3	Confident	3 Å²	3	23.9 Å²	23.9	2%	0.015	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	133.2	179.8	-162.1	168.8	0	0	0	110.6	A693 L694 Q699 I737 A740 I747 F784	A693-I697 PolarHBondContact O-N 3.25Å; A693-I697 VanDerWaalsContact O-N 3.11Å; L694-I697 WeakPolarHBondContact O-CG2 3.15Å; I697-Q699 PolarHBondContact O-N 3.17Å; I697-I737 HydrophobicContact CD1-CG2 4.38Å; I697-A740 HydrophobicContact CD1-CB 4.49Å; I697-I747 HydrophobicContact CD1-CD1 4Å; I697-I747 HydrophobicContact CD1-CG1 3.88Å; I697-F784 HydrophobicContact CD1-CD1 4.49Å; I697-F784 HydrophobicContact CD1-CE1 4.26Å
698	Q	82.1	Confident	85	Confident	13 Å²	13	26.2 Å²	26.2	6%	0.061	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	-4.9	-173.4	-57.8	-166.7	-26.3	0	0	117.7	M696 N744 V745 T787 R893 M895	M696-Q698 PolarHBondContact O-N 3.39Å; Q698-N744 PolarHBondContact NE2-O 3.09Å; Q698-N744 VanDerWaalsContact NE2-O 3.12Å; Q698-V745 WeakPolarHBondContact CG-O 3.44Å; Q698-V745 PolarHBondContact NE2-O 3.08Å; Q698-T787 PolarHBondContact NE2-OG1 3.41Å; Q698-T787 PolarHBondContact OE1-OG1 2.91Å; Q698-T787 VanDerWaalsContact OE1-OG1 3.12Å; Q698-R893 PolarHBondContact O-NH2 3.17Å; Q698-M895 WeakPolarHBondContact O-CE 3.47Å
699	Q	80.7	Confident	84.7	Confident	33 Å²	33	31.6 Å²	31.6	15%	0.154	16%	0.16	C	C	.	.			trans	-75.5	143.9	-177.7	-57.5	-149.7	-29.5	0	0	112.1	T664 M696 I697 V707	T664-Q699 PolarHBondContact O-NE2 2.91Å; T664-Q699 VanDerWaalsContact O-NE2 3.15Å; M696-Q699 WeakPolarHBondContact O-CB 3.32Å; M696-Q699 PolarHBondContact O-N 3.14Å; I697-Q699 PolarHBondContact O-N 3.17Å; Q699-V707 HydrophobicContact CB-CG2 4.39Å
700	T	78.8	Confident	84.3	Confident	8 Å²	8	31.8 Å²	31.8	5%	0.049	16%	0.16	C	C	.	.			trans	-98.8	170	-180	64.6	0	0	0	0	111.3	F702 T703 C704 T811 M895	T700-F702 PolarHBondContact O-N 3.25Å; T700-T703 PolarHBondContact N-OG1 2.99Å; T700-T703 VanDerWaalsContact N-OG1 3.14Å; T700-T703 PolarHBondContact O-N 3.35Å; T700-T703 PolarHBondContact O-OG1 2.81Å; T700-C704 PolarHBondContact O-N 3.44Å; T700-C704 VanDerWaalsContact O-N 3.11Å; T700-T811 PolarHBondContact OG1-O 3.22Å; T700-M895 HydrophobicContact CG2-CE 3.92Å
701	E	75.2	Confident	84	Confident	92 Å²	92	34.3 Å²	34.3	43%	0.43	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-30.8	176.2	-55	-179.4	179.7	0	0	112.6	C704 P705 N708	E701-C704 CarbonylContact O-C 3.38Å; E701-C704 VanDerWaalsContact O-C 3.26Å; E701-P705 WeakPolarHBondContact O-CA 3.5Å; E701-N708 WeakPolarHBondContact CG-ND2 3.38Å; E701-N708 PolarHBondContact OE1-ND2 2.91Å; E701-N708 PolarHBondContact OE1-OD1 2.94Å; E701-N708 VanDerWaalsContact OE1-OD1 3.13Å; E701-N708 PolarHBondContact OE2-ND2 3.43Å
702	F	74.5	Confident	83.8	Confident	153 Å²	153	41.1 Å²	41.1	67%	0.671	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-38	-178.6	-162.7	-90.7	0	0	0	111.9	T700 T811	T700-F702 PolarHBondContact O-N 3.25Å; F702-T811 HydrophobicContact CD1-CG2 3.94Å
703	T	73.3	Confident	83.7	Confident	55 Å²	55	43.4 Å²	43.4	34%	0.337	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-39.6	176.6	54.8	0	0	0	0	111.2	T700	T700-T703 PolarHBondContact N-OG1 2.99Å; T700-T703 VanDerWaalsContact N-OG1 3.14Å; T700-T703 PolarHBondContact O-N 3.35Å; T700-T703 PolarHBondContact O-OG1 2.81Å
704	C	72.8	Confident	83.7	Confident	4 Å²	4	43.5 Å²	43.5	3%	0.027	21%	0.214	C	C	.	.			trans	-146.3	112.4	175.4	-164.3	0	0	0	0	111.5	T700 E701 K706 V707	T700-C704 PolarHBondContact O-N 3.44Å; T700-C704 VanDerWaalsContact O-N 3.11Å; E701-C704 CarbonylContact O-C 3.38Å; E701-C704 VanDerWaalsContact O-C 3.26Å; C704-K706 PolarHBondContact O-N 3.43Å; C704-V707 HydrophobicContact CB-CG2 4.26Å; C704-V707 WeakPolarHBondContact O-CG2 3.49Å; C704-V707 PolarHBondContact O-N 3.42Å
705	P	79.6	Confident	83.5	Confident	90 Å²	90	45.2 Å²	45.2	58%	0.584	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-20.4	177.9	-26.5	35.1	0	0	0	114.2	E701 V707	E701-P705 WeakPolarHBondContact O-CA 3.5Å; P705-V707 PolarHBondContact O-N 2.81Å
706	K	83	Confident	83.6	Confident	42 Å²	42	51.9 Å²	51.9	18%	0.183	26%	0.257	C	S	.	.	H	α-helix	trans	-69.5	-18.7	-178.2	-64.6	-172.6	170.9	-166.7	0	113.3	I670 N671 E674 C704 N708 Q709 F710	I670-K706 HydrophobicContact CG2-CB 4.45Å; I670-K706 HydrophobicContact CG2-CD 3.46Å; I670-K706 VanDerWaalsContact CG2-CD 3.46Å; N671-K706 PolarHBondContact OD1-NZ 3.44Å; E674-K706 VanDerWaalsContact OE1-CD 3.28Å; E674-K706 WeakPolarHBondContact OE1-CD 3.4Å; E674-K706 WeakPolarHBondContact OE1-CE 3.4Å; E674-K706 IonicContact OE1-NZ 3.86Å; E674-K706 PolarHBondContact OE1-NZ 3.46Å; E674-K706 IonicContact OE2-NZ 2.72Å; E674-K706 PolarHBondContact OE2-NZ 2.92Å; C704-K706 PolarHBondContact O-N 3.43Å; K706-N708 VanDerWaalsContact C-N 3.26Å; K706-N708 PolarHBondContact O-N 2.91Å; K706-Q709 WeakPolarHBondContact O-CB 3.2Å; K706-Q709 PolarHBondContact O-N 3.34Å; K706-F710 HydrophobicContact CB-CD2 4.19Å; K706-F710 HydrophobicContact CB-CE2 4.24Å; K706-F710 WeakPolarHBondContact O-CD2 3.46Å; K706-F710 PolarHBondContact O-N 2.86Å
707	V	83.1	Confident	83.6	Confident	3 Å²	3	52.5 Å²	52.5	2%	0.018	26%	0.261	C	S	.	.	H	α-helix	trans	-55.4	-43.1	178.8	177.2	0	0	0	0	111.3	M696 Q699 C704 P705 F710 R711 L738	M696-V707 HydrophobicContact CB-CG2 4.29Å; M696-V707 HydrophobicContact CG-CG2 4.22Å; M696-V707 HydrophobicContact SD-CB 4.35Å; M696-V707 HydrophobicContact SD-CG2 3.81Å; Q699-V707 HydrophobicContact CB-CG2 4.39Å; C704-V707 HydrophobicContact CB-CG2 4.26Å; C704-V707 WeakPolarHBondContact O-CG2 3.49Å; C704-V707 PolarHBondContact O-N 3.42Å; P705-V707 PolarHBondContact O-N 2.81Å; V707-F710 PolarHBondContact O-N 2.89Å; V707-R711 WeakPolarHBondContact O-CG 3.25Å; V707-R711 PolarHBondContact O-N 2.91Å; V707-L738 HydrophobicContact CG1-CD2 4.5Å
708	N	84.8	Confident	83.7	Confident	51 Å²	51	52.9 Å²	52.9	27%	0.273	26%	0.263	S	S	.	.	H	α-helix	trans	-68.7	-37.6	177.6	-82.5	-7.9	0	0	0	113.3	E701 K706 R711 Q712	E701-N708 WeakPolarHBondContact CG-ND2 3.38Å; E701-N708 PolarHBondContact OE1-ND2 2.91Å; E701-N708 PolarHBondContact OE1-OD1 2.94Å; E701-N708 VanDerWaalsContact OE1-OD1 3.13Å; E701-N708 PolarHBondContact OE2-ND2 3.43Å; K706-N708 VanDerWaalsContact C-N 3.26Å; K706-N708 PolarHBondContact O-N 2.91Å; N708-R711 PolarHBondContact O-N 2.91Å; N708-Q712 WeakPolarHBondContact O-CB 3.45Å; N708-Q712 VanDerWaalsContact O-CG 3.31Å; N708-Q712 WeakPolarHBondContact O-CG 3.47Å; N708-Q712 PolarHBondContact O-N 2.67Å
709	Q	87.3	Confident	84	Confident	113 Å²	113	57.1 Å²	57.1	53%	0.528	29%	0.286	S	S	.	.	H	α-helix	trans	-62.9	-45.5	177.3	-62.3	178.8	-6.8	0	0	110.5	K706 Q712 L713	K706-Q709 WeakPolarHBondContact O-CB 3.2Å; K706-Q709 PolarHBondContact O-N 3.34Å; Q709-Q712 PolarHBondContact O-N 3.48Å; Q709-L713 WeakPolarHBondContact O-CB 3.21Å; Q709-L713 PolarHBondContact O-N 2.86Å
710	F	87.3	Confident	84.4	Confident	7 Å²	7	58.2 Å²	58.2	3%	0.031	29%	0.293	C	S	.	.	H	α-helix	trans	-68.2	-37.7	176.2	-80.3	-75.9	0	0	0	112.9	I670 E674 M696 K706 V707 Q712 L713 Y714	I670-F710 HydrophobicContact CG2-CE2 3.7Å; I670-F710 HydrophobicContact CG2-CZ 4.23Å; E674-F710 HydrophobicContact CG-CZ 4.11Å; M696-F710 HydrophobicContact CE-CB 3.64Å; M696-F710 HydrophobicContact CE-CD1 4.39Å; M696-F710 HydrophobicContact CE-CD2 3.55Å; M696-F710 HydrophobicContact CE-CE2 4.32Å; M696-F710 HydrophobicContact CE-CG 3.61Å; M696-F710 HydrophobicContact SD-CB 4.49Å; M696-F710 HydrophobicContact SD-CD2 3.85Å; M696-F710 HydrophobicContact SD-CG 4.44Å; K706-F710 HydrophobicContact CB-CD2 4.19Å; K706-F710 HydrophobicContact CB-CE2 4.24Å; K706-F710 WeakPolarHBondContact O-CD2 3.46Å; K706-F710 PolarHBondContact O-N 2.86Å; V707-F710 PolarHBondContact O-N 2.89Å; F710-Q712 VanDerWaalsContact C-N 3.34Å; F710-Q712 PolarHBondContact O-N 2.77Å; F710-L713 HydrophobicContact CD1-CD2 4.11Å; F710-L713 HydrophobicContact CE1-CD2 4.34Å; F710-L713 WeakPolarHBondContact O-CB 3.37Å; F710-L713 PolarHBondContact O-N 2.92Å; F710-L713 VanDerWaalsContact O-N 3.14Å; F710-Y714 HydrophobicContact CB-CE1 4.36Å; F710-Y714 HydrophobicContact CB-CE2 4.32Å; F710-Y714 HydrophobicContact CD1-CE1 4.3Å; F710-Y714 WeakPolarHBondContact O-CD1 3.46Å; F710-Y714 WeakPolarHBondContact O-CD2 3.43Å; F710-Y714 PolarHBondContact O-N 3.47Å
711	R	86.8	Confident	84.6	Confident	53 Å²	53	65.9 Å²	65.9	20%	0.2	33%	0.325	C	S	.	.	H	α-helix	trans	-59.3	-45	173	-80.8	-176.5	167.8	-173.4	-3.2	112.1	V707 N708 L713 Y714 A715 L738 D739 R743	V707-R711 WeakPolarHBondContact O-CG 3.25Å; V707-R711 PolarHBondContact O-N 2.91Å; N708-R711 PolarHBondContact O-N 2.91Å; R711-L713 VanDerWaalsContact C-N 3.31Å; R711-Y714 PolarHBondContact O-N 2.86Å; R711-A715 PolarHBondContact O-N 3.37Å; R711-A715 VanDerWaalsContact O-N 3.12Å; R711-L738 HydrophobicContact CG-CD2 3.57Å; R711-L738 VanDerWaalsContact NE-CD2 3.3Å; R711-D739 IonicContact CZ-OD1 2.75Å; R711-D739 IonicContact NH2-OD1 3.14Å; R711-D739 PolarHBondContact NH2-OD1 3.13Å; R711-R743 VanDerWaalsContact NH2-NH2 3.17Å
712	Q	88.6	Confident	85.1	Confident	142 Å²	142	69.7 Å²	69.7	66%	0.664	34%	0.343	S	S	*	.	H	α-helix	trans	-63.6	-38.9	174.4	-71.2	175.4	7.6	0	0	111.5	N708 Q709 F710 A715 K716	N708-Q712 WeakPolarHBondContact O-CB 3.45Å; N708-Q712 VanDerWaalsContact O-CG 3.31Å; N708-Q712 WeakPolarHBondContact O-CG 3.47Å; N708-Q712 PolarHBondContact O-N 2.67Å; Q709-Q712 PolarHBondContact O-N 3.48Å; F710-Q712 VanDerWaalsContact C-N 3.34Å; F710-Q712 PolarHBondContact O-N 2.77Å; Q712-A715 PolarHBondContact O-N 3.37Å; Q712-K716 WeakPolarHBondContact O-CB 3.43Å; Q712-K716 PolarHBondContact O-N 2.86Å
713	L	90.7	Very high	85.6	Confident	50 Å²	50	63.9 Å²	63.9	26%	0.262	32%	0.319	S	S	.	.	H	α-helix	trans	-63.7	-44.9	176.7	-172.5	63	0	0	0	112.1	T677 L689 Q709 F710 R711 A715 K716 V717	T677-L713 HydrophobicContact CG2-CD2 3.59Å; L689-L713 HydrophobicContact CD2-CD2 4.19Å; Q709-L713 WeakPolarHBondContact O-CB 3.21Å; Q709-L713 PolarHBondContact O-N 2.86Å; F710-L713 HydrophobicContact CD1-CD2 4.11Å; F710-L713 HydrophobicContact CE1-CD2 4.34Å; F710-L713 WeakPolarHBondContact O-CB 3.37Å; F710-L713 PolarHBondContact O-N 2.92Å; F710-L713 VanDerWaalsContact O-N 3.14Å; R711-L713 VanDerWaalsContact C-N 3.31Å; L713-A715 PolarHBondContact O-N 3.47Å; L713-K716 WeakPolarHBondContact O-CB 3.2Å; L713-K716 PolarHBondContact O-N 3.07Å; L713-V717 HydrophobicContact CD1-CG2 4.47Å; L713-V717 WeakPolarHBondContact O-CG2 3.44Å; L713-V717 PolarHBondContact O-N 2.91Å
714	Y	90.9	Very high	86.4	Confident	1 Å²	1	64.3 Å²	64.3	0%	0.004	32%	0.319	C	S	.	.	H	α-helix	trans	-58.8	-48.3	175.7	-55.8	-28.8	0	0	0	110.8	L689 S692 A693 F710 R711 K716 V717 I718 A734 Q735 L738	L689-Y714 HydrophobicContact CB-CE1 4.13Å; L689-Y714 HydrophobicContact CD2-CD1 3.83Å; L689-Y714 HydrophobicContact CD2-CE1 3.64Å; L689-Y714 HydrophobicContact CG-CE1 4.45Å; L689-Y714 PolarHBondContact O-OH 2.79Å; S692-Y714 PolarHBondContact OG-OH 3.21Å; A693-Y714 PolarHBondContact N-OH 3.38Å; F710-Y714 HydrophobicContact CB-CE1 4.36Å; F710-Y714 HydrophobicContact CB-CE2 4.32Å; F710-Y714 HydrophobicContact CD1-CE1 4.3Å; F710-Y714 WeakPolarHBondContact O-CD1 3.46Å; F710-Y714 WeakPolarHBondContact O-CD2 3.43Å; F710-Y714 PolarHBondContact O-N 3.47Å; R711-Y714 PolarHBondContact O-N 2.86Å; Y714-K716 VanDerWaalsContact C-N 3.31Å; Y714-K716 PolarHBondContact O-N 3.17Å; Y714-V717 PolarHBondContact O-N 3.22Å; Y714-I718 WeakPolarHBondContact O-CB 3.19Å; Y714-I718 WeakPolarHBondContact O-CD1 3.44Å; Y714-I718 WeakPolarHBondContact O-CG1 3.4Å; Y714-I718 PolarHBondContact O-N 3.03Å; Y714-A734 HydrophobicContact CD1-CB 4.1Å; Y714-A734 HydrophobicContact CD2-CB 4.24Å; Y714-A734 HydrophobicContact CE1-CB 3.77Å; Y714-A734 HydrophobicContact CE2-CB 3.92Å; Y714-A734 HydrophobicContact CG-CB 4.34Å; Y714-Q735 HydrophobicContact CD2-CG 4.01Å; Y714-Q735 HydrophobicContact CG-CG 4.3Å; Y714-L738 HydrophobicContact CE2-CD2 4.31Å
715	A	89.3	Confident	87.1	Confident	36 Å²	36	66.7 Å²	66.7	30%	0.298	33%	0.333	S	S	.	.	H	α-helix	trans	-62.4	-37.6	177.4	0	0	0	0	0	112.4	R711 Q712 L713 N719	R711-A715 PolarHBondContact O-N 3.37Å; R711-A715 VanDerWaalsContact O-N 3.12Å; Q712-A715 PolarHBondContact O-N 3.37Å; L713-A715 PolarHBondContact O-N 3.47Å; A715-N719 WeakPolarHBondContact O-CB 3.39Å; A715-N719 VanDerWaalsContact O-CG 3.29Å; A715-N719 PolarHBondContact O-N 3.42Å; A715-N719 VanDerWaalsContact O-N 3.1Å; A715-N719 PolarHBondContact O-ND2 3.4Å
716	K	91.2	Very high	87.5	Confident	140 Å²	140	67 Å²	67	61%	0.609	33%	0.328	S	S	*	.	H	α-helix	trans	-62.5	-51.6	176.7	-176.9	-178.2	176.6	-174.4	0	111.4	Q712 L713 Y714 I718 N719 D720	Q712-K716 WeakPolarHBondContact O-CB 3.43Å; Q712-K716 PolarHBondContact O-N 2.86Å; L713-K716 WeakPolarHBondContact O-CB 3.2Å; L713-K716 PolarHBondContact O-N 3.07Å; Y714-K716 VanDerWaalsContact C-N 3.31Å; Y714-K716 PolarHBondContact O-N 3.17Å; K716-I718 VanDerWaalsContact C-N 3.31Å; K716-I718 PolarHBondContact O-N 3.46Å; K716-N719 PolarHBondContact O-N 2.97Å; K716-D720 WeakPolarHBondContact O-CB 3.4Å; K716-D720 PolarHBondContact O-N 3.3Å
717	V	89.3	Confident	87.8	Confident	14 Å²	14	65 Å²	65	9%	0.085	32%	0.32	C	S	.	.	H	α-helix	trans	-64.3	-35.8	-178.6	173.5	0	0	0	0	111.8	L713 Y714 D723 A727 K728 A731	L713-V717 HydrophobicContact CD1-CG2 4.47Å; L713-V717 WeakPolarHBondContact O-CG2 3.44Å; L713-V717 PolarHBondContact O-N 2.91Å; Y714-V717 PolarHBondContact O-N 3.22Å; V717-D723 HydrophobicContact CG1-CB 4.09Å; V717-A727 HydrophobicContact CG1-CB 4.39Å; V717-K728 HydrophobicContact CG1-CG 4.31Å; V717-K728 WeakPolarHBondContact O-CE 3.35Å; V717-K728 WeakPolarHBondContact O-CG 3.18Å; V717-A731 HydrophobicContact CB-CB 4.26Å; V717-A731 HydrophobicContact CG1-CB 4.11Å
718	I	88.8	Confident	88.1	Confident	10 Å²	10	66.1 Å²	66.1	5%	0.051	32%	0.324	C	S	.	.	H	α-helix	trans	-67.4	-42.8	177.5	-69.4	166.6	0	0	0	111.2	T357 A360 Y714 K716 A731 I732 Q735	T357-I718 HydrophobicContact CG2-CG2 4.29Å; A360-I718 HydrophobicContact CB-CG2 3.9Å; Y714-I718 WeakPolarHBondContact O-CB 3.19Å; Y714-I718 WeakPolarHBondContact O-CD1 3.44Å; Y714-I718 WeakPolarHBondContact O-CG1 3.4Å; Y714-I718 PolarHBondContact O-N 3.03Å; K716-I718 VanDerWaalsContact C-N 3.31Å; K716-I718 PolarHBondContact O-N 3.46Å; I718-A731 HydrophobicContact CD1-CB 4.12Å; I718-A731 HydrophobicContact CG1-CB 3.76Å; I718-I732 HydrophobicContact CD1-CG1 3.79Å; I718-I732 HydrophobicContact CG1-CG1 3.84Å; I718-Q735 VanDerWaalsContact CD1-CD 3.47Å; I718-Q735 HydrophobicContact CD1-CG 4.37Å
719	N	88.5	Confident	88.4	Confident	103 Å²	103	63.8 Å²	63.8	55%	0.551	31%	0.312	S	S	*	.	H	α-helix	trans	-78.7	-28.7	-177.8	-72.5	-36.8	0	0	0	113.3	A715 K716 K721	A715-N719 WeakPolarHBondContact O-CB 3.39Å; A715-N719 VanDerWaalsContact O-CG 3.29Å; A715-N719 PolarHBondContact O-N 3.42Å; A715-N719 VanDerWaalsContact O-N 3.1Å; A715-N719 PolarHBondContact O-ND2 3.4Å; K716-N719 PolarHBondContact O-N 2.97Å; N719-K721 PolarHBondContact O-N 2.84Å
720	D	88.3	Confident	88.5	Confident	55 Å²	55	58.4 Å²	58.4	29%	0.294	29%	0.286	S	S	.	.			trans	-68.5	130.1	179.8	-162.3	-19.9	0	0	0	110.5	K716 H722 K728	K716-D720 WeakPolarHBondContact O-CB 3.4Å; K716-D720 PolarHBondContact O-N 3.3Å; D720-H722 VanDerWaalsContact C-N 3.35Å; D720-H722 WeakPolarHBondContact OD1-CB 3.3Å; D720-H722 IonicContact OD1-CD2 2.78Å; D720-H722 PolarHBondContact OD1-CD2 3.08Å; D720-H722 VanDerWaalsContact OD1-CD2 3.27Å; D720-H722 IonicContact OD1-CG 3.62Å; D720-H722 PolarHBondContact OD1-N 3.13Å; D720-K728 WeakPolarHBondContact O-CE 3.19Å; D720-K728 PolarHBondContact O-NZ 3.35Å
721	K	83.4	Confident	88.8	Confident	169 Å²	169	58 Å²	58	74%	0.735	29%	0.285	S	S	*	.	S	Bend	trans	-77.5	-25	175.8	-69.5	179.6	-176.6	171	0	112.2	N719 K728	N719-K721 PolarHBondContact O-N 2.84Å; K721-K728 PolarHBondContact O-NZ 3.22Å
722	H	85.5	Confident	89	Confident	173 Å²	173	55.5 Å²	55.5	80%	0.801	28%	0.275	S	S	*	.	S	Bend	trans	-80.1	-16.7	-174.1	-60.5	-66.1	0	0	0	113.6	D720	D720-H722 VanDerWaalsContact C-N 3.35Å; D720-H722 WeakPolarHBondContact OD1-CB 3.3Å; D720-H722 IonicContact OD1-CD2 2.78Å; D720-H722 PolarHBondContact OD1-CD2 3.08Å; D720-H722 VanDerWaalsContact OD1-CD2 3.27Å; D720-H722 IonicContact OD1-CG 3.62Å; D720-H722 PolarHBondContact OD1-N 3.13Å
723	D	85.5	Confident	89.2	Confident	30 Å²	30	48.8 Å²	48.8	16%	0.16	24%	0.244	C	C	.	.	S	Bend	trans	-75	148.7	174.7	-85.5	-50.2	0	0	0	113.2	R685 V717 K728	R685-D723 IonicContact CZ-OD1 3.82Å; R685-D723 IonicContact NH1-OD1 2.91Å; R685-D723 PolarHBondContact NH1-OD1 3.4Å; R685-D723 IonicContact NH2-OD1 3.8Å; V717-D723 HydrophobicContact CG1-CB 4.09Å; D723-K728 WeakPolarHBondContact O-CE 3.16Å; D723-K728 PolarHBondContact O-NZ 3.05Å
724	D	88.9	Confident	89.3	Confident	65 Å²	65	46.4 Å²	46.4	35%	0.348	23%	0.231	S	C	.	.			trans	-64	148.4	-179.2	-64.8	-59.6	0	0	0	112.7	N682 R685 M726 A727 K728	N682-D724 HydrophobicContact CB-CB 3.9Å; N682-D724 WeakPolarHBondContact CB-OD2 3.32Å; R685-D724 IonicContact CZ-OD2 3.39Å; R685-D724 IonicContact NH2-OD2 3.9Å; R685-D724 PolarHBondContact NH2-OD2 3.24Å; D724-M726 VanDerWaalsContact C-N 3.26Å; D724-M726 PolarHBondContact O-N 3.02Å; D724-A727 HydrophobicContact CB-CB 4.34Å; D724-A727 PolarHBondContact O-N 3.13Å; D724-K728 WeakPolarHBondContact O-CG 3.24Å; D724-K728 PolarHBondContact O-N 2.8Å
725	V	89.4	Confident	89.2	Confident	53 Å²	53	47.4 Å²	47.4	32%	0.321	24%	0.236	S	C	.	.	H	α-helix	trans	-60.6	-35.8	177.5	-177.5	0	0	0	0	112	N363 V365 K728 F729	N363-V725 WeakPolarHBondContact ND2-CG2 3.4Å; V365-V725 HydrophobicContact CB-CG1 3.95Å; V365-V725 HydrophobicContact CG1-CG1 4.08Å; V725-K728 PolarHBondContact O-N 3.46Å; V725-F729 PolarHBondContact O-N 3.14Å
726	M	86.9	Confident	89.3	Confident	96 Å²	96	45.7 Å²	45.7	47%	0.473	22%	0.222	S	C	.	.	H	α-helix	trans	-68.7	-42.1	178	-66.5	-179.9	-175	0	0	112.2	N682 Q686 D724 K728 F729 G730	N682-M726 HydrophobicContact CB-CB 4.47Å; Q686-M726 WeakPolarHBondContact CG-O 3.43Å; D724-M726 VanDerWaalsContact C-N 3.26Å; D724-M726 PolarHBondContact O-N 3.02Å; M726-K728 VanDerWaalsContact C-N 3.34Å; M726-F729 WeakPolarHBondContact O-CB 3.45Å; M726-F729 PolarHBondContact O-N 3.16Å; M726-G730 PolarHBondContact O-N 2.71Å
727	A	88.9	Confident	89.3	Confident	1 Å²	1	39 Å²	39	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-64.7	-40.5	175.5	0	0	0	0	0	111.1	R685 V717 D724 F729 G730 A731	R685-A727 HydrophobicContact CB-CB 4.46Å; V717-A727 HydrophobicContact CG1-CB 4.39Å; D724-A727 HydrophobicContact CB-CB 4.34Å; D724-A727 PolarHBondContact O-N 3.13Å; A727-F729 PolarHBondContact O-N 2.86Å; A727-G730 PolarHBondContact O-N 3.05Å; A727-A731 PolarHBondContact O-N 3Å
728	K	90.6	Very high	89.4	Confident	26 Å²	26	38.7 Å²	38.7	11%	0.113	19%	0.191	C	C	.	.	H	α-helix	trans	-60.3	-43.3	172.6	-75.2	169.1	174.4	155.9	0	112.8	V717 D720 K721 D723 D724 V725 M726 G730 A731 I732	V717-K728 HydrophobicContact CG1-CG 4.31Å; V717-K728 WeakPolarHBondContact O-CE 3.35Å; V717-K728 WeakPolarHBondContact O-CG 3.18Å; D720-K728 WeakPolarHBondContact O-CE 3.19Å; D720-K728 PolarHBondContact O-NZ 3.35Å; K721-K728 PolarHBondContact O-NZ 3.22Å; D723-K728 WeakPolarHBondContact O-CE 3.16Å; D723-K728 PolarHBondContact O-NZ 3.05Å; D724-K728 WeakPolarHBondContact O-CG 3.24Å; D724-K728 PolarHBondContact O-N 2.8Å; V725-K728 PolarHBondContact O-N 3.46Å; M726-K728 VanDerWaalsContact C-N 3.34Å; K728-G730 VanDerWaalsContact C-N 3.29Å; K728-G730 PolarHBondContact O-N 2.65Å; K728-A731 PolarHBondContact O-N 2.87Å; K728-I732 VanDerWaalsContact O-CG1 3.26Å; K728-I732 WeakPolarHBondContact O-CG1 2.94Å; K728-I732 PolarHBondContact O-N 2.71Å
729	F	90.3	Very high	89.4	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.009	19%	0.189	C	C	.	.	H	α-helix	trans	-58	-45.2	175	-177.7	-82.5	0	0	0	110.8	V365 A369 V725 M726 A727 I732 L733 F770 F774	V365-F729 HydrophobicContact CG1-CB 4.46Å; V365-F729 HydrophobicContact CG1-CD2 3.67Å; V365-F729 HydrophobicContact CG1-CE2 4.38Å; V365-F729 HydrophobicContact CG1-CG 4.41Å; A369-F729 HydrophobicContact CB-CD2 3.48Å; A369-F729 VanDerWaalsContact CB-CD2 3.48Å; A369-F729 HydrophobicContact CB-CE2 3.81Å; A369-F729 HydrophobicContact CB-CG 4.12Å; V725-F729 PolarHBondContact O-N 3.14Å; M726-F729 WeakPolarHBondContact O-CB 3.45Å; M726-F729 PolarHBondContact O-N 3.16Å; A727-F729 PolarHBondContact O-N 2.86Å; F729-I732 PolarHBondContact O-N 3.14Å; F729-L733 HydrophobicContact CD1-CD1 3.81Å; F729-L733 HydrophobicContact CD1-CG 4.19Å; F729-L733 HydrophobicContact CE1-CD1 3.21Å; F729-L733 HydrophobicContact CE1-CG 3.93Å; F729-L733 HydrophobicContact CZ-CD1 3.8Å; F729-L733 HydrophobicContact CZ-CG 4.33Å; F729-L733 WeakPolarHBondContact O-CG 3.23Å; F729-L733 PolarHBondContact O-N 3.34Å; F729-F770 HydrophobicContact CE1-CD2 4.09Å; F729-F770 HydrophobicContact CE1-CE2 4.26Å; F729-F774 HydrophobicContact CE2-CD1 4.08Å; F729-F774 HydrophobicContact CE2-CE1 4.21Å; F729-F774 AromaticContact CZ-CD1 3.88Å; F729-F774 HydrophobicContact CZ-CD1 3.88Å; F729-F774 HydrophobicContact CZ-CE1 4.19Å
730	G	90.4	Very high	89.4	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-60.2	-44.3	174.3	0	0	0	0	0	113.4	M726 A727 K728 I732 L733 A734	M726-G730 PolarHBondContact O-N 2.71Å; A727-G730 PolarHBondContact O-N 3.05Å; K728-G730 VanDerWaalsContact C-N 3.29Å; K728-G730 PolarHBondContact O-N 2.65Å; G730-I732 PolarHBondContact O-N 2.96Å; G730-L733 PolarHBondContact O-N 3.47Å; G730-A734 WeakPolarHBondContact O-CB 3.25Å; G730-A734 PolarHBondContact O-N 3.45Å
731	A	91.7	Very high	89.2	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.3	-40.6	178.5	0	0	0	0	0	112.9	L689 V717 I718 A727 K728 A734 Q735	L689-A731 HydrophobicContact CD1-CB 4.07Å; V717-A731 HydrophobicContact CB-CB 4.26Å; V717-A731 HydrophobicContact CG1-CB 4.11Å; I718-A731 HydrophobicContact CD1-CB 4.12Å; I718-A731 HydrophobicContact CG1-CB 3.76Å; A727-A731 PolarHBondContact O-N 3Å; K728-A731 PolarHBondContact O-N 2.87Å; A731-A734 PolarHBondContact O-N 2.8Å; A731-Q735 PolarHBondContact O-N 3.05Å; A731-Q735 VanDerWaalsContact O-N 3.09Å
732	I	92.2	Very high	89.1	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-67.6	-45.4	178.2	-64.8	166.4	0	0	0	110.4	T357 V361 C366 A369 A373 I718 K728 F729 G730 A734 Q735 G736	T357-I732 HydrophobicContact CG2-CD1 4.21Å; T357-I732 HydrophobicContact CG2-CG1 3.85Å; T357-I732 HydrophobicContact CG2-CG2 4.09Å; V361-I732 HydrophobicContact CG2-CD1 3.79Å; C366-I732 HydrophobicContact CB-CD1 4.15Å; A369-I732 HydrophobicContact CB-CB 3.96Å; A369-I732 HydrophobicContact CB-CD1 3.99Å; A369-I732 HydrophobicContact CB-CG2 3.79Å; A369-I732 WeakPolarHBondContact O-CG2 3.2Å; A373-I732 HydrophobicContact CB-CG2 3.72Å; A373-I732 WeakPolarHBondContact CB-O 3.32Å; I718-I732 HydrophobicContact CD1-CG1 3.79Å; I718-I732 HydrophobicContact CG1-CG1 3.84Å; K728-I732 VanDerWaalsContact O-CG1 3.26Å; K728-I732 WeakPolarHBondContact O-CG1 2.94Å; K728-I732 PolarHBondContact O-N 2.71Å; F729-I732 PolarHBondContact O-N 3.14Å; G730-I732 PolarHBondContact O-N 2.96Å; I732-A734 VanDerWaalsContact C-N 3.32Å; I732-A734 PolarHBondContact O-N 2.79Å; I732-Q735 PolarHBondContact O-N 3.08Å; I732-G736 PolarHBondContact O-N 3.49Å; I732-G736 VanDerWaalsContact O-N 3.1Å
733	L	92.1	Very high	89.1	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-62.8	-40.4	174.8	-71.3	-170.8	0	0	0	111.8	I372 F376 I690 F729 G730 Q735 G736 I737	I372-L733 HydrophobicContact CB-CD2 3.88Å; I372-L733 HydrophobicContact CG2-CD2 3.49Å; I372-L733 VanDerWaalsContact CG2-CD2 3.49Å; F376-L733 HydrophobicContact CE2-CD2 4.08Å; I690-L733 HydrophobicContact CD1-CD1 4.3Å; I690-L733 HydrophobicContact CG1-CB 4.49Å; F729-L733 HydrophobicContact CD1-CD1 3.81Å; F729-L733 HydrophobicContact CD1-CG 4.19Å; F729-L733 HydrophobicContact CE1-CD1 3.21Å; F729-L733 HydrophobicContact CE1-CG 3.93Å; F729-L733 HydrophobicContact CZ-CD1 3.8Å; F729-L733 HydrophobicContact CZ-CG 4.33Å; F729-L733 WeakPolarHBondContact O-CG 3.23Å; F729-L733 PolarHBondContact O-N 3.34Å; G730-L733 PolarHBondContact O-N 3.47Å; L733-Q735 VanDerWaalsContact C-N 3.31Å; L733-Q735 PolarHBondContact O-N 3.23Å; L733-G736 PolarHBondContact O-N 2.96Å; L733-G736 VanDerWaalsContact O-N 3.09Å; L733-I737 VanDerWaalsContact O-CG1 3.28Å; L733-I737 WeakPolarHBondContact O-CG1 3.45Å; L733-I737 PolarHBondContact O-N 3Å
734	A	92.5	Very high	89.2	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-59.5	-39.9	177.6	0	0	0	0	0	112.3	L689 A693 Y714 G730 A731 I732 L738	L689-A734 HydrophobicContact CB-CB 4.45Å; L689-A734 VanDerWaalsContact O-CB 3.27Å; L689-A734 WeakPolarHBondContact O-CB 3.4Å; A693-A734 HydrophobicContact CB-CB 3.78Å; A693-A734 VanDerWaalsContact CB-O 3.3Å; A693-A734 WeakPolarHBondContact CB-O 3.24Å; Y714-A734 HydrophobicContact CD1-CB 4.1Å; Y714-A734 HydrophobicContact CD2-CB 4.24Å; Y714-A734 HydrophobicContact CE1-CB 3.77Å; Y714-A734 HydrophobicContact CE2-CB 3.92Å; Y714-A734 HydrophobicContact CG-CB 4.34Å; G730-A734 WeakPolarHBondContact O-CB 3.25Å; G730-A734 PolarHBondContact O-N 3.45Å; A731-A734 PolarHBondContact O-N 2.8Å; I732-A734 VanDerWaalsContact C-N 3.32Å; I732-A734 PolarHBondContact O-N 2.79Å; A734-L738 VanDerWaalsContact O-CB 3.32Å; A734-L738 WeakPolarHBondContact O-CB 3.28Å; A734-L738 PolarHBondContact O-N 3.17Å
735	Q	90.2	Very high	89.2	Confident	23 Å²	23	10.9 Å²	10.9	11%	0.107	6%	0.055	C	C	.	.	H	α-helix	trans	-62.7	-46.9	171.2	-72.6	-177.7	-13.7	0	0	111.7	T357 Y714 I718 A731 I732 L733 I737 L738 D739	T357-Q735 PolarHBondContact OG1-OE1 3.04Å; T357-Q735 VanDerWaalsContact OG1-OE1 3.09Å; Y714-Q735 HydrophobicContact CD2-CG 4.01Å; Y714-Q735 HydrophobicContact CG-CG 4.3Å; I718-Q735 VanDerWaalsContact CD1-CD 3.47Å; I718-Q735 HydrophobicContact CD1-CG 4.37Å; A731-Q735 PolarHBondContact O-N 3.05Å; A731-Q735 VanDerWaalsContact O-N 3.09Å; I732-Q735 PolarHBondContact O-N 3.08Å; L733-Q735 VanDerWaalsContact C-N 3.31Å; L733-Q735 PolarHBondContact O-N 3.23Å; Q735-I737 VanDerWaalsContact C-N 3.32Å; Q735-I737 PolarHBondContact O-N 2.98Å; Q735-L738 PolarHBondContact O-N 3.19Å; Q735-D739 PolarHBondContact O-N 3.32Å
736	G	90.6	Very high	89.2	Confident	0 Å²	0	9 Å²	9	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-61	-38.6	179.7	0	0	0	0	0	113.7	F376 I732 L733 A740	F376-G736 WeakPolarHBondContact CB-O 3.24Å; I732-G736 PolarHBondContact O-N 3.49Å; I732-G736 VanDerWaalsContact O-N 3.1Å; L733-G736 PolarHBondContact O-N 2.96Å; L733-G736 VanDerWaalsContact O-N 3.09Å; G736-A740 WeakPolarHBondContact O-CA 3.48Å; G736-A740 PolarHBondContact O-N 3.46Å; G736-A740 VanDerWaalsContact O-N 3.16Å
737	I	92.1	Very high	89.4	Confident	0 Å²	0	4.6 Å²	4.6	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-70.7	-42.4	177.2	-66.9	171.4	0	0	0	111	F376 I690 A693 L694 I697 L733 Q735 D739 A740 I747 F767 L780	F376-I737 HydrophobicContact CD2-CG1 3.99Å; F376-I737 HydrophobicContact CE2-CG1 4.22Å; I690-I737 HydrophobicContact CG2-CD1 4.12Å; A693-I737 HydrophobicContact CB-CB 4.13Å; A693-I737 HydrophobicContact CB-CG2 4.08Å; L694-I737 HydrophobicContact CD2-CD1 4.35Å; L694-I737 HydrophobicContact CD2-CG2 3.96Å; I697-I737 HydrophobicContact CD1-CG2 4.38Å; L733-I737 VanDerWaalsContact O-CG1 3.28Å; L733-I737 WeakPolarHBondContact O-CG1 3.45Å; L733-I737 PolarHBondContact O-N 3Å; Q735-I737 VanDerWaalsContact C-N 3.32Å; Q735-I737 PolarHBondContact O-N 2.98Å; I737-D739 VanDerWaalsContact C-N 3.33Å; I737-D739 PolarHBondContact O-N 3.48Å; I737-A740 VanDerWaalsContact O-CB 3.24Å; I737-A740 WeakPolarHBondContact O-CB 3.36Å; I737-A740 PolarHBondContact O-N 2.8Å; I737-I747 HydrophobicContact CG2-CD1 4.28Å; I737-F767 HydrophobicContact CD1-CZ 4.29Å; I737-L780 HydrophobicContact CD1-CD2 3.64Å; I737-L780 HydrophobicContact CG1-CD2 3.63Å
738	L	89.8	Confident	89.1	Confident	6 Å²	6	6.7 Å²	6.7	3%	0.031	4%	0.038	C	C	.	.	H	α-helix	trans	-67	-36	-178	-172.6	64.6	0	0	0	112.3	M696 V707 R711 Y714 A734 Q735	M696-L738 HydrophobicContact CB-CD1 4.05Å; M696-L738 WeakPolarHBondContact O-CD1 3.28Å; V707-L738 HydrophobicContact CG1-CD2 4.5Å; R711-L738 HydrophobicContact CG-CD2 3.57Å; R711-L738 VanDerWaalsContact NE-CD2 3.3Å; Y714-L738 HydrophobicContact CE2-CD2 4.31Å; A734-L738 VanDerWaalsContact O-CB 3.32Å; A734-L738 WeakPolarHBondContact O-CB 3.28Å; A734-L738 PolarHBondContact O-N 3.17Å; Q735-L738 PolarHBondContact O-N 3.19Å
739	D	88.6	Confident	88.7	Confident	5 Å²	5	5.9 Å²	5.9	3%	0.027	3%	0.034	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	18.5	178.4	-68	-36.3	0	0	0	112.9	I353 M377 R711 Q735 I737 R743	I353-D739 WeakPolarHBondContact CD1-OD2 3.45Å; M377-D739 WeakPolarHBondContact CA-O 3.32Å; M377-D739 HydrophobicContact CE-CB 3.98Å; M377-D739 HydrophobicContact CG-CB 3.95Å; M377-D739 HydrophobicContact SD-CB 4.39Å; R711-D739 IonicContact CZ-OD1 2.75Å; R711-D739 IonicContact NH2-OD1 3.14Å; R711-D739 PolarHBondContact NH2-OD1 3.13Å; Q735-D739 PolarHBondContact O-N 3.32Å; I737-D739 VanDerWaalsContact C-N 3.33Å; I737-D739 PolarHBondContact O-N 3.48Å; D739-R743 IonicContact OD1-CZ 3.67Å; D739-R743 VanDerWaalsContact OD1-CZ 3.3Å; D739-R743 IonicContact OD1-NE 3.66Å; D739-R743 PolarHBondContact OD1-NE 3.16Å; D739-R743 IonicContact OD1-NH2 3.78Å; D739-R743 PolarHBondContact OD1-NH2 3.25Å; D739-R743 IonicContact OD2-NH2 2.76Å
740	A	89.7	Confident	88.4	Confident	1 Å²	1	8.5 Å²	8.5	1%	0.008	5%	0.047	C	C	.	.	G	3₁₀ helix	trans	-57.4	140.8	-175.8	0	0	0	0	0	112.9	F376 I697 G736 I737 G742 R743 V745 F784	F376-A740 CarbonylContact O-C 3.05Å; F376-A740 VanDerWaalsContact O-CA 3.23Å; F376-A740 WeakPolarHBondContact O-CA 3.16Å; I697-A740 HydrophobicContact CD1-CB 4.49Å; G736-A740 WeakPolarHBondContact O-CA 3.48Å; G736-A740 PolarHBondContact O-N 3.46Å; G736-A740 VanDerWaalsContact O-N 3.16Å; I737-A740 VanDerWaalsContact O-CB 3.24Å; I737-A740 WeakPolarHBondContact O-CB 3.36Å; I737-A740 PolarHBondContact O-N 2.8Å; A740-G742 VanDerWaalsContact C-N 3.28Å; A740-G742 PolarHBondContact O-N 2.61Å; A740-R743 VanDerWaalsContact O-CA 3.29Å; A740-R743 WeakPolarHBondContact O-CA 3.38Å; A740-R743 PolarHBondContact O-N 3.21Å; A740-V745 VanDerWaalsContact C-CG2 3.44Å; A740-V745 HydrophobicContact CB-CG2 3.54Å; A740-V745 WeakPolarHBondContact O-CG2 3.27Å; A740-F784 HydrophobicContact CB-CD1 4.23Å; A740-F784 HydrophobicContact CB-CE1 3.69Å; A740-F784 HydrophobicContact CB-CE2 4.29Å; A740-F784 HydrophobicContact CB-CZ 3.74Å
741	G	84.1	Confident	87.8	Confident	0 Å²	0	9 Å²	9	0%	0	5%	0.05	C	C	.	.	G	3₁₀ helix	trans	50.4	39.8	177.5	0	0	0	0	0	114.5	F376 M377 R743 N744	F376-G741 PolarHBondContact O-N 3.49Å; M377-G741 CarbonylContact O-C 3.6Å; M377-G741 VanDerWaalsContact O-CA 3.27Å; M377-G741 WeakPolarHBondContact O-CA 3.41Å; M377-G741 PolarHBondContact O-N 3.01Å; G741-R743 PolarHBondContact O-N 3.41Å; G741-N744 VanDerWaalsContact O-CB 3.26Å; G741-N744 WeakPolarHBondContact O-CB 3.32Å; G741-N744 PolarHBondContact O-N 3.35Å; G741-N744 VanDerWaalsContact O-N 3.11Å; G741-N744 PolarHBondContact O-ND2 3.01Å
742	G	82.1	Confident	86.9	Confident	0 Å²	0	13 Å²	13	0%	0	7%	0.065	C	C	.	.	G	3₁₀ helix	trans	63.8	28.1	-174.3	0	0	0	0	0	114	T349 M377 A740 N744	T349-G742 VanDerWaalsContact CG2-CA 3.46Å; M377-G742 PolarHBondContact O-N 3.36Å; A740-G742 VanDerWaalsContact C-N 3.28Å; A740-G742 PolarHBondContact O-N 2.61Å; G742-N744 PolarHBondContact O-N 3.41Å
743	R	85.1	Confident	85.8	Confident	13 Å²	13	14.2 Å²	14.2	5%	0.049	7%	0.073	C	C	.	.	G	3₁₀ helix	trans	67.7	16.4	-174.2	-53.8	169.5	176.5	159.8	4.9	114.3	R711 D739 A740 G741 Y814 P815 R893	R711-R743 VanDerWaalsContact NH2-NH2 3.17Å; D739-R743 IonicContact OD1-CZ 3.67Å; D739-R743 VanDerWaalsContact OD1-CZ 3.3Å; D739-R743 IonicContact OD1-NE 3.66Å; D739-R743 PolarHBondContact OD1-NE 3.16Å; D739-R743 IonicContact OD1-NH2 3.78Å; D739-R743 PolarHBondContact OD1-NH2 3.25Å; D739-R743 IonicContact OD2-NH2 2.76Å; A740-R743 VanDerWaalsContact O-CA 3.29Å; A740-R743 WeakPolarHBondContact O-CA 3.38Å; A740-R743 PolarHBondContact O-N 3.21Å; G741-R743 PolarHBondContact O-N 3.41Å; R743-Y814 HydrophobicContact CB-CD1 4.11Å; R743-Y814 HydrophobicContact CB-CE1 4.22Å; R743-P815 PolarHBondContact NH1-O 2.92Å; R743-R893 VanDerWaalsContact O-CZ 3.29Å; R743-R893 PolarHBondContact O-NE 3.15Å; R743-R893 PolarHBondContact O-NH2 2.69Å; R743-R893 VanDerWaalsContact O-NH2 3.08Å
744	N	87.1	Confident	84.8	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99	-10.6	-178.6	-57.8	-38.4	0	0	0	114.1	F342 L343 N346 Q698 G741 G742 T787 Y814 R893	F342-N744 HydrophobicContact CE1-CB 3.7Å; F342-N744 HydrophobicContact CZ-CB 3.89Å; L343-N744 HydrophobicContact CD2-CB 3.78Å; N346-N744 PolarHBondContact O-ND2 3.18Å; Q698-N744 PolarHBondContact NE2-O 3.09Å; Q698-N744 VanDerWaalsContact NE2-O 3.12Å; G741-N744 VanDerWaalsContact O-CB 3.26Å; G741-N744 WeakPolarHBondContact O-CB 3.32Å; G741-N744 PolarHBondContact O-N 3.35Å; G741-N744 VanDerWaalsContact O-N 3.11Å; G741-N744 PolarHBondContact O-ND2 3.01Å; G742-N744 PolarHBondContact O-N 3.41Å; N744-T787 PolarHBondContact O-N 3.48Å; N744-T787 PolarHBondContact O-OG1 3.25Å; N744-Y814 WeakPolarHBondContact OD1-CE1 3.36Å; N744-Y814 PolarHBondContact OD1-OH 3.43Å; N744-R893 WeakPolarHBondContact OD1-CD 3.36Å
745	V	88.9	Confident	84.1	Confident	3 Å²	3	17 Å²	17	2%	0.018	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	146.5	176.4	-56.7	0	0	0	0	110.8	L343 Q698 A740 F784 T785 P786	L343-V745 HydrophobicContact CD2-CG1 4.09Å; Q698-V745 WeakPolarHBondContact CG-O 3.44Å; Q698-V745 PolarHBondContact NE2-O 3.08Å; A740-V745 VanDerWaalsContact C-CG2 3.44Å; A740-V745 HydrophobicContact CB-CG2 3.54Å; A740-V745 WeakPolarHBondContact O-CG2 3.27Å; V745-F784 HydrophobicContact CB-CB 4.05Å; V745-F784 HydrophobicContact CG1-CB 4.44Å; V745-F784 HydrophobicContact CG2-CB 4.03Å; V745-F784 HydrophobicContact CG2-CD1 3.93Å; V745-F784 HydrophobicContact CG2-CG 3.97Å; V745-T785 WeakPolarHBondContact CA-O 3.41Å; V745-P786 HydrophobicContact CG1-CB 4.39Å
746	S	89.5	Confident	83.7	Confident	14 Å²	14	16.6 Å²	16.6	10%	0.098	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	166.3	173.1	69.9	0	0	0	0	109.1	T785 T787	S746-T785 PolarHBondContact N-O 3.4Å; S746-T785 PolarHBondContact O-N 3.38Å; S746-T785 PolarHBondContact OG-O 3.33Å; S746-T787 WeakPolarHBondContact OG-CG2 3.27Å
747	I	90.2	Very high	83.4	Confident	2 Å²	2	18.8 Å²	18.8	1%	0.01	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	118	168.1	-67.3	166.5	0	0	0	107	A662 L694 I697 I737 L764 L780 A783 F784	A662-I747 HydrophobicContact CB-CB 4.44Å; A662-I747 HydrophobicContact CB-CG2 4.02Å; L694-I747 HydrophobicContact CD2-CD1 3.29Å; I697-I747 HydrophobicContact CD1-CD1 4Å; I697-I747 HydrophobicContact CD1-CG1 3.88Å; I737-I747 HydrophobicContact CG2-CD1 4.28Å; I747-L764 HydrophobicContact CG2-CD1 3.87Å; I747-L764 HydrophobicContact CG2-CD2 4.47Å; I747-L764 HydrophobicContact CG2-CG 4.47Å; I747-L780 HydrophobicContact CD1-CD1 4.02Å; I747-A783 WeakPolarHBondContact CA-O 3.28Å; I747-A783 HydrophobicContact CG1-CB 4.44Å; I747-A783 HydrophobicContact CG2-CB 4.22Å; I747-F784 HydrophobicContact CD1-CD1 4.17Å; I747-F784 HydrophobicContact CD1-CE1 3.81Å; I747-F784 HydrophobicContact CG1-CD1 3.77Å; I747-F784 HydrophobicContact CG1-CE1 3.93Å
748	S	82.4	Confident	83	Confident	46 Å²	46	19.8 Å²	19.8	32%	0.322	11%	0.106	S	C	.	.			trans	-133.1	130.8	172.2	-173.6	0	0	0	0	109.9	Q750 S760	S748-Q750 VanDerWaalsContact C-N 3.3Å; S748-Q750 WeakPolarHBondContact CB-O 3.38Å; S748-Q750 PolarHBondContact OG-N 2.82Å; S748-Q750 PolarHBondContact OG-O 3.28Å; S748-S760 VanDerWaalsContact O-CB 3.22Å; S748-S760 WeakPolarHBondContact O-CB 3.28Å; S748-S760 PolarHBondContact O-OG 3.22Å
749	L	83.6	Confident	82.9	Confident	8 Å²	8	20.1 Å²	20.1	4%	0.042	11%	0.109	C	C	.	.	S	Bend	trans	-82.5	-14	172.1	-70.1	173.3	0	0	0	112.3	F628 I659 T756 H757 V761 L764	F628-L749 HydrophobicContact CB-CB 4.45Å; F628-L749 HydrophobicContact CB-CD1 3.65Å; F628-L749 HydrophobicContact CD1-CB 4.48Å; F628-L749 HydrophobicContact CD1-CD1 4.04Å; F628-L749 HydrophobicContact CD2-CB 3.47Å; F628-L749 VanDerWaalsContact CD2-CB 3.47Å; F628-L749 HydrophobicContact CD2-CD1 4.17Å; F628-L749 HydrophobicContact CD2-CG 4.48Å; F628-L749 HydrophobicContact CE2-CB 3.7Å; F628-L749 HydrophobicContact CG-CB 3.91Å; F628-L749 HydrophobicContact CG-CD1 3.71Å; F628-L749 HydrophobicContact CG-CG 4.48Å; F628-L749 HydrophobicContact CZ-CB 4.31Å; I659-L749 HydrophobicContact CG2-CD1 3.7Å; I659-L749 WeakPolarHBondContact O-CD1 3.28Å; L749-T756 WeakPolarHBondContact O-CA 3.4Å; L749-H757 PolarHBondContact O-N 2.99Å; L749-V761 HydrophobicContact CD2-CB 4.22Å; L749-V761 HydrophobicContact CD2-CG2 3.7Å; L749-L764 HydrophobicContact CD1-CD1 4.33Å; L749-L764 HydrophobicContact CD2-CD1 3.61Å; L749-L764 HydrophobicContact CG-CD1 4.03Å
750	Q	83	Confident	83	Confident	57 Å²	57	19.9 Å²	19.9	27%	0.266	11%	0.108	S	C	.	.	B	Isolated β-bridge	trans	-111.3	136.3	176.4	-65.3	176.9	47.8	0	0	109.8	F628 R629 S748 H755	F628-Q750 HydrophobicContact CD2-CG 3.72Å; F628-Q750 HydrophobicContact CE2-CG 3.5Å; F628-Q750 PolarHBondContact O-NE2 3.39Å; R629-Q750 VanDerWaalsContact CA-NE2 3.35Å; S748-Q750 VanDerWaalsContact C-N 3.3Å; S748-Q750 WeakPolarHBondContact CB-O 3.38Å; S748-Q750 PolarHBondContact OG-N 2.82Å; S748-Q750 PolarHBondContact OG-O 3.28Å; Q750-H755 CarbonylContact C-O 3.25Å; Q750-H755 WeakPolarHBondContact CA-O 3.27Å
751	S	79.2	Confident	83	Confident	10 Å²	10	19.9 Å²	19.9	7%	0.07	11%	0.107	C	C	.	.			trans	-64.4	158.2	158.6	-179.6	0	0	0	0	109.3	T753 G754 H755	S751-T753 PolarHBondContact O-N 3.3Å; S751-T753 VanDerWaalsContact O-N 3.13Å; S751-T753 PolarHBondContact OG-OG1 3.31Å; S751-G754 PolarHBondContact O-N 2.97Å; S751-H755 PolarHBondContact N-O 2.94Å
752	R	72.8	Confident	83.3	Confident	86 Å²	86	19.9 Å²	19.9	33%	0.325	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-20.5	177.6	-52.5	-172.8	-172.1	118.1	-6.3	112.2	E255 G754 P786 T918	E255-R752 IonicContact OE1-CZ 2.85Å; E255-R752 IonicContact OE1-NH1 3.1Å; E255-R752 PolarHBondContact OE1-NH1 3.39Å; E255-R752 IonicContact OE2-NH1 2.7Å; R752-G754 VanDerWaalsContact C-N 3.31Å; R752-P786 PolarHBondContact NH2-O 2.94Å; R752-T918 HydrophobicContact CB-CG2 4.37Å; R752-T918 WeakPolarHBondContact CD-O 3.33Å
753	T	69.2	Low	83.7	Confident	25 Å²	25	19.9 Å²	19.9	15%	0.153	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-5.2	174.4	59.1	0	0	0	0	113.7	S256 S751	S256-T753 WeakPolarHBondContact OG-CG2 3.43Å; S256-T753 PolarHBondContact OG-OG1 3.36Å; S751-T753 PolarHBondContact O-N 3.3Å; S751-T753 VanDerWaalsContact O-N 3.13Å; S751-T753 PolarHBondContact OG-OG1 3.31Å
754	G	70	Confident	83.9	Confident	24 Å²	24	19.2 Å²	19.2	25%	0.247	11%	0.105	C	C	.	.	S	Bend	trans	86.4	0.4	-178.8	0	0	0	0	0	114.8	S751 R752	S751-G754 PolarHBondContact O-N 2.97Å; R752-G754 VanDerWaalsContact C-N 3.31Å
755	H	77.9	Confident	84.1	Confident	33 Å²	33	19.2 Å²	19.2	15%	0.153	11%	0.105	C	C	.	.			trans	-74.4	156.1	168.1	-165.8	78.3	0	0	0	111.1	F223 S256 Q750 S751	F223-H755 AromaticContact CD1-ND1 3.75Å; F223-H755 HydrophobicContact CE1-CB 4.33Å; F223-H755 AromaticContact CE1-ND1 3.17Å; F223-H755 WeakPolarHBondContact CE1-ND1 3.5Å; F223-H755 HydrophobicContact CZ-CB 4.17Å; F223-H755 AromaticContact CZ-ND1 3.81Å; S256-H755 PolarHBondContact O-CD2 3.46Å; Q750-H755 CarbonylContact C-O 3.25Å; Q750-H755 WeakPolarHBondContact CA-O 3.27Å; S751-H755 PolarHBondContact N-O 2.94Å
756	T	82.7	Confident	84.2	Confident	15 Å²	15	19.1 Å²	19.1	9%	0.092	10%	0.104	C	C	.	.	B	Isolated β-bridge	trans	-80.7	122.5	177.6	58.3	0	0	0	0	110.2	Y558 F628 L749 M758	Y558-T756 VanDerWaalsContact OH-CB 3.32Å; Y558-T756 WeakPolarHBondContact OH-CB 3.26Å; Y558-T756 PolarHBondContact OH-OG1 3.49Å; F628-T756 HydrophobicContact CE2-CG2 4.14Å; F628-T756 HydrophobicContact CZ-CG2 3.58Å; L749-T756 WeakPolarHBondContact O-CA 3.4Å; T756-M758 PolarHBondContact O-N 3.33Å
757	H	83	Confident	84.4	Confident	47 Å²	47	18.5 Å²	18.5	22%	0.218	10%	0.1	C	C	.	.			trans	-77.1	98.8	178.4	-173	-108.1	0	0	0	109.9	L749 S760 V761	L749-H757 PolarHBondContact O-N 2.99Å; H757-S760 WeakPolarHBondContact ND1-CB 3.45Å; H757-S760 PolarHBondContact ND1-N 3.41Å; H757-S760 PolarHBondContact ND1-OG 2.87Å; H757-S760 WeakPolarHBondContact O-CB 3.35Å; H757-S760 PolarHBondContact O-N 2.94Å; H757-S760 VanDerWaalsContact O-N 3.08Å; H757-V761 PolarHBondContact O-N 3.3Å; H757-V761 VanDerWaalsContact O-N 3.13Å
758	M	84.9	Confident	84.3	Confident	21 Å²	21	18.6 Å²	18.6	10%	0.103	10%	0.1	C	C	.	.	H	α-helix	trans	-54	-47.1	-173.5	178.8	-178.7	76.9	0	0	113.2	L487 L522 Y558 T756 S760 V761 V762	L487-M758 HydrophobicContact CD2-CE 3.8Å; L522-M758 HydrophobicContact CD2-CE 3.68Å; L522-M758 HydrophobicContact CD2-CG 3.57Å; L522-M758 HydrophobicContact CD2-SD 3.37Å; L522-M758 WeakPolarHBondContact CD2-SD 3.5Å; L522-M758 HydrophobicContact CG-CG 4.31Å; L522-M758 HydrophobicContact CG-SD 3.85Å; Y558-M758 HydrophobicContact CD1-CG 4.25Å; Y558-M758 HydrophobicContact CD1-SD 4.37Å; Y558-M758 HydrophobicContact CE1-CB 4.1Å; Y558-M758 HydrophobicContact CE1-CG 3.97Å; Y558-M758 HydrophobicContact CE1-SD 4.44Å; T756-M758 PolarHBondContact O-N 3.33Å; M758-S760 VanDerWaalsContact C-N 3.29Å; M758-S760 PolarHBondContact O-N 3.46Å; M758-V761 PolarHBondContact O-N 2.89Å; M758-V762 WeakPolarHBondContact O-CG2 3.42Å; M758-V762 PolarHBondContact O-N 3.3Å
759	P	87.9	Confident	84.5	Confident	13 Å²	13	16.9 Å²	16.9	8%	0.084	9%	0.087	C	C	.	.	H	α-helix	trans	-62.3	-33.4	178	-21.7	33.7	0	0	0	113.5	N453 G763 L782	N453-P759 WeakPolarHBondContact ND2-CG 3.45Å; P759-G763 PolarHBondContact O-N 3.2Å; P759-L782 HydrophobicContact CB-CB 4.4Å; P759-L782 WeakPolarHBondContact O-CB 3.46Å
760	S	89.2	Confident	84.6	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-68.3	-43.3	176.2	-70.2	0	0	0	0	112.1	S748 H757 M758 G763 L764	S748-S760 VanDerWaalsContact O-CB 3.22Å; S748-S760 WeakPolarHBondContact O-CB 3.28Å; S748-S760 PolarHBondContact O-OG 3.22Å; H757-S760 WeakPolarHBondContact ND1-CB 3.45Å; H757-S760 PolarHBondContact ND1-N 3.41Å; H757-S760 PolarHBondContact ND1-OG 2.87Å; H757-S760 WeakPolarHBondContact O-CB 3.35Å; H757-S760 PolarHBondContact O-N 2.94Å; H757-S760 VanDerWaalsContact O-N 3.08Å; M758-S760 VanDerWaalsContact C-N 3.29Å; M758-S760 PolarHBondContact O-N 3.46Å; S760-G763 PolarHBondContact O-N 3.27Å; S760-L764 PolarHBondContact O-N 3.02Å
761	V	90.6	Very high	84.6	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-63.2	-48.4	179.5	179.4	0	0	0	0	110.2	Y558 M589 F625 L749 H757 M758 L764 L765	Y558-V761 HydrophobicContact CE2-CB 4.04Å; Y558-V761 HydrophobicContact CE2-CG1 3.86Å; Y558-V761 HydrophobicContact CE2-CG2 4.3Å; M589-V761 HydrophobicContact CE-CG1 3.74Å; M589-V761 HydrophobicContact SD-CG1 3.69Å; F625-V761 HydrophobicContact CD1-CG1 3.96Å; F625-V761 HydrophobicContact CE1-CG1 4.15Å; L749-V761 HydrophobicContact CD2-CB 4.22Å; L749-V761 HydrophobicContact CD2-CG2 3.7Å; H757-V761 PolarHBondContact O-N 3.3Å; H757-V761 VanDerWaalsContact O-N 3.13Å; M758-V761 PolarHBondContact O-N 2.89Å; V761-L764 PolarHBondContact O-N 3.18Å; V761-L765 WeakPolarHBondContact O-CB 3.5Å; V761-L765 PolarHBondContact O-N 3.31Å
762	V	90.1	Very high	84.9	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-62.7	-44.4	177.6	175	0	0	0	0	111	L519 L522 L555 M758 L764 L765 V766	L519-V762 HydrophobicContact CD2-CG1 3.5Å; L519-V762 VanDerWaalsContact CD2-CG1 3.5Å; L522-V762 HydrophobicContact CD1-CG2 3.69Å; L522-V762 HydrophobicContact CD2-CG2 3.84Å; L522-V762 HydrophobicContact CG-CG2 4.46Å; L555-V762 HydrophobicContact CD2-CB 4.26Å; L555-V762 HydrophobicContact CD2-CG1 3.85Å; L555-V762 HydrophobicContact CD2-CG2 3.73Å; M758-V762 WeakPolarHBondContact O-CG2 3.42Å; M758-V762 PolarHBondContact O-N 3.3Å; V762-L764 PolarHBondContact O-N 3.33Å; V762-L765 PolarHBondContact O-N 2.96Å; V762-V766 HydrophobicContact CG1-CG2 4.34Å; V762-V766 WeakPolarHBondContact O-CG2 3.32Å; V762-V766 PolarHBondContact O-N 3.39Å
763	G	89.6	Confident	85.6	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-57.7	-45.5	177.9	0	0	0	0	0	112.7	P759 S760 F767 F779	P759-G763 PolarHBondContact O-N 3.2Å; S760-G763 PolarHBondContact O-N 3.27Å; G763-F767 WeakPolarHBondContact O-CB 3.42Å; G763-F767 PolarHBondContact O-N 3.04Å; G763-F779 WeakPolarHBondContact CA-O 3.49Å
764	L	90.1	Very high	86.5	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-70	-39.8	177	-78.1	175.9	0	0	0	112.9	F625 I659 L694 I747 L749 S760 V761 V762 F767 T768 L780 A783	F625-L764 HydrophobicContact CE1-CB 4.17Å; F625-L764 HydrophobicContact CZ-CB 4.33Å; I659-L764 HydrophobicContact CG2-CD1 4.3Å; L694-L764 HydrophobicContact CD2-CD2 4.42Å; I747-L764 HydrophobicContact CG2-CD1 3.87Å; I747-L764 HydrophobicContact CG2-CD2 4.47Å; I747-L764 HydrophobicContact CG2-CG 4.47Å; L749-L764 HydrophobicContact CD1-CD1 4.33Å; L749-L764 HydrophobicContact CD2-CD1 3.61Å; L749-L764 HydrophobicContact CG-CD1 4.03Å; S760-L764 PolarHBondContact O-N 3.02Å; V761-L764 PolarHBondContact O-N 3.18Å; V762-L764 PolarHBondContact O-N 3.33Å; L764-F767 HydrophobicContact CD2-CD1 4.5Å; L764-F767 PolarHBondContact O-N 3.49Å; L764-T768 WeakPolarHBondContact O-CG2 3.38Å; L764-T768 PolarHBondContact O-N 3.21Å; L764-T768 VanDerWaalsContact O-N 3.08Å; L764-L780 HydrophobicContact CD2-CD1 3.57Å; L764-A783 HydrophobicContact CG-CB 4.09Å
765	L	91.1	Very high	87.3	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-59.9	-52.1	176.7	176.4	66.7	0	0	0	110.9	V551 L555 Y585 M589 F625 V761 V762 F767 T768	V551-L765 HydrophobicContact CG1-CD2 4.39Å; L555-L765 HydrophobicContact CD2-CD2 3.95Å; Y585-L765 HydrophobicContact CD1-CD1 3.49Å; Y585-L765 VanDerWaalsContact CD1-CD1 3.49Å; Y585-L765 HydrophobicContact CE1-CD1 3.8Å; Y585-L765 HydrophobicContact CG-CD1 4.07Å; M589-L765 HydrophobicContact CE-CB 4.06Å; M589-L765 HydrophobicContact CE-CD1 4.11Å; M589-L765 HydrophobicContact CE-CD2 3.85Å; M589-L765 HydrophobicContact CE-CG 4.21Å; M589-L765 HydrophobicContact CG-CD2 3.78Å; M589-L765 HydrophobicContact SD-CD2 3.72Å; F625-L765 HydrophobicContact CE1-CB 4.46Å; F625-L765 HydrophobicContact CE2-CB 4.43Å; F625-L765 HydrophobicContact CE2-CD1 3.93Å; F625-L765 HydrophobicContact CZ-CB 3.9Å; F625-L765 HydrophobicContact CZ-CD1 4.26Å; V761-L765 WeakPolarHBondContact O-CB 3.5Å; V761-L765 PolarHBondContact O-N 3.31Å; V762-L765 PolarHBondContact O-N 2.96Å; L765-F767 VanDerWaalsContact C-N 3.31Å; L765-F767 PolarHBondContact O-N 3.46Å; L765-T768 PolarHBondContact O-N 3.06Å; L765-T768 PolarHBondContact O-OG1 3.11Å
766	V	91.8	Very high	87.8	Confident	1 Å²	1	16.7 Å²	16.7	1%	0.006	8%	0.075	C	C	.	.	H	α-helix	trans	-67.7	-36.4	-179	179.3	0	0	0	0	110.7	V551 V762 T768 Q769 L776 F779	V551-V766 HydrophobicContact CG1-CG2 4.41Å; V762-V766 HydrophobicContact CG1-CG2 4.34Å; V762-V766 WeakPolarHBondContact O-CG2 3.32Å; V762-V766 PolarHBondContact O-N 3.39Å; V766-T768 VanDerWaalsContact C-N 3.32Å; V766-T768 PolarHBondContact O-N 3.44Å; V766-Q769 PolarHBondContact O-N 3.04Å; V766-L776 HydrophobicContact CG1-CB 4.15Å; V766-L776 HydrophobicContact CG1-CD1 4.35Å; V766-L776 HydrophobicContact CG1-CD2 3.81Å; V766-L776 HydrophobicContact CG1-CG 4.3Å; V766-F779 HydrophobicContact CB-CB 4.07Å; V766-F779 HydrophobicContact CB-CD1 4.14Å; V766-F779 HydrophobicContact CB-CD2 4.45Å; V766-F779 HydrophobicContact CB-CG 3.98Å; V766-F779 HydrophobicContact CG1-CB 4Å; V766-F779 HydrophobicContact CG1-CD1 3.92Å; V766-F779 HydrophobicContact CG1-CD2 3.52Å; V766-F779 HydrophobicContact CG1-CE1 4.25Å; V766-F779 HydrophobicContact CG1-CE2 3.89Å; V766-F779 HydrophobicContact CG1-CG 3.54Å; V766-F779 HydrophobicContact CG1-CZ 4.25Å; V766-F779 HydrophobicContact CG2-CD1 4.47Å
767	F	92.6	Very high	88.2	Confident	0 Å²	0	16 Å²	16	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-55.5	-44.6	174.3	169.2	-104	0	0	0	111.9	I690 I737 G763 L764 L765 Q769 F770 L780	I690-F767 HydrophobicContact CG2-CE1 3.91Å; I690-F767 HydrophobicContact CG2-CZ 3.92Å; I737-F767 HydrophobicContact CD1-CZ 4.29Å; G763-F767 WeakPolarHBondContact O-CB 3.42Å; G763-F767 PolarHBondContact O-N 3.04Å; L764-F767 HydrophobicContact CD2-CD1 4.5Å; L764-F767 PolarHBondContact O-N 3.49Å; L765-F767 VanDerWaalsContact C-N 3.31Å; L765-F767 PolarHBondContact O-N 3.46Å; F767-Q769 PolarHBondContact O-N 3.23Å; F767-F770 HydrophobicContact CE2-CD1 4.42Å; F767-F770 HydrophobicContact CZ-CD1 4.35Å; F767-F770 HydrophobicContact CZ-CE1 4.48Å; F767-F770 WeakPolarHBondContact O-CD1 3.34Å; F767-F770 PolarHBondContact O-N 3.3Å; F767-F770 VanDerWaalsContact O-N 3.14Å; F767-L780 HydrophobicContact CB-CB 4.45Å; F767-L780 HydrophobicContact CD1-CD1 4.27Å; F767-L780 HydrophobicContact CD2-CB 3.82Å; F767-L780 HydrophobicContact CD2-CD1 4.4Å; F767-L780 HydrophobicContact CD2-CD2 4.23Å; F767-L780 HydrophobicContact CD2-CG 4.38Å; F767-L780 HydrophobicContact CE2-CB 4.36Å; F767-L780 HydrophobicContact CE2-CD2 4Å; F767-L780 HydrophobicContact CG-CB 4.22Å; F767-L780 HydrophobicContact CG-CD1 4.14Å; F767-L780 HydrophobicContact CZ-CD2 4.25Å
768	T	88.6	Confident	88.7	Confident	4 Å²	4	13.8 Å²	13.8	3%	0.025	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-17.6	-177.7	65.5	0	0	0	0	114.6	M655 I659 L764 L765 V766 F770	M655-T768 HydrophobicContact CG-CG2 3.91Å; M655-T768 HydrophobicContact SD-CG2 4.28Å; I659-T768 HydrophobicContact CD1-CG2 3.86Å; L764-T768 WeakPolarHBondContact O-CG2 3.38Å; L764-T768 PolarHBondContact O-N 3.21Å; L764-T768 VanDerWaalsContact O-N 3.08Å; L765-T768 PolarHBondContact O-N 3.06Å; L765-T768 PolarHBondContact O-OG1 3.11Å; V766-T768 VanDerWaalsContact C-N 3.32Å; V766-T768 PolarHBondContact O-N 3.44Å; T768-F770 VanDerWaalsContact C-N 3.32Å; T768-F770 PolarHBondContact O-N 3.06Å
769	Q	87.1	Confident	89	Confident	11 Å²	11	12.8 Å²	12.8	5%	0.051	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	14.3	-176.5	-58.3	179.3	10.8	0	0	114.3	V766 F767 W771 F772 W773 L776	V766-Q769 PolarHBondContact O-N 3.04Å; F767-Q769 PolarHBondContact O-N 3.23Å; Q769-W771 PolarHBondContact O-N 3.49Å; Q769-F772 PolarHBondContact O-N 3.49Å; Q769-F772 VanDerWaalsContact O-N 3.08Å; Q769-W773 PolarHBondContact O-N 2.95Å; Q769-L776 HydrophobicContact CB-CD1 3.98Å
770	F	85.6	Confident	89.3	Confident	5 Å²	5	12.1 Å²	12.1	2%	0.022	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-16.6	-179	68.8	-102.7	0	0	0	114.6	Q686 I690 F729 F767 T768 W773	Q686-F770 VanDerWaalsContact NE2-CE2 3.27Å; I690-F770 HydrophobicContact CD1-CE1 4.03Å; I690-F770 HydrophobicContact CD1-CZ 3.79Å; F729-F770 HydrophobicContact CE1-CD2 4.09Å; F729-F770 HydrophobicContact CE1-CE2 4.26Å; F767-F770 HydrophobicContact CE2-CD1 4.42Å; F767-F770 HydrophobicContact CZ-CD1 4.35Å; F767-F770 HydrophobicContact CZ-CE1 4.48Å; F767-F770 WeakPolarHBondContact O-CD1 3.34Å; F767-F770 PolarHBondContact O-N 3.3Å; F767-F770 VanDerWaalsContact O-N 3.14Å; T768-F770 VanDerWaalsContact C-N 3.32Å; T768-F770 PolarHBondContact O-N 3.06Å; F770-W773 CarbonylContact O-C 3.51Å
771	W	83.6	Confident	89.3	Confident	70 Å²	70	12.1 Å²	12.1	27%	0.265	5%	0.052	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-38.9	174.1	-69.3	-2.4	0	0	0	113	C651 Y683 Q769	C651-W771 HydrophobicContact CB-CH2 4.37Å; C651-W771 VanDerWaalsContact SG-CZ2 3.54Å; Y683-W771 AromaticContact CD2-CH2 3.64Å; Y683-W771 HydrophobicContact CD2-CH2 3.64Å; Y683-W771 HydrophobicContact CD2-CZ2 4.06Å; Y683-W771 HydrophobicContact CD2-CZ3 4.49Å; Y683-W771 HydrophobicContact CE2-CH2 4.28Å; Y683-W771 HydrophobicContact CG-CH2 4.18Å; Y683-W771 HydrophobicContact CG-CZ2 4.32Å; Q769-W771 PolarHBondContact O-N 3.49Å
772	F	84.8	Confident	89.3	Confident	49 Å²	49	12.4 Å²	12.4	22%	0.215	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-34.6	-178.6	-60.7	-66.2	0	0	0	110.9	Q769	Q769-F772 PolarHBondContact O-N 3.49Å; Q769-F772 VanDerWaalsContact O-N 3.08Å
773	W	87.1	Confident	89.3	Confident	22 Å²	22	12.4 Å²	12.4	8%	0.083	5%	0.053	C	C	.	.			trans	-147.6	107.2	-178.5	-161.2	-121.4	0	0	0	112.4	W400 H476 Q769 F770 L776	W400-W773 AromaticContact CD2-CH2 3.73Å; W400-W773 HydrophobicContact CD2-CH2 3.73Å; W400-W773 AromaticContact CD2-CZ2 3.9Å; W400-W773 HydrophobicContact CD2-CZ2 3.9Å; W400-W773 AromaticContact CE2-CH2 3.34Å; W400-W773 AromaticContact CE2-CZ2 3.87Å; W400-W773 AromaticContact CE3-CH2 3.92Å; W400-W773 HydrophobicContact CE3-CH2 3.92Å; W400-W773 AromaticContact CE3-CZ2 3.58Å; W400-W773 HydrophobicContact CE3-CZ2 3.58Å; W400-W773 AromaticContact CH2-CH2 3.5Å; W400-W773 HydrophobicContact CH2-CH2 3.5Å; W400-W773 VanDerWaalsContact CH2-CH2 3.5Å; W400-W773 AromaticContact CH2-CZ2 3.3Å; W400-W773 HydrophobicContact CH2-CZ2 3.3Å; W400-W773 AromaticContact CZ2-CH2 3.25Å; W400-W773 HydrophobicContact CZ2-CH2 3.25Å; W400-W773 AromaticContact CZ2-CZ2 3.62Å; W400-W773 HydrophobicContact CZ2-CZ2 3.62Å; W400-W773 HydrophobicContact CZ2-CZ3 4.44Å; W400-W773 AromaticContact CZ3-CH2 3.82Å; W400-W773 HydrophobicContact CZ3-CH2 3.82Å; W400-W773 AromaticContact CZ3-CZ2 3.27Å; W400-W773 HydrophobicContact CZ3-CZ2 3.27Å; W400-W773 AromaticContact NE1-CH2 3.96Å; H476-W773 AromaticContact CE1-CE2 3.74Å; H476-W773 AromaticContact CE1-CZ2 3.68Å; H476-W773 AromaticContact CE1-NE1 3.47Å; H476-W773 PolarHBondContact CE1-NE1 3.38Å; H476-W773 AromaticContact NE2-CE2 3.54Å; H476-W773 AromaticContact NE2-CZ2 3.5Å; H476-W773 AromaticContact NE2-NE1 3.06Å; H476-W773 PolarHBondContact NE2-NE1 2.89Å; Q769-W773 PolarHBondContact O-N 2.95Å; F770-W773 CarbonylContact O-C 3.51Å; W773-L776 HydrophobicContact CB-CD1 3.88Å; W773-L776 HydrophobicContact CB-CG 3.89Å; W773-L776 HydrophobicContact CG-CG 4.3Å; W773-L776 WeakPolarHBondContact O-CB 3.32Å; W773-L776 PolarHBondContact O-N 2.8Å; W773-L776 VanDerWaalsContact O-N 3.13Å
774	F	87.3	Confident	89.3	Confident	87 Å²	87	13.1 Å²	13.1	38%	0.382	6%	0.056	S	C	.	.	G	3₁₀ helix	trans	-56.6	-41.3	-177.6	-66.2	-62.2	0	0	0	114.5	F729 L776 S777	F729-F774 HydrophobicContact CE2-CD1 4.08Å; F729-F774 HydrophobicContact CE2-CE1 4.21Å; F729-F774 AromaticContact CZ-CD1 3.88Å; F729-F774 HydrophobicContact CZ-CD1 3.88Å; F729-F774 HydrophobicContact CZ-CE1 4.19Å; F774-L776 PolarHBondContact O-N 3.05Å; F774-S777 WeakPolarHBondContact O-CB 3.43Å; F774-S777 PolarHBondContact O-N 3.46Å; F774-S777 PolarHBondContact O-OG 3.13Å
775	P	87.8	Confident	89.2	Confident	3 Å²	3	14.7 Å²	14.7	2%	0.019	7%	0.066	C	C	.	.	G	3₁₀ helix	trans	-58.9	-19.3	178.7	-26.1	35.3	0	0	0	114.9	F403 Y445 S777 H778	F403-P775 HydrophobicContact CD1-CB 4.02Å; F403-P775 HydrophobicContact CD1-CG 3.85Å; F403-P775 HydrophobicContact CE1-CB 3.87Å; F403-P775 HydrophobicContact CE1-CG 4.11Å; Y445-P775 PolarHBondContact OH-O 2.99Å; P775-S777 PolarHBondContact O-N 2.81Å; P775-S777 VanDerWaalsContact O-N 3.13Å; P775-H778 PolarHBondContact O-CD2 3.38Å; P775-H778 VanDerWaalsContact O-CD2 3.29Å; P775-H778 PolarHBondContact O-N 3.44Å
776	L	89.2	Confident	89.1	Confident	3 Å²	3	15.5 Å²	15.5	2%	0.016	7%	0.071	C	C	.	.	G	3₁₀ helix	trans	-63.3	-16.2	174.2	-61.9	-179.4	0	0	0	112.7	L515 V766 Q769 W773 F774 H778 F779	L515-L776 HydrophobicContact CD1-CD2 3.91Å; V766-L776 HydrophobicContact CG1-CB 4.15Å; V766-L776 HydrophobicContact CG1-CD1 4.35Å; V766-L776 HydrophobicContact CG1-CD2 3.81Å; V766-L776 HydrophobicContact CG1-CG 4.3Å; Q769-L776 HydrophobicContact CB-CD1 3.98Å; W773-L776 HydrophobicContact CB-CD1 3.88Å; W773-L776 HydrophobicContact CB-CG 3.89Å; W773-L776 HydrophobicContact CG-CG 4.3Å; W773-L776 WeakPolarHBondContact O-CB 3.32Å; W773-L776 PolarHBondContact O-N 2.8Å; W773-L776 VanDerWaalsContact O-N 3.13Å; F774-L776 PolarHBondContact O-N 3.05Å; L776-H778 PolarHBondContact O-N 3.34Å; L776-F779 HydrophobicContact CB-CD2 4.48Å; L776-F779 HydrophobicContact CD2-CD2 4.06Å; L776-F779 HydrophobicContact CD2-CE2 3.71Å; L776-F779 WeakPolarHBondContact O-CB 3.34Å; L776-F779 PolarHBondContact O-N 3.18Å; L776-F779 VanDerWaalsContact O-N 3.16Å
777	S	90.8	Very high	88.7	Confident	0 Å²	0	15.7 Å²	15.7	0%	0	7%	0.072	C	C	.	.	G	3₁₀ helix	trans	-58.1	-30	174.1	63.8	0	0	0	0	112.8	I372 F376 F774 P775 F779 L780	I372-S777 VanDerWaalsContact CD1-OG 3.22Å; I372-S777 WeakPolarHBondContact CD1-OG 3.35Å; F376-S777 VanDerWaalsContact CZ-O 3.28Å; F376-S777 WeakPolarHBondContact CZ-O 3.46Å; F774-S777 WeakPolarHBondContact O-CB 3.43Å; F774-S777 PolarHBondContact O-N 3.46Å; F774-S777 PolarHBondContact O-OG 3.13Å; P775-S777 PolarHBondContact O-N 2.81Å; P775-S777 VanDerWaalsContact O-N 3.13Å; S777-F779 PolarHBondContact O-N 3.45Å; S777-L780 WeakPolarHBondContact O-CB 3.4Å; S777-L780 PolarHBondContact O-N 3.24Å
778	H	92.7	Very high	88.3	Confident	0 Å²	0	15.8 Å²	15.8	0%	0	7%	0.073	C	C	.	.	G	3₁₀ helix	trans	-68.3	-17.9	-178.7	-63.4	-63.5	0	0	0	113.7	T404 V411 Y445 L449 P775 L776 L780 S781	T404-H778 WeakPolarHBondContact CG2-NE2 3.42Å; T404-H778 PolarHBondContact O-NE2 3.36Å; V411-H778 HydrophobicContact CG2-CB 4.07Å; Y445-H778 HydrophobicContact CE1-CB 4.09Å; L449-H778 HydrophobicContact CD1-CB 3.83Å; L449-H778 HydrophobicContact CD2-CB 4.43Å; P775-H778 PolarHBondContact O-CD2 3.38Å; P775-H778 VanDerWaalsContact O-CD2 3.29Å; P775-H778 PolarHBondContact O-N 3.44Å; L776-H778 PolarHBondContact O-N 3.34Å; H778-L780 PolarHBondContact O-N 3.33Å; H778-S781 WeakPolarHBondContact O-CB 3.48Å; H778-S781 PolarHBondContact O-N 3.34Å; H778-S781 VanDerWaalsContact O-N 3.09Å; H778-S781 PolarHBondContact O-OG 3.06Å
779	F	92	Very high	88.2	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	7%	0.072	C	C	.	.	G	3₁₀ helix	trans	-63.8	-18	173.5	-79.3	-95.7	0	0	0	113.2	Y445 L480 L484 L519 G763 V766 L776 S777 S781 L782	Y445-F779 AromaticContact CE2-CE2 3.99Å; Y445-F779 HydrophobicContact CE2-CE2 3.99Å; Y445-F779 HydrophobicContact CE2-CZ 4.23Å; Y445-F779 AromaticContact CZ-CE2 3.87Å; Y445-F779 WeakPolarHBondContact OH-CD2 3.21Å; Y445-F779 WeakPolarHBondContact OH-CE2 3.3Å; L480-F779 HydrophobicContact CD2-CZ 4.4Å; L484-F779 HydrophobicContact CD1-CE1 4.17Å; L484-F779 HydrophobicContact CD1-CZ 4.18Å; L484-F779 HydrophobicContact CD2-CD1 3.87Å; L484-F779 HydrophobicContact CD2-CE1 3.38Å; L484-F779 HydrophobicContact CD2-CZ 4.17Å; L484-F779 HydrophobicContact CG-CE1 3.85Å; L484-F779 HydrophobicContact CG-CZ 4.16Å; L519-F779 HydrophobicContact CD1-CE1 3.91Å; L519-F779 HydrophobicContact CD1-CZ 4.28Å; G763-F779 WeakPolarHBondContact CA-O 3.49Å; V766-F779 HydrophobicContact CB-CB 4.07Å; V766-F779 HydrophobicContact CB-CD1 4.14Å; V766-F779 HydrophobicContact CB-CD2 4.45Å; V766-F779 HydrophobicContact CB-CG 3.98Å; V766-F779 HydrophobicContact CG1-CB 4Å; V766-F779 HydrophobicContact CG1-CD1 3.92Å; V766-F779 HydrophobicContact CG1-CD2 3.52Å; V766-F779 HydrophobicContact CG1-CE1 4.25Å; V766-F779 HydrophobicContact CG1-CE2 3.89Å; V766-F779 HydrophobicContact CG1-CG 3.54Å; V766-F779 HydrophobicContact CG1-CZ 4.25Å; V766-F779 HydrophobicContact CG2-CD1 4.47Å; L776-F779 HydrophobicContact CB-CD2 4.48Å; L776-F779 HydrophobicContact CD2-CD2 4.06Å; L776-F779 HydrophobicContact CD2-CE2 3.71Å; L776-F779 WeakPolarHBondContact O-CB 3.34Å; L776-F779 PolarHBondContact O-N 3.18Å; L776-F779 VanDerWaalsContact O-N 3.16Å; S777-F779 PolarHBondContact O-N 3.45Å; F779-S781 PolarHBondContact O-N 2.8Å; F779-S781 VanDerWaalsContact O-N 3.13Å; F779-L782 HydrophobicContact CD1-CD1 3.95Å; F779-L782 WeakPolarHBondContact O-CB 3.28Å; F779-L782 PolarHBondContact O-N 3.14Å
780	L	92.7	Very high	88.2	Confident	0 Å²	0	15 Å²	15	0%	0	7%	0.069	C	C	.	.	G	3₁₀ helix	trans	-59.1	-25.4	172.6	-169.8	63.1	0	0	0	112.3	F376 I737 I747 L764 F767 S777 H778 L782 A783 F784	F376-L780 HydrophobicContact CD2-CD2 4.3Å; F376-L780 HydrophobicContact CE1-CB 4.02Å; F376-L780 HydrophobicContact CE1-CD2 4.37Å; F376-L780 HydrophobicContact CE2-CD2 3.76Å; F376-L780 HydrophobicContact CZ-CB 3.85Å; F376-L780 HydrophobicContact CZ-CD2 3.8Å; F376-L780 HydrophobicContact CZ-CG 4.4Å; I737-L780 HydrophobicContact CD1-CD2 3.64Å; I737-L780 HydrophobicContact CG1-CD2 3.63Å; I747-L780 HydrophobicContact CD1-CD1 4.02Å; L764-L780 HydrophobicContact CD2-CD1 3.57Å; F767-L780 HydrophobicContact CB-CB 4.45Å; F767-L780 HydrophobicContact CD1-CD1 4.27Å; F767-L780 HydrophobicContact CD2-CB 3.82Å; F767-L780 HydrophobicContact CD2-CD1 4.4Å; F767-L780 HydrophobicContact CD2-CD2 4.23Å; F767-L780 HydrophobicContact CD2-CG 4.38Å; F767-L780 HydrophobicContact CE2-CB 4.36Å; F767-L780 HydrophobicContact CE2-CD2 4Å; F767-L780 HydrophobicContact CG-CB 4.22Å; F767-L780 HydrophobicContact CG-CD1 4.14Å; F767-L780 HydrophobicContact CZ-CD2 4.25Å; S777-L780 WeakPolarHBondContact O-CB 3.4Å; S777-L780 PolarHBondContact O-N 3.24Å; H778-L780 PolarHBondContact O-N 3.33Å; L780-L782 PolarHBondContact O-N 3.08Å; L780-L782 VanDerWaalsContact O-N 3.16Å; L780-A783 HydrophobicContact CD1-CB 4.27Å; L780-A783 WeakPolarHBondContact O-CB 3.43Å; L780-A783 PolarHBondContact O-N 2.91Å; L780-F784 HydrophobicContact CD2-CE1 4.36Å; L780-F784 HydrophobicContact CD2-CZ 3.89Å; L780-F784 HydrophobicContact CG-CE1 4.22Å; L780-F784 HydrophobicContact CG-CE2 4.43Å; L780-F784 HydrophobicContact CG-CZ 3.91Å; L780-F784 PolarHBondContact O-N 3.15Å
781	S	91.1	Very high	88.1	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.068	C	C	.	.	G	3₁₀ helix	trans	-59.2	-25.7	175.6	67.6	0	0	0	0	113.6	K414 H778 F779 A783 F784	K414-S781 PolarHBondContact NZ-O 3.29Å; H778-S781 WeakPolarHBondContact O-CB 3.48Å; H778-S781 PolarHBondContact O-N 3.34Å; H778-S781 VanDerWaalsContact O-N 3.09Å; H778-S781 PolarHBondContact O-OG 3.06Å; F779-S781 PolarHBondContact O-N 2.8Å; F779-S781 VanDerWaalsContact O-N 3.13Å; S781-A783 VanDerWaalsContact C-N 3.29Å; S781-F784 PolarHBondContact O-N 3.17Å
782	L	89.3	Confident	88.2	Confident	6 Å²	6	11.5 Å²	11.5	3%	0.031	6%	0.055	C	C	.	.	G	3₁₀ helix	trans	-71.6	-24.9	174.7	-57.2	179.3	0	0	0	112.7	A452 L484 L487 P759 F779 L780	A452-L782 HydrophobicContact CB-CD2 3.44Å; A452-L782 VanDerWaalsContact CB-CD2 3.44Å; L484-L782 HydrophobicContact CD2-CD1 3.76Å; L484-L782 HydrophobicContact CD2-CD2 4.39Å; L487-L782 HydrophobicContact CD1-CD1 4.4Å; P759-L782 HydrophobicContact CB-CB 4.4Å; P759-L782 WeakPolarHBondContact O-CB 3.46Å; F779-L782 HydrophobicContact CD1-CD1 3.95Å; F779-L782 WeakPolarHBondContact O-CB 3.28Å; F779-L782 PolarHBondContact O-N 3.14Å; L780-L782 PolarHBondContact O-N 3.08Å; L780-L782 VanDerWaalsContact O-N 3.16Å
783	A	90.4	Very high	88	Confident	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.046	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-10.7	178.5	0	0	0	0	0	113.5	I747 L764 L780 S781 T785	I747-A783 WeakPolarHBondContact CA-O 3.28Å; I747-A783 HydrophobicContact CG1-CB 4.44Å; I747-A783 HydrophobicContact CG2-CB 4.22Å; L764-A783 HydrophobicContact CG-CB 4.09Å; L780-A783 HydrophobicContact CD1-CB 4.27Å; L780-A783 WeakPolarHBondContact O-CB 3.43Å; L780-A783 PolarHBondContact O-N 2.91Å; S781-A783 VanDerWaalsContact C-N 3.29Å; A783-T785 PolarHBondContact O-N 3.39Å
784	F	90.6	Very high	87.6	Confident	14 Å²	14	14.1 Å²	14.1	6%	0.061	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	113.4	174.1	-66.3	-38	0	0	0	110.7	F376 T379 I697 A740 V745 I747 L780 S781	F376-F784 HydrophobicContact CB-CE2 4.05Å; F376-F784 HydrophobicContact CB-CZ 4.08Å; F376-F784 AromaticContact CD1-CE2 3.65Å; F376-F784 HydrophobicContact CD1-CE2 3.65Å; F376-F784 HydrophobicContact CD1-CZ 4.09Å; F376-F784 HydrophobicContact CE1-CE2 4.32Å; F376-F784 AromaticContact CG-CE2 3.98Å; F376-F784 HydrophobicContact CG-CE2 3.98Å; F376-F784 HydrophobicContact CG-CZ 4.02Å; T379-F784 HydrophobicContact CG2-CD2 4.09Å; I697-F784 HydrophobicContact CD1-CD1 4.49Å; I697-F784 HydrophobicContact CD1-CE1 4.26Å; A740-F784 HydrophobicContact CB-CD1 4.23Å; A740-F784 HydrophobicContact CB-CE1 3.69Å; A740-F784 HydrophobicContact CB-CE2 4.29Å; A740-F784 HydrophobicContact CB-CZ 3.74Å; V745-F784 HydrophobicContact CB-CB 4.05Å; V745-F784 HydrophobicContact CG1-CB 4.44Å; V745-F784 HydrophobicContact CG2-CB 4.03Å; V745-F784 HydrophobicContact CG2-CD1 3.93Å; V745-F784 HydrophobicContact CG2-CG 3.97Å; I747-F784 HydrophobicContact CD1-CD1 4.17Å; I747-F784 HydrophobicContact CD1-CE1 3.81Å; I747-F784 HydrophobicContact CG1-CD1 3.77Å; I747-F784 HydrophobicContact CG1-CE1 3.93Å; L780-F784 HydrophobicContact CD2-CE1 4.36Å; L780-F784 HydrophobicContact CD2-CZ 3.89Å; L780-F784 HydrophobicContact CG-CE1 4.22Å; L780-F784 HydrophobicContact CG-CE2 4.43Å; L780-F784 HydrophobicContact CG-CZ 3.91Å; L780-F784 PolarHBondContact O-N 3.15Å; S781-F784 PolarHBondContact O-N 3.17Å
785	T	87.8	Confident	87	Confident	34 Å²	34	14.2 Å²	14.2	21%	0.209	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	122.7	175.5	-50.3	0	0	0	0	109.3	V745 S746 A783 T787	V745-T785 WeakPolarHBondContact CA-O 3.41Å; S746-T785 PolarHBondContact N-O 3.4Å; S746-T785 PolarHBondContact O-N 3.38Å; S746-T785 PolarHBondContact OG-O 3.33Å; A783-T785 PolarHBondContact O-N 3.39Å; T785-T787 PolarHBondContact O-N 3.01Å
786	P	87.9	Confident	86.4	Confident	16 Å²	16	14.7 Å²	14.7	10%	0.104	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	133.1	177.4	27	-32.6	0	0	0	111	H339 F342 V745 R752	H339-P786 HydrophobicContact CB-CG 4.04Å; F342-P786 HydrophobicContact CD1-CB 4.35Å; F342-P786 HydrophobicContact CE1-CB 4.28Å; V745-P786 HydrophobicContact CG1-CB 4.39Å; R752-P786 PolarHBondContact NH2-O 2.94Å
787	T	84.3	Confident	86	Confident	6 Å²	6	20 Å²	20	4%	0.037	10%	0.097	C	C	.	.			trans	-102.6	81.7	177.7	59.9	0	0	0	0	109.7	Q698 N744 S746 T785 R893 V894	Q698-T787 PolarHBondContact NE2-OG1 3.41Å; Q698-T787 PolarHBondContact OE1-OG1 2.91Å; Q698-T787 VanDerWaalsContact OE1-OG1 3.12Å; N744-T787 PolarHBondContact O-N 3.48Å; N744-T787 PolarHBondContact O-OG1 3.25Å; S746-T787 WeakPolarHBondContact OG-CG2 3.27Å; T785-T787 PolarHBondContact O-N 3.01Å; T787-R893 WeakPolarHBondContact O-CA 3.37Å; T787-V894 WeakPolarHBondContact CB-O 3.48Å; T787-V894 PolarHBondContact O-N 3.43Å
788	A	84.3	Confident	85.4	Confident	1 Å²	1	20.3 Å²	20.3	1%	0.008	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	153.6	178.8	0	0	0	0	0	111.7	F342 I790 A892 G920	F342-A788 HydrophobicContact CD1-CB 3.84Å; F342-A788 HydrophobicContact CD2-CB 3.93Å; F342-A788 HydrophobicContact CE1-CB 3.69Å; F342-A788 HydrophobicContact CE2-CB 3.79Å; F342-A788 HydrophobicContact CG-CB 3.95Å; F342-A788 HydrophobicContact CZ-CB 3.67Å; A788-I790 HydrophobicContact CB-CD1 4.45Å; A788-I790 HydrophobicContact CB-CG1 4.09Å; A788-A892 CarbonylContact C-O 3.5Å; A788-A892 WeakPolarHBondContact CA-O 3.48Å; A788-G920 VanDerWaalsContact O-CA 3.28Å; A788-G920 WeakPolarHBondContact O-CA 3.37Å; A788-G920 PolarHBondContact O-N 2.7Å
789	I	86.2	Confident	84.8	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	125.5	156.5	-88.3	167.6	0	0	0	107.1	Y803 A892 V894 L899 L902 G920 I922	I789-Y803 HydrophobicContact CG2-CD1 4.48Å; I789-Y803 HydrophobicContact CG2-CD2 4.21Å; I789-Y803 HydrophobicContact CG2-CE1 3.88Å; I789-Y803 HydrophobicContact CG2-CE2 3.54Å; I789-Y803 WeakPolarHBondContact CG2-OH 3.43Å; I789-A892 PolarHBondContact N-O 3.46Å; I789-A892 PolarHBondContact O-N 3.21Å; I789-A892 VanDerWaalsContact O-N 3.14Å; I789-V894 HydrophobicContact CB-CG2 4.09Å; I789-V894 HydrophobicContact CD1-CG1 4.23Å; I789-V894 HydrophobicContact CD1-CG2 3.81Å; I789-V894 HydrophobicContact CG1-CG2 3.69Å; I789-L899 HydrophobicContact CD1-CD2 3.55Å; I789-L899 HydrophobicContact CG1-CD2 4.21Å; I789-L902 HydrophobicContact CD1-CD2 3.35Å; I789-G920 WeakPolarHBondContact CA-O 3.49Å; I789-I922 HydrophobicContact CG1-CD1 4.47Å
790	I	86.4	Confident	84.2	Confident	0 Å²	0	26 Å²	26	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	108.6	176.9	-53	-177.1	0	0	0	107	L338 A788 L792 M798 N890 P891 G920 I921 I922	L338-I790 HydrophobicContact CB-CD1 4.06Å; A788-I790 HydrophobicContact CB-CD1 4.45Å; A788-I790 HydrophobicContact CB-CG1 4.09Å; I790-L792 HydrophobicContact CG2-CD2 4.26Å; I790-L792 HydrophobicContact CG2-CG 4.49Å; I790-M798 HydrophobicContact CG2-CE 4.22Å; I790-M798 HydrophobicContact CG2-CG 4.38Å; I790-N890 WeakPolarHBondContact CA-OD1 3.17Å; I790-P891 HydrophobicContact CG1-CB 3.97Å; I790-G920 PolarHBondContact N-O 2.72Å; I790-I921 HydrophobicContact CB-CG1 4.3Å; I790-I921 WeakPolarHBondContact O-CA 3.5Å; I790-I922 PolarHBondContact O-N 3.48Å
791	G	84.2	Confident	83.7	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	135.1	170.2	0	0	0	0	0	110.2	P799 Y803 N890 I922	G791-P799 WeakPolarHBondContact O-CD 3.12Å; G791-Y803 PolarHBondContact N-OH 3.13Å; G791-N890 PolarHBondContact N-ND2 3.09Å; G791-N890 PolarHBondContact N-OD1 3.08Å; G791-N890 PolarHBondContact O-ND2 2.98Å; G791-I922 WeakPolarHBondContact CA-O 2.99Å
792	L	84.5	Confident	83.3	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	145.2	172.2	-64.6	177.1	0	0	0	111.1	F251 L338 I790 L796 K797 M798 I921 I922 I923 L924	F251-L792 HydrophobicContact CE2-CD1 3.98Å; F251-L792 HydrophobicContact CZ-CD1 3.74Å; L338-L792 HydrophobicContact CD1-CD1 3.7Å; L338-L792 HydrophobicContact CD1-CD2 3.98Å; L338-L792 HydrophobicContact CD1-CG 4.33Å; L338-L792 HydrophobicContact CD2-CD2 3.91Å; I790-L792 HydrophobicContact CG2-CD2 4.26Å; I790-L792 HydrophobicContact CG2-CG 4.49Å; L792-L796 HydrophobicContact CD1-CD2 4.48Å; L792-K797 WeakPolarHBondContact CA-O 2.81Å; L792-M798 HydrophobicContact CD2-CG 4.14Å; L792-I921 HydrophobicContact CD1-CG2 3.37Å; L792-I921 HydrophobicContact CG-CG2 3.96Å; L792-I922 PolarHBondContact N-O 3.41Å; L792-I923 HydrophobicContact CB-CD1 4.11Å; L792-L924 PolarHBondContact O-N 3.13Å
793	N	82.3	Confident	83.1	Confident	3 Å²	3	30.4 Å²	30.4	2%	0.016	14%	0.144	C	C	.	.			trans	-83.3	-177.6	171.8	72.6	-3.6	0	0	0	111.6	D795 L796 K797 E932	N793-D795 PolarHBondContact O-N 3.01Å; N793-D795 VanDerWaalsContact OD1-C 3.32Å; N793-D795 WeakPolarHBondContact OD1-CA 3.27Å; N793-D795 PolarHBondContact OD1-N 3.34Å; N793-D795 VanDerWaalsContact OD1-N 3.07Å; N793-L796 PolarHBondContact O-N 2.92Å; N793-L796 VanDerWaalsContact O-N 3.08Å; N793-L796 PolarHBondContact OD1-N 3.16Å; N793-K797 PolarHBondContact N-O 3.35Å; N793-K797 PolarHBondContact OD1-N 2.95Å; N793-K797 PolarHBondContact OD1-O 3.09Å; N793-E932 PolarHBondContact ND2-OE2 3.29Å
794	K	77.6	Confident	82.8	Confident	123 Å²	123	35.6 Å²	35.6	54%	0.535	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-28.8	177.4	-174.6	177.7	178.3	-175.8	0	113.1	L244 L796	L244-K794 HydrophobicContact CD1-CB 4.5Å; L244-K794 HydrophobicContact CD1-CD 4.22Å; L244-K794 HydrophobicContact CD1-CG 3.99Å; K794-L796 VanDerWaalsContact C-N 3.33Å
795	D	75.8	Confident	82.4	Confident	90 Å²	90	35 Å²	35	48%	0.481	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	10.2	179.4	-66.8	-35.1	0	0	0	113.9	N793 K797	N793-D795 PolarHBondContact O-N 3.01Å; N793-D795 VanDerWaalsContact OD1-C 3.32Å; N793-D795 WeakPolarHBondContact OD1-CA 3.27Å; N793-D795 PolarHBondContact OD1-N 3.34Å; N793-D795 VanDerWaalsContact OD1-N 3.07Å; D795-K797 VanDerWaalsContact C-N 3.27Å; D795-K797 PolarHBondContact O-N 3.44Å
796	L	75.5	Confident	82.2	Confident	13 Å²	13	36.6 Å²	36.6	7%	0.068	17%	0.169	C	C	.	.	S	Bend	trans	62.5	29.6	178.6	-51.8	171.2	0	0	0	113.8	Y247 F251 I329 M334 L792 N793 K794 I923	Y247-L796 HydrophobicContact CD2-CD2 3.86Å; Y247-L796 HydrophobicContact CE2-CD2 4.24Å; Y247-L796 HydrophobicContact CE2-CG 4.46Å; Y247-L796 HydrophobicContact CG-CD2 4.28Å; F251-L796 HydrophobicContact CE2-CD2 4.19Å; F251-L796 HydrophobicContact CZ-CD2 4.43Å; I329-L796 HydrophobicContact CD1-CD1 3.97Å; I329-L796 HydrophobicContact CD1-CD2 4.1Å; I329-L796 HydrophobicContact CG1-CD1 4.24Å; M334-L796 HydrophobicContact CE-CB 3.55Å; M334-L796 HydrophobicContact CE-CD1 4.07Å; M334-L796 HydrophobicContact CE-CG 4.43Å; M334-L796 HydrophobicContact SD-CB 4.29Å; M334-L796 HydrophobicContact SD-CD1 3.65Å; L792-L796 HydrophobicContact CD1-CD2 4.48Å; N793-L796 PolarHBondContact O-N 2.92Å; N793-L796 VanDerWaalsContact O-N 3.08Å; N793-L796 PolarHBondContact OD1-N 3.16Å; K794-L796 VanDerWaalsContact C-N 3.33Å; L796-I923 HydrophobicContact CD2-CD1 4.4Å
797	K	80.2	Confident	81.8	Confident	113 Å²	113	37.4 Å²	37.4	49%	0.491	18%	0.175	S	C	.	.			trans	-104.5	157.5	172.6	-57.3	-175.7	-173.9	170.5	0	110.5	L792 N793 D795 P799 L934	L792-K797 WeakPolarHBondContact CA-O 2.81Å; N793-K797 PolarHBondContact N-O 3.35Å; N793-K797 PolarHBondContact OD1-N 2.95Å; N793-K797 PolarHBondContact OD1-O 3.09Å; D795-K797 VanDerWaalsContact C-N 3.27Å; D795-K797 PolarHBondContact O-N 3.44Å; K797-P799 WeakPolarHBondContact O-CD 3.34Å; K797-L934 HydrophobicContact CB-CD1 4.32Å; K797-L934 HydrophobicContact CB-CD2 3.77Å; K797-L934 HydrophobicContact CD-CD1 3.54Å; K797-L934 HydrophobicContact CD-CD2 4.48Å
798	M	78.1	Confident	81.6	Confident	8 Å²	8	42.5 Å²	42.5	4%	0.039	20%	0.196	C	C	.	.			trans	-83.2	112.7	178	-62.9	-175.4	-170.5	0	0	110.7	L338 Q341 I790 L792 P891 L934 V935	L338-M798 HydrophobicContact CB-CE 4.07Å; L338-M798 HydrophobicContact CD2-CE 3.28Å; L338-M798 HydrophobicContact CD2-CG 4.1Å; L338-M798 HydrophobicContact CG-CE 4.26Å; Q341-M798 HydrophobicContact CB-CE 4.09Å; Q341-M798 VanDerWaalsContact OE1-CE 3.23Å; I790-M798 HydrophobicContact CG2-CE 4.22Å; I790-M798 HydrophobicContact CG2-CG 4.38Å; L792-M798 HydrophobicContact CD2-CG 4.14Å; M798-P891 HydrophobicContact SD-CG 4.3Å; M798-L934 WeakPolarHBondContact O-CA 3.35Å; M798-V935 HydrophobicContact CB-CB 4.28Å; M798-V935 HydrophobicContact CB-CG2 4.12Å; M798-V935 PolarHBondContact O-N 3.43Å
799	P	79.8	Confident	81.2	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-79	152	169.2	32.8	-33.9	0	0	0	111.1	G791 K797 V801 N890 Y910 L924	G791-P799 WeakPolarHBondContact O-CD 3.12Å; K797-P799 WeakPolarHBondContact O-CD 3.34Å; P799-V801 PolarHBondContact O-N 3.35Å; P799-N890 PolarHBondContact O-ND2 3.37Å; P799-Y910 HydrophobicContact CB-CD2 4.37Å; P799-Y910 HydrophobicContact CB-CE1 4.14Å; P799-Y910 HydrophobicContact CB-CE2 3.72Å; P799-Y910 HydrophobicContact CG-CE1 4.42Å; P799-Y910 HydrophobicContact CG-CE2 4.42Å; P799-L924 HydrophobicContact CG-CD1 3.99Å
800	K	78.9	Confident	80.7	Confident	119 Å²	119	46.7 Å²	46.7	52%	0.517	23%	0.225	S	C	.	.			trans	-72.2	105.7	168.2	-69	-177.3	-162.6	165.7	0	109.5	E933 L934 V935	K800-E933 HydrophobicContact CD-CB 4.1Å; K800-E933 WeakPolarHBondContact CD-OE2 3.33Å; K800-E933 PolarHBondContact N-O 2.91Å; K800-E933 IonicContact NZ-OE2 3.15Å; K800-E933 PolarHBondContact NZ-OE2 2.81Å; K800-L934 WeakPolarHBondContact CE-O 3.5Å; K800-V935 HydrophobicContact CG-CG2 3.85Å
801	V	81.7	Confident	80.3	Confident	7 Å²	7	47.8 Å²	47.8	4%	0.042	23%	0.231	C	C	.	.			trans	-135	148.3	178.3	64.9	0	0	0	0	111	P799 Y803 N890 M904 C908 Y910 L924	P799-V801 PolarHBondContact O-N 3.35Å; V801-Y803 HydrophobicContact CG1-CE1 4.42Å; V801-Y803 HydrophobicContact CG1-CE2 4.02Å; V801-Y803 WeakPolarHBondContact CG1-OH 3.29Å; V801-N890 HydrophobicContact CG1-CB 3.49Å; V801-N890 VanDerWaalsContact CG1-CB 3.49Å; V801-N890 PolarHBondContact O-N 3.22Å; V801-M904 HydrophobicContact CG2-CE 3.79Å; V801-C908 WeakPolarHBondContact CG2-SG 3.25Å; V801-Y910 HydrophobicContact CB-CD2 4.48Å; V801-L924 HydrophobicContact CB-CD1 4.48Å; V801-L924 HydrophobicContact CG1-CD1 3.88Å
802	Q	84.1	Confident	79.9	Confident	90 Å²	90	48.7 Å²	48.7	42%	0.421	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	130.9	178.9	-66.9	178.7	-9.3	0	0	111.2	L888 E889 P905	Q802-L888 CarbonylContact C-O 3.57Å; Q802-L888 VanDerWaalsContact CA-O 3.24Å; Q802-L888 WeakPolarHBondContact CA-O 3.43Å; Q802-E889 HydrophobicContact CG-CG 4.43Å; Q802-P905 VanDerWaalsContact O-CD 3.32Å; Q802-P905 WeakPolarHBondContact O-CD 3.45Å
803	Y	83.5	Confident	79.3	Confident	1 Å²	1	50.6 Å²	50.6	0%	0.004	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	137.1	175.2	-52	-80.3	0	0	0	110.2	I789 G791 V801 L887 L888 N890 L902 M904 L916	I789-Y803 HydrophobicContact CG2-CD1 4.48Å; I789-Y803 HydrophobicContact CG2-CD2 4.21Å; I789-Y803 HydrophobicContact CG2-CE1 3.88Å; I789-Y803 HydrophobicContact CG2-CE2 3.54Å; I789-Y803 WeakPolarHBondContact CG2-OH 3.43Å; G791-Y803 PolarHBondContact N-OH 3.13Å; V801-Y803 HydrophobicContact CG1-CE1 4.42Å; V801-Y803 HydrophobicContact CG1-CE2 4.02Å; V801-Y803 WeakPolarHBondContact CG1-OH 3.29Å; Y803-L887 CarbonylContact O-C 3.26Å; Y803-L887 WeakPolarHBondContact O-CA 3.22Å; Y803-L888 PolarHBondContact N-O 2.87Å; Y803-L888 PolarHBondContact O-N 3Å; Y803-N890 HydrophobicContact CE2-CB 4.07Å; Y803-L902 HydrophobicContact CD1-CD2 4.34Å; Y803-L902 HydrophobicContact CG-CD2 4.29Å; Y803-M904 HydrophobicContact CD1-SD 3.41Å; Y803-M904 WeakPolarHBondContact CD1-SD 3.49Å; Y803-M904 HydrophobicContact CE1-CE 4.45Å; Y803-M904 HydrophobicContact CE1-SD 3.59Å; Y803-M904 VanDerWaalsContact CE1-SD 3.59Å; Y803-L916 HydrophobicContact CD1-CD1 4.49Å; Y803-L916 HydrophobicContact CD1-CD2 4.22Å; Y803-L916 HydrophobicContact CE1-CD2 4.03Å
804	R	84.5	Confident	79	Confident	109 Å²	109	53.7 Å²	53.7	41%	0.411	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	117.5	176.2	179.8	-179.8	171.1	163.1	3.7	110.3	N806 F885 L887 T903 P905	R804-N806 PolarHBondContact NE-OD1 2.85Å; R804-N806 VanDerWaalsContact NE-OD1 3.12Å; R804-F885 HydrophobicContact CG-CB 4.37Å; R804-L887 HydrophobicContact CB-CD2 4.19Å; R804-T903 WeakPolarHBondContact CB-O 3.46Å; R804-T903 PolarHBondContact N-O 3.09Å; R804-T903 PolarHBondContact O-N 3.29Å; R804-T903 VanDerWaalsContact O-O 3.13Å; R804-T903 PolarHBondContact O-OG1 3.36Å; R804-P905 HydrophobicContact CB-CG 4.36Å
805	S	83.6	Confident	78.7	Confident	1 Å²	1	49 Å²	49	1%	0.007	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	121.4	169.8	-167.6	0	0	0	0	110	C807 F885 Q886 Q898	S805-C807 PolarHBondContact O-N 3.46Å; S805-C807 VanDerWaalsContact O-N 3.07Å; S805-F885 VanDerWaalsContact O-CA 3.22Å; S805-F885 WeakPolarHBondContact O-CA 3.46Å; S805-Q886 PolarHBondContact N-O 3.44Å; S805-Q886 PolarHBondContact O-N 3.15Å; S805-Q898 PolarHBondContact OG-NE2 3.28Å
806	N	83.6	Confident	78.4	Confident	69 Å²	69	49.7 Å²	49.7	37%	0.369	26%	0.255	S	S	.	.			trans	-85.3	45.5	-179.7	-63.2	-46.5	0	0	0	112.4	R804 V901 T903	R804-N806 PolarHBondContact NE-OD1 2.85Å; R804-N806 VanDerWaalsContact NE-OD1 3.12Å; N806-V901 WeakPolarHBondContact CB-O 3.48Å; N806-V901 PolarHBondContact N-O 3.36Å; N806-V901 PolarHBondContact ND2-O 2.96Å; N806-T903 WeakPolarHBondContact ND2-CG2 3.39Å; N806-T903 PolarHBondContact ND2-OG1 2.86Å
807	C	79.4	Confident	78.2	Confident	33 Å²	33	52.5 Å²	52.5	22%	0.223	28%	0.28	C	S	.	.	S	Bend	trans	-142.8	160	178.7	-85.6	0	0	0	0	111	S805 F812 N884 V901	S805-C807 PolarHBondContact O-N 3.46Å; S805-C807 VanDerWaalsContact O-N 3.07Å; C807-F812 HydrophobicContact CB-CD2 4.3Å; C807-F812 HydrophobicContact CB-CE2 3.84Å; C807-N884 CarbonylContact C-O 3.6Å; C807-N884 PolarHBondContact N-O 3.18Å; C807-V901 HydrophobicContact CB-CG2 4.32Å
808	K	80.1	Confident	77.6	Confident	113 Å²	113	51.7 Å²	51.7	49%	0.491	28%	0.28	S	S	.	.			trans	-66.2	134.6	176.1	-66.3	-177.3	-179.9	-177.8	0	110.6	S810 T811	K808-S810 VanDerWaalsContact C-N 3.28Å; K808-S810 PolarHBondContact O-N 3.39Å; K808-T811 VanDerWaalsContact O-CB 3.32Å; K808-T811 WeakPolarHBondContact O-CB 3.27Å; K808-T811 PolarHBondContact O-N 3.3Å; K808-T811 PolarHBondContact O-OG1 3.25Å
809	P	76.2	Confident	76.6	Confident	27 Å²	27	56.6 Å²	56.6	18%	0.175	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-51.3	-40.7	179.5	-27.8	32.3	0	0	0	113.9	T811 F812 A813 P883 Q886	P809-T811 PolarHBondContact O-N 2.88Å; P809-F812 PolarHBondContact O-N 3.5Å; P809-A813 VanDerWaalsContact O-CB 3.25Å; P809-A813 WeakPolarHBondContact O-CB 3.2Å; P809-A813 PolarHBondContact O-N 2.81Å; P809-P883 WeakPolarHBondContact CD-O 3.2Å; P809-P883 HydrophobicContact CG-CG 4.13Å; P809-Q886 HydrophobicContact CG-CB 4.28Å
810	S	75.6	Confident	75.5	Confident	61 Å²	61	59.4 Å²	59.4	43%	0.427	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-60.7	-17.2	-179.8	-79.9	0	0	0	0	115.2	K808 F812 E882	K808-S810 VanDerWaalsContact C-N 3.28Å; K808-S810 PolarHBondContact O-N 3.39Å; S810-F812 VanDerWaalsContact C-N 3.35Å; S810-E882 WeakPolarHBondContact CB-OE1 3.3Å; S810-E882 WeakPolarHBondContact CB-OE2 3.37Å; S810-E882 PolarHBondContact N-OE2 3.07Å; S810-E882 PolarHBondContact OG-OE1 3.24Å; S810-E882 PolarHBondContact OG-OE2 2.8Å; S810-E882 VanDerWaalsContact OG-OE2 3.09Å
811	T	78.1	Confident	74.3	Confident	23 Å²	23	56.8 Å²	56.8	14%	0.141	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-68.8	-37.3	176.8	-42.8	0	0	0	0	111.2	T700 F702 K808 P809	T700-T811 PolarHBondContact OG1-O 3.22Å; F702-T811 HydrophobicContact CD1-CG2 3.94Å; K808-T811 VanDerWaalsContact O-CB 3.32Å; K808-T811 WeakPolarHBondContact O-CB 3.27Å; K808-T811 PolarHBondContact O-N 3.3Å; K808-T811 PolarHBondContact O-OG1 3.25Å; P809-T811 PolarHBondContact O-N 2.88Å
812	F	74.8	Confident	73	Confident	19 Å²	19	63.5 Å²	63.5	8%	0.083	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.4	-2.9	-170.8	-59.1	-66.3	0	0	0	114	C807 P809 S810 R893 M895 A897 Q898	C807-F812 HydrophobicContact CB-CD2 4.3Å; C807-F812 HydrophobicContact CB-CE2 3.84Å; P809-F812 PolarHBondContact O-N 3.5Å; S810-F812 VanDerWaalsContact C-N 3.35Å; F812-R893 PolarHBondContact O-NH1 3.48Å; F812-M895 HydrophobicContact CD1-CB 4.37Å; F812-M895 HydrophobicContact CD1-CE 4.26Å; F812-M895 HydrophobicContact CD1-CG 4.27Å; F812-M895 HydrophobicContact CD1-SD 3.75Å; F812-M895 HydrophobicContact CE1-CB 4.46Å; F812-M895 HydrophobicContact CE1-SD 4.25Å; F812-A897 HydrophobicContact CE1-CB 4.39Å; F812-Q898 HydrophobicContact CD1-CB 4.05Å; F812-Q898 HydrophobicContact CD1-CG 4.36Å; F812-Q898 HydrophobicContact CD2-CB 4.24Å; F812-Q898 HydrophobicContact CD2-CG 3.76Å; F812-Q898 HydrophobicContact CE1-CB 3.86Å; F812-Q898 HydrophobicContact CE1-CG 4.44Å; F812-Q898 HydrophobicContact CE2-CB 4.04Å; F812-Q898 HydrophobicContact CE2-CG 3.84Å; F812-Q898 HydrophobicContact CG-CB 4.24Å; F812-Q898 HydrophobicContact CG-CG 4.03Å; F812-Q898 HydrophobicContact CZ-CB 3.85Å; F812-Q898 HydrophobicContact CZ-CG 4.18Å
813	A	72.1	Confident	71.5	Confident	40 Å²	40	65.3 Å²	65.3	33%	0.331	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-57.1	151.4	177.2	0	0	0	0	0	112	P809	P809-A813 VanDerWaalsContact O-CB 3.25Å; P809-A813 WeakPolarHBondContact O-CB 3.2Å; P809-A813 PolarHBondContact O-N 2.81Å
814	Y	76.9	Confident	70.1	Confident	69 Å²	69	69.8 Å²	69.8	27%	0.271	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-64.7	139.4	169	-63.4	-79.2	0	0	0	109.6	N348 R743 N744 R893	N348-Y814 HydrophobicContact CB-CD1 4.15Å; N348-Y814 HydrophobicContact CB-CE1 4.37Å; N348-Y814 HydrophobicContact CB-CG 4.27Å; N348-Y814 WeakPolarHBondContact ND2-CE2 3.49Å; N348-Y814 VanDerWaalsContact ND2-CZ 3.31Å; R743-Y814 HydrophobicContact CB-CD1 4.11Å; R743-Y814 HydrophobicContact CB-CE1 4.22Å; N744-Y814 WeakPolarHBondContact OD1-CE1 3.36Å; N744-Y814 PolarHBondContact OD1-OH 3.43Å; Y814-R893 VanDerWaalsContact OH-CB 3.3Å; Y814-R893 WeakPolarHBondContact OH-CB 3.42Å; Y814-R893 WeakPolarHBondContact OH-CD 3.3Å
815	P	69.6	Low	68.6	Low	23 Å²	23	70.7 Å²	70.7	15%	0.149	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-57.2	137.5	170.1	-19.7	27.8	0	0	0	109.8	R743	R743-P815 PolarHBondContact NH1-O 2.92Å
816	P	70.4	Confident	67.4	Low	106 Å²	106	77.9 Å²	77.9	69%	0.688	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-59.5	143.5	-179.5	24.7	-33.3	0	0	0	110.8
817	A	70.3	Confident	66.1	Low	72 Å²	72	80.5 Å²	80.5	60%	0.595	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-61.6	148.4	172.7	0	0	0	0	0	110.4	E819	A817-E819 PolarHBondContact O-N 3.42Å
818	L	67.9	Low	65.2	Low	96 Å²	96	86.1 Å²	86.1	50%	0.503	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-69.7	125.8	175.9	-67.3	171.6	0	0	0	109.4	D350 M352 I353	D350-L818 WeakPolarHBondContact OD2-CB 3.39Å; D350-L818 PolarHBondContact OD2-N 2.98Å; M352-L818 WeakPolarHBondContact CE-O 3.32Å; I353-L818 HydrophobicContact CG1-CD1 3.85Å
819	E	58.7	Low	64.5	Low	110 Å²	110	85.1 Å²	85.1	51%	0.514	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-64.4	142.2	172.7	-68.7	168.9	164.5	0	0	111.2	A817 K824	A817-E819 PolarHBondContact O-N 3.42Å; E819-K824 WeakPolarHBondContact OE2-CE 3.36Å; E819-K824 IonicContact OE2-NZ 2.62Å; E819-K824 PolarHBondContact OE2-NZ 2.82Å
820	V	55.5	Low	63.9	Low	60 Å²	60	86.4 Å²	86.4	36%	0.364	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-55.8	127.5	-177.2	-167.7	0	0	0	0	109.7	M352 K822 E823	M352-V820 HydrophobicContact CE-CB 4.04Å; M352-V820 HydrophobicContact CE-CG2 3.27Å; M352-V820 VanDerWaalsContact SD-CA 3.59Å; M352-V820 HydrophobicContact SD-CB 4.16Å; M352-V820 HydrophobicContact SD-CG1 4.4Å; M352-V820 HydrophobicContact SD-CG2 3.98Å; V820-K822 HydrophobicContact CG1-CB 3.91Å; V820-K822 HydrophobicContact CG1-CD 4.47Å; V820-K822 HydrophobicContact CG1-CG 4.16Å; V820-K822 PolarHBondContact O-N 3.39Å; V820-E823 PolarHBondContact O-N 3.31Å
821	P	54.5	Low	63.8	Low	63 Å²	63	87.3 Å²	87.3	41%	0.409	46%	0.458	S	S	.	.	H	α-helix	trans	-52.9	-29.9	177.1	-26.4	32.5	0	0	0	113.3	E823 K824 E825	P821-E823 VanDerWaalsContact C-N 3.27Å; P821-E823 PolarHBondContact O-N 3.27Å; P821-K824 PolarHBondContact O-N 3.44Å; P821-E825 WeakPolarHBondContact O-CB 3.08Å; P821-E825 PolarHBondContact O-N 3.41Å
822	K	53.3	Low	63.5	Low	149 Å²	149	88.2 Å²	88.2	65%	0.648	47%	0.468	S	S	*	.	H	α-helix	trans	-59.4	-30.8	176.6	-67.7	-177.6	179.8	175.6	0	113.5	V820 K826	V820-K822 HydrophobicContact CG1-CB 3.91Å; V820-K822 HydrophobicContact CG1-CD 4.47Å; V820-K822 HydrophobicContact CG1-CG 4.16Å; V820-K822 PolarHBondContact O-N 3.39Å; K822-K826 VanDerWaalsContact O-CB 3.3Å; K822-K826 WeakPolarHBondContact O-CB 3.3Å; K822-K826 VanDerWaalsContact O-CD 3.3Å; K822-K826 WeakPolarHBondContact O-CD 3.41Å; K822-K826 WeakPolarHBondContact O-CG 3.25Å; K822-K826 PolarHBondContact O-N 3.3Å; K822-K826 VanDerWaalsContact O-N 3.13Å
823	E	52.2	Low	63.3	Low	127 Å²	127	91 Å²	91	59%	0.593	49%	0.487	S	S	*	.	H	α-helix	trans	-75.4	-44.8	174.4	-85.9	-168.5	136.8	0	0	111.6	V820 P821 E825 K826 E827	V820-E823 PolarHBondContact O-N 3.31Å; P821-E823 VanDerWaalsContact C-N 3.27Å; P821-E823 PolarHBondContact O-N 3.27Å; E823-E825 PolarHBondContact O-N 2.91Å; E823-K826 PolarHBondContact O-N 3.19Å; E823-E827 WeakPolarHBondContact O-CB 2.88Å; E823-E827 PolarHBondContact O-N 3.46Å
824	K	54.7	Low	63.3	Low	96 Å²	96	94.7 Å²	94.7	42%	0.417	50%	0.5	S	S	.	.	H	α-helix	trans	-67.5	-34.8	177.9	-71.3	-178.2	177.3	162.4	0	112.8	E819 P821 E827 K828	E819-K824 WeakPolarHBondContact OE2-CE 3.36Å; E819-K824 IonicContact OE2-NZ 2.62Å; E819-K824 PolarHBondContact OE2-NZ 2.82Å; P821-K824 PolarHBondContact O-N 3.44Å; K824-E827 PolarHBondContact O-N 3.48Å; K824-K828 VanDerWaalsContact O-CB 3.32Å; K824-K828 WeakPolarHBondContact O-CB 3.38Å; K824-K828 VanDerWaalsContact O-CG 3.24Å; K824-K828 WeakPolarHBondContact O-CG 3.44Å; K824-K828 PolarHBondContact O-N 3.49Å
825	E	53.8	Low	63	Low	128 Å²	128	94.7 Å²	94.7	60%	0.598	51%	0.51	S	S	*	.	H	α-helix	trans	-69.4	-41.9	172.2	-77.7	-171.3	159.1	0	0	111.3	P821 E823 E827 K828 V829	P821-E825 WeakPolarHBondContact O-CB 3.08Å; P821-E825 PolarHBondContact O-N 3.41Å; E823-E825 PolarHBondContact O-N 2.91Å; E825-E827 VanDerWaalsContact C-N 3.28Å; E825-E827 PolarHBondContact O-N 2.99Å; E825-K828 PolarHBondContact O-N 2.99Å; E825-V829 WeakPolarHBondContact O-CB 3.23Å; E825-V829 WeakPolarHBondContact O-CG2 3.28Å; E825-V829 PolarHBondContact O-N 3.18Å
826	K	58.2	Low	63.4	Low	151 Å²	151	99.2 Å²	99.2	66%	0.657	53%	0.532	S	S	*	.	H	α-helix	trans	-61.4	-37	172.7	-76.2	171.4	-175.2	-177.1	0	112	K822 E823 S830	K822-K826 VanDerWaalsContact O-CB 3.3Å; K822-K826 WeakPolarHBondContact O-CB 3.3Å; K822-K826 VanDerWaalsContact O-CD 3.3Å; K822-K826 WeakPolarHBondContact O-CD 3.41Å; K822-K826 WeakPolarHBondContact O-CG 3.25Å; K822-K826 PolarHBondContact O-N 3.3Å; K822-K826 VanDerWaalsContact O-N 3.13Å; E823-K826 PolarHBondContact O-N 3.19Å; K826-S830 VanDerWaalsContact O-CB 3.27Å; K826-S830 WeakPolarHBondContact O-CB 3.37Å; K826-S830 PolarHBondContact O-N 2.95Å; K826-S830 PolarHBondContact O-OG 3.02Å
827	E	55.4	Low	63.7	Low	124 Å²	124	97.2 Å²	97.2	58%	0.579	52%	0.518	S	S	*	.	H	α-helix	trans	-72.2	-41.6	177.2	-163.7	175.9	-164.7	0	0	112.4	E823 K824 E825 S830 T831	E823-E827 WeakPolarHBondContact O-CB 2.88Å; E823-E827 PolarHBondContact O-N 3.46Å; K824-E827 PolarHBondContact O-N 3.48Å; E825-E827 VanDerWaalsContact C-N 3.28Å; E825-E827 PolarHBondContact O-N 2.99Å; E827-S830 PolarHBondContact O-N 2.9Å; E827-S830 PolarHBondContact O-OG 3Å; E827-T831 PolarHBondContact O-N 3.46Å; E827-T831 PolarHBondContact O-OG1 3.05Å
828	K	62	Low	63.9	Low	152 Å²	152	96.4 Å²	96.4	66%	0.661	51%	0.511	S	S	*	.	H	α-helix	trans	-68.5	-37.9	174.3	-74.6	177.4	-177.5	-177.7	0	112.5	K824 E825 T831 A832	K824-K828 VanDerWaalsContact O-CB 3.32Å; K824-K828 WeakPolarHBondContact O-CB 3.38Å; K824-K828 VanDerWaalsContact O-CG 3.24Å; K824-K828 WeakPolarHBondContact O-CG 3.44Å; K824-K828 PolarHBondContact O-N 3.49Å; E825-K828 PolarHBondContact O-N 2.99Å; K828-T831 VanDerWaalsContact CA-OG1 3.3Å; K828-T831 WeakPolarHBondContact CA-OG1 3.17Å; K828-T831 PolarHBondContact O-OG1 2.78Å; K828-T831 VanDerWaalsContact O-OG1 3.13Å; K828-A832 WeakPolarHBondContact O-CB 3.3Å; K828-A832 PolarHBondContact O-N 3.28Å
829	V	64.2	Low	64.4	Low	91 Å²	91	99.1 Å²	99.1	55%	0.552	52%	0.519	S	S	*	.	H	α-helix	trans	-68.9	-41.5	175.5	172.1	0	0	0	0	109.9	E825 A832 V833	E825-V829 WeakPolarHBondContact O-CB 3.23Å; E825-V829 WeakPolarHBondContact O-CG2 3.28Å; E825-V829 PolarHBondContact O-N 3.18Å; V829-A832 PolarHBondContact O-N 2.94Å; V829-V833 HydrophobicContact CG1-CG2 4.17Å; V829-V833 WeakPolarHBondContact O-CB 3.41Å; V829-V833 WeakPolarHBondContact O-CG2 3.38Å; V829-V833 PolarHBondContact O-N 3.4Å
830	S	64.9	Low	65.1	Low	55 Å²	55	96.3 Å²	96.3	39%	0.385	52%	0.515	S	S	.	.	H	α-helix	trans	-66.3	-40.5	176.8	69.6	0	0	0	0	112.1	K826 E827 V833 L834	K826-S830 VanDerWaalsContact O-CB 3.27Å; K826-S830 WeakPolarHBondContact O-CB 3.37Å; K826-S830 PolarHBondContact O-N 2.95Å; K826-S830 PolarHBondContact O-OG 3.02Å; E827-S830 PolarHBondContact O-N 2.9Å; E827-S830 PolarHBondContact O-OG 3Å; S830-V833 PolarHBondContact O-N 2.9Å; S830-L834 VanDerWaalsContact O-CB 3.28Å; S830-L834 WeakPolarHBondContact O-CB 3.45Å; S830-L834 WeakPolarHBondContact O-CD1 3.22Å; S830-L834 WeakPolarHBondContact O-CG 3.31Å; S830-L834 PolarHBondContact O-N 2.94Å
831	T	71.8	Confident	66.1	Low	79 Å²	79	100.2 Å²	100.2	49%	0.485	53%	0.527	S	S	.	.	H	α-helix	trans	-67.6	-37.8	173.2	36.3	0	0	0	0	113	E827 K828 L834 S835	E827-T831 PolarHBondContact O-N 3.46Å; E827-T831 PolarHBondContact O-OG1 3.05Å; K828-T831 VanDerWaalsContact CA-OG1 3.3Å; K828-T831 WeakPolarHBondContact CA-OG1 3.17Å; K828-T831 PolarHBondContact O-OG1 2.78Å; K828-T831 VanDerWaalsContact O-OG1 3.13Å; T831-L834 PolarHBondContact O-N 3.01Å; T831-S835 WeakPolarHBondContact O-CB 3.14Å; T831-S835 PolarHBondContact O-N 3.49Å; T831-S835 PolarHBondContact O-OG 2.6Å
832	A	72.4	Confident	67.1	Low	43 Å²	43	104.3 Å²	104.3	36%	0.355	54%	0.538	S	S	.	.	H	α-helix	trans	-65.1	-43.7	172.9	0	0	0	0	0	111.8	K828 V829 S835 I836	K828-A832 WeakPolarHBondContact O-CB 3.3Å; K828-A832 PolarHBondContact O-N 3.28Å; V829-A832 PolarHBondContact O-N 2.94Å; A832-S835 WeakPolarHBondContact CA-OG 3.28Å; A832-S835 PolarHBondContact O-N 2.81Å; A832-S835 PolarHBondContact O-OG 3.41Å; A832-I836 WeakPolarHBondContact O-CB 3.14Å; A832-I836 WeakPolarHBondContact O-CD1 3.41Å; A832-I836 WeakPolarHBondContact O-CG1 3.34Å; A832-I836 PolarHBondContact O-N 2.8Å
833	V	71.1	Confident	68	Low	78 Å²	78	103.8 Å²	103.8	47%	0.473	54%	0.536	S	S	.	.	H	α-helix	trans	-65.5	-42.8	176.4	173.6	0	0	0	0	110.3	V829 S830 I836 T837	V829-V833 HydrophobicContact CG1-CG2 4.17Å; V829-V833 WeakPolarHBondContact O-CB 3.41Å; V829-V833 WeakPolarHBondContact O-CG2 3.38Å; V829-V833 PolarHBondContact O-N 3.4Å; S830-V833 PolarHBondContact O-N 2.9Å; V833-I836 PolarHBondContact O-N 2.84Å; V833-T837 VanDerWaalsContact O-CB 3.22Å; V833-T837 WeakPolarHBondContact O-CB 3.09Å; V833-T837 PolarHBondContact O-N 2.81Å; V833-T837 PolarHBondContact O-OG1 2.98Å
834	L	71.9	Confident	68.9	Low	117 Å²	117	103.7 Å²	103.7	61%	0.613	54%	0.536	S	S	*	.	H	α-helix	trans	-64.2	-41.1	177.2	-74.9	166	0	0	0	112.3	S830 T831 T837 A838	S830-L834 VanDerWaalsContact O-CB 3.28Å; S830-L834 WeakPolarHBondContact O-CB 3.45Å; S830-L834 WeakPolarHBondContact O-CD1 3.22Å; S830-L834 WeakPolarHBondContact O-CG 3.31Å; S830-L834 PolarHBondContact O-N 2.94Å; T831-L834 PolarHBondContact O-N 3.01Å; L834-T837 PolarHBondContact O-N 3.43Å; L834-A838 WeakPolarHBondContact O-CB 3.19Å; L834-A838 PolarHBondContact O-N 3.17Å
835	S	70.9	Confident	69.6	Low	69 Å²	69	106 Å²	106	48%	0.483	55%	0.545	S	S	.	.	H	α-helix	trans	-69.3	-39.5	176.9	58	0	0	0	0	112.3	T831 A832 K839	T831-S835 WeakPolarHBondContact O-CB 3.14Å; T831-S835 PolarHBondContact O-N 3.49Å; T831-S835 PolarHBondContact O-OG 2.6Å; A832-S835 WeakPolarHBondContact CA-OG 3.28Å; A832-S835 PolarHBondContact O-N 2.81Å; A832-S835 PolarHBondContact O-OG 3.41Å; S835-K839 WeakPolarHBondContact O-CB 3.27Å; S835-K839 PolarHBondContact O-N 3.48Å
836	I	78.4	Confident	70.2	Confident	117 Å²	117	104.7 Å²	104.7	60%	0.6	54%	0.539	S	S	*	.	H	α-helix	trans	-65.6	-42	172.7	-66.7	165.5	0	0	0	110.5	A832 V833 K839 A840	A832-I836 WeakPolarHBondContact O-CB 3.14Å; A832-I836 WeakPolarHBondContact O-CD1 3.41Å; A832-I836 WeakPolarHBondContact O-CG1 3.34Å; A832-I836 PolarHBondContact O-N 2.8Å; V833-I836 PolarHBondContact O-N 2.84Å; I836-K839 PolarHBondContact O-N 3.39Å; I836-A840 VanDerWaalsContact O-CB 3.31Å; I836-A840 WeakPolarHBondContact O-CB 3.42Å; I836-A840 PolarHBondContact O-N 3.26Å
837	T	76.4	Confident	70.6	Confident	65 Å²	65	104.8 Å²	104.8	40%	0.399	54%	0.54	S	S	.	.	H	α-helix	trans	-68.7	-39.7	-180	-51.9	0	0	0	0	111.7	V833 L834 A840 K841	V833-T837 VanDerWaalsContact O-CB 3.22Å; V833-T837 WeakPolarHBondContact O-CB 3.09Å; V833-T837 PolarHBondContact O-N 2.81Å; V833-T837 PolarHBondContact O-OG1 2.98Å; L834-T837 PolarHBondContact O-N 3.43Å; T837-A840 PolarHBondContact O-N 3.13Å; T837-K841 PolarHBondContact O-N 3.29Å
838	A	74	Confident	70.9	Confident	55 Å²	55	105.5 Å²	105.5	46%	0.455	54%	0.541	S	S	.	.	H	α-helix	trans	-67.1	-39.6	173.6	0	0	0	0	0	111.7	L834 K841 K842	L834-A838 WeakPolarHBondContact O-CB 3.19Å; L834-A838 PolarHBondContact O-N 3.17Å; A838-K841 PolarHBondContact O-N 2.91Å; A838-K842 WeakPolarHBondContact O-CB 3.07Å; A838-K842 PolarHBondContact O-N 2.86Å
839	K	77.3	Confident	70.7	Confident	153 Å²	153	103.1 Å²	103.1	67%	0.665	53%	0.532	S	S	*	.	H	α-helix	trans	-68.7	-34.1	175.6	-162.8	170.6	-171.7	173.4	0	112	S835 I836 K843	S835-K839 WeakPolarHBondContact O-CB 3.27Å; S835-K839 PolarHBondContact O-N 3.48Å; I836-K839 PolarHBondContact O-N 3.39Å; K839-K843 WeakPolarHBondContact O-CB 3.3Å; K839-K843 PolarHBondContact O-N 2.65Å
840	A	75.2	Confident	70.3	Confident	51 Å²	51	105.5 Å²	105.5	42%	0.421	54%	0.535	S	S	.	.	H	α-helix	trans	-67.2	-46.3	172.5	0	0	0	0	0	111.7	I836 T837 K842 K843 E844	I836-A840 VanDerWaalsContact O-CB 3.31Å; I836-A840 WeakPolarHBondContact O-CB 3.42Å; I836-A840 PolarHBondContact O-N 3.26Å; T837-A840 PolarHBondContact O-N 3.13Å; A840-K842 PolarHBondContact O-N 2.94Å; A840-K843 PolarHBondContact O-N 2.76Å; A840-E844 PolarHBondContact O-N 3.46Å
841	K	76.4	Confident	69.6	Low	141 Å²	141	110.5 Å²	110.5	61%	0.613	55%	0.552	S	S	*	*	H	α-helix	trans	-63.7	-38.2	174.3	-78.9	-175.2	175.6	-179.1	0	113	T837 A838 E844 K845	T837-K841 PolarHBondContact O-N 3.29Å; A838-K841 PolarHBondContact O-N 2.91Å; K841-E844 PolarHBondContact O-N 3.08Å; K841-K845 PolarHBondContact O-N 2.96Å
842	K	74.1	Confident	68.5	Low	150 Å²	150	114.5 Å²	114.5	65%	0.652	57%	0.565	S	S	*	*	H	α-helix	trans	-63.6	-43.5	171.9	-86.3	-171.8	174	-175.9	0	111.5	A838 A840 E844 K845 E846	A838-K842 WeakPolarHBondContact O-CB 3.07Å; A838-K842 PolarHBondContact O-N 2.86Å; A840-K842 PolarHBondContact O-N 2.94Å; K842-E844 VanDerWaalsContact C-N 3.34Å; K842-E844 PolarHBondContact O-N 2.99Å; K842-K845 PolarHBondContact O-N 3.18Å; K842-E846 WeakPolarHBondContact O-CB 3.11Å; K842-E846 WeakPolarHBondContact O-CG 3.4Å; K842-E846 PolarHBondContact O-N 3.01Å
843	K	73.5	Confident	66.9	Low	137 Å²	137	119.8 Å²	119.8	60%	0.596	58%	0.583	S	S	*	*	H	α-helix	trans	-63.4	-35.2	174.4	-99.4	-173.6	171.7	-177.2	0	113.5	K839 A840 K847	K839-K843 WeakPolarHBondContact O-CB 3.3Å; K839-K843 PolarHBondContact O-N 2.65Å; A840-K843 PolarHBondContact O-N 2.76Å; K843-K847 WeakPolarHBondContact O-CB 3.3Å; K843-K847 WeakPolarHBondContact O-CG 3.41Å; K843-K847 PolarHBondContact O-N 3Å
844	E	70.8	Confident	65.4	Low	126 Å²	126	124.9 Å²	124.9	59%	0.589	60%	0.599	S	S	*	*	H	α-helix	trans	-70.1	-39.4	173.4	-83	-171.1	149.7	0	0	112.2	A840 K841 K842 K847 K848	A840-E844 PolarHBondContact O-N 3.46Å; K841-E844 PolarHBondContact O-N 3.08Å; K842-E844 VanDerWaalsContact C-N 3.34Å; K842-E844 PolarHBondContact O-N 2.99Å; E844-K847 PolarHBondContact O-N 3.16Å; E844-K848 WeakPolarHBondContact O-CG 3.46Å; E844-K848 PolarHBondContact O-N 2.67Å
845	K	69.6	Low	63.8	Low	143 Å²	143	127.6 Å²	127.6	62%	0.622	61%	0.61	S	S	*	*	H	α-helix	trans	-63.3	-47.2	171.7	-87.4	-168.6	169.8	-166	0	112.1	K841 K842 K847 K848 E849	K841-K845 PolarHBondContact O-N 2.96Å; K842-K845 PolarHBondContact O-N 3.18Å; K845-K847 PolarHBondContact O-N 2.93Å; K845-K848 CarbonylContact O-C 3.58Å; K845-K848 PolarHBondContact O-N 3.09Å; K845-E849 WeakPolarHBondContact O-CB 3.38Å; K845-E849 WeakPolarHBondContact O-CG 3.5Å; K845-E849 PolarHBondContact O-N 2.99Å
846	E	65.3	Low	61.7	Low	101 Å²	101	133.5 Å²	133.5	47%	0.472	63%	0.63	S	S	.	*	H	α-helix	trans	-61.8	-30.8	175.1	-76.9	177	-176.5	0	0	112.4	K842 K850	K842-E846 WeakPolarHBondContact O-CB 3.11Å; K842-E846 WeakPolarHBondContact O-CG 3.4Å; K842-E846 PolarHBondContact O-N 3.01Å; E846-K850 WeakPolarHBondContact O-CB 3.33Å; E846-K850 WeakPolarHBondContact O-CG 3.48Å; E846-K850 PolarHBondContact O-N 3.27Å
847	K	66.4	Low	59.3	Low	154 Å²	154	134.3 Å²	134.3	67%	0.67	64%	0.641	S	S	*	*	H	α-helix	trans	-70.6	-38.7	172.6	-85.3	-176.8	175.6	-173.4	0	112.2	K843 E844 K845 E851	K843-K847 WeakPolarHBondContact O-CB 3.3Å; K843-K847 WeakPolarHBondContact O-CG 3.41Å; K843-K847 PolarHBondContact O-N 3Å; E844-K847 PolarHBondContact O-N 3.16Å; K845-K847 PolarHBondContact O-N 2.93Å; K847-E851 PolarHBondContact O-N 3Å; K847-E851 VanDerWaalsContact O-N 3.14Å
848	K	62.4	Low	56.9	Low	139 Å²	139	139.7 Å²	139.7	60%	0.604	66%	0.661	S	S	*	*	H	α-helix	trans	-69	-43	174.6	-73.5	-179.1	176	-174.9	0	111.6	E844 K845 K850 E851 E852	E844-K848 WeakPolarHBondContact O-CG 3.46Å; E844-K848 PolarHBondContact O-N 2.67Å; K845-K848 CarbonylContact O-C 3.58Å; K845-K848 PolarHBondContact O-N 3.09Å; K848-K850 VanDerWaalsContact C-N 3.34Å; K848-K850 PolarHBondContact O-N 2.88Å; K848-E851 PolarHBondContact O-N 3.28Å; K848-E851 VanDerWaalsContact O-N 3.09Å; K848-E852 PolarHBondContact O-N 3.34Å
849	E	57.2	Low	54.8	Low	101 Å²	101	142.8 Å²	142.8	47%	0.472	67%	0.674	S	S	.	*	H	α-helix	trans	-63.8	-37.1	174	-72.5	168.5	-178	0	0	111.2	K845 E851 E852 E853	K845-E849 WeakPolarHBondContact O-CB 3.38Å; K845-E849 WeakPolarHBondContact O-CG 3.5Å; K845-E849 PolarHBondContact O-N 2.99Å; E849-E851 VanDerWaalsContact C-N 3.3Å; E849-E851 PolarHBondContact O-N 3.26Å; E849-E852 CarbonylContact O-C 3.49Å; E849-E852 PolarHBondContact O-N 3.37Å; E849-E853 WeakPolarHBondContact O-CB 3.43Å; E849-E853 PolarHBondContact O-N 2.93Å
850	K	55.4	Low	52.4	Low	141 Å²	141	144.6 Å²	144.6	61%	0.613	69%	0.685	S	S	*	*	H	α-helix	trans	-69.7	-19.6	171.8	-80.8	177.2	178.4	178.2	0	115.1	E846 K848	E846-K850 WeakPolarHBondContact O-CB 3.33Å; E846-K850 WeakPolarHBondContact O-CG 3.48Å; E846-K850 PolarHBondContact O-N 3.27Å; K848-K850 VanDerWaalsContact C-N 3.34Å; K848-K850 PolarHBondContact O-N 2.88Å
851	E	51.8	Low	50.1	Low	161 Å²	161	151.9 Å²	151.9	75%	0.752	71%	0.71	S	S	*	*	H	α-helix	trans	-82.9	-29.8	169.5	-78.6	-176.3	163.7	0	0	111.4	K847 K848 E849	K847-E851 PolarHBondContact O-N 3Å; K847-E851 VanDerWaalsContact O-N 3.14Å; K848-E851 PolarHBondContact O-N 3.28Å; K848-E851 VanDerWaalsContact O-N 3.09Å; E849-E851 VanDerWaalsContact C-N 3.3Å; E849-E851 PolarHBondContact O-N 3.26Å
852	E	47.5	Very low	47.6	Very low	162 Å²	162	148.8 Å²	148.8	76%	0.757	72%	0.719	S	S	*	*	H	α-helix	trans	-83.9	-30.2	177.5	-70.7	179	173.5	0	0	113.7	K848 E849 K854	K848-E852 PolarHBondContact O-N 3.34Å; E849-E852 CarbonylContact O-C 3.49Å; E849-E852 PolarHBondContact O-N 3.37Å; E852-K854 VanDerWaalsContact C-N 3.32Å; E852-K854 PolarHBondContact O-N 3.43Å
853	E	39.1	Very low	45.3	Very low	154 Å²	154	150.6 Å²	150.6	72%	0.72	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	8	-179.7	-79.6	-172.4	155.7	0	0	115.2	E849 M855	E849-E853 WeakPolarHBondContact O-CB 3.43Å; E849-E853 PolarHBondContact O-N 2.93Å; E853-M855 PolarHBondContact O-N 3.18Å
854	K	38.9	Very low	43	Very low	185 Å²	185	154.1 Å²	154.1	80%	0.804	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	9.7	175.9	-83.3	-174.4	180	177.6	0	115.1	E852	E852-K854 VanDerWaalsContact C-N 3.32Å; E852-K854 PolarHBondContact O-N 3.43Å
855	M	39.2	Very low	40.8	Very low	175 Å²	175	156.3 Å²	156.3	86%	0.862	76%	0.755	S	S	*	*	S	Bend	trans	-132.5	80.2	169.3	-83.8	-174.7	170	0	0	110.7	E853	E853-M855 PolarHBondContact O-N 3.18Å
856	E	26.8	Very low	38.7	Very low	192 Å²	192	158.5 Å²	158.5	90%	0.897	76%	0.764	S	S	*	*				161.6	135.5	129.4	-88.5	-178.4	168.5	0	0	110.4
857	V	28.3	Very low	36.7	Very low	135 Å²	135	162.4 Å²	162.4	82%	0.818	78%	0.783	S	S	*	*			trans	-118.7	129.7	-177.1	-176	0	0	0	0	107.8
858	E	26.8	Very low	34.7	Very low	177 Å²	177	164.9 Å²	164.9	83%	0.827	79%	0.794	S	S	*	*				164.3	126	123.3	-91	-163.7	157.5	0	0	115.7
859	V	29.3	Very low	32.9	Very low	120 Å²	120	167.4 Å²	167.4	73%	0.727	81%	0.805	S	S	*	*			trans	58.5	118.7	139.8	-161.3	0	0	0	0	122
860	Q	26.7	Very low	31.3	Very low	192 Å²	192	169.1 Å²	169.1	90%	0.897	82%	0.817	S	S	*	*				174.7	142.2	114.8	-93.9	-174.9	1.1	0	0	113.5
861	E	27.5	Very low	29.8	Very low	203 Å²	203	171.2 Å²	171.2	95%	0.949	83%	0.829	S	S	*	*			trans	-75.7	147.3	171.5	-68.4	179.9	145.3	0	0	112.5
862	G	24.3	Very low	28.5	Very low	77 Å²	77	171.5 Å²	171.5	79%	0.794	83%	0.83	S	S	*	*			trans	164.7	114.6	165.7	0	0	0	0	0	115.6
863	E	25.3	Very low	27.5	Very low	188 Å²	188	172.6 Å²	172.6	88%	0.879	83%	0.833	S	S	*	*			trans	-14.3	137.5	170.7	-62.8	176	150.4	0	0	120.7
864	K	24.7	Very low	26.8	Very low	210 Å²	210	173 Å²	173	91%	0.913	83%	0.834	S	S	*	*				-174.4	134.4	119.3	-102.1	166.4	-173.4	176.2	0	114.4
865	E	25.1	Very low	26.2	Very low	172 Å²	172	173 Å²	173	80%	0.804	84%	0.835	S	S	*	*			trans	-61.4	165.8	165.6	-59.1	176.3	129.5	0	0	113.5
866	K	24.5	Very low	25.5	Very low	189 Å²	189	172.7 Å²	172.7	82%	0.822	83%	0.831	S	S	*	*			trans	82.9	99.3	162.1	-64	176.3	178.7	172.1	0	117.4
867	E	23.5	Very low	25.7	Very low	184 Å²	184	172.3 Å²	172.3	86%	0.86	83%	0.826	S	S	*	*				173.4	89.4	110.9	-93.4	-177.5	168.8	0	0	109.9
868	K	24.8	Very low	25.8	Very low	206 Å²	206	175.3 Å²	175.3	90%	0.896	83%	0.828	S	S	*	*			trans	-101.5	100.1	146.2	-85.1	-175.6	177.8	177.6	0	105.4
869	K	23.7	Very low	26.3	Very low	192 Å²	192	176 Å²	176	84%	0.835	83%	0.828	S	S	*	*			trans	-105.1	120.2	156.6	-104.1	-174.9	175.2	-179.4	0	107
870	D	24.5	Very low	26.8	Very low	136 Å²	136	178.6 Å²	178.6	73%	0.727	83%	0.833	S	S	*	*			trans	-52.5	132.2	175.2	-58.1	-64.2	0	0	0	111.1	E872	D870-E872 VanDerWaalsContact C-N 3.28Å
871	E	23.8	Very low	27.9	Very low	185 Å²	185	176.5 Å²	176.5	86%	0.864	83%	0.833	S	S	*	*			trans	-94.2	63.6	153.7	-77.7	-168.4	142.6	0	0	108.1
872	E	24.8	Very low	29.2	Very low	167 Å²	167	169.8 Å²	169.8	78%	0.78	80%	0.801	S	S	*	*			trans	-83.9	98.9	147.7	-86.6	-173.2	160.6	0	0	106.4	D870 E874	D870-E872 VanDerWaalsContact C-N 3.28Å; E872-E874 PolarHBondContact O-N 3.07Å
873	K	25.3	Very low	31.3	Very low	186 Å²	186	169.7 Å²	169.7	81%	0.809	79%	0.787	S	S	*	*			trans	-68.9	83.3	163	-82.6	-179.5	176.4	172.7	0	107.9	K875	K873-K875 VanDerWaalsContact C-N 3.35Å; K873-K875 PolarHBondContact O-N 3.34Å
874	E	24.3	Very low	33.8	Very low	161 Å²	161	166.1 Å²	166.1	75%	0.752	77%	0.774	S	S	*	*			trans	-61.1	103.7	150.5	-83.1	-170.1	147	0	0	106.9	E872 E876	E872-E874 PolarHBondContact O-N 3.07Å; E874-E876 PolarHBondContact O-N 3Å
875	K	26.7	Very low	36.2	Very low	187 Å²	187	160.7 Å²	160.7	81%	0.813	75%	0.75	S	S	*	*			trans	-67.6	84.5	154.1	-81.5	-179.8	177.4	173.7	0	106.3	K873 K877	K873-K875 VanDerWaalsContact C-N 3.35Å; K873-K875 PolarHBondContact O-N 3.34Å; K875-K877 PolarHBondContact O-N 3.44Å
876	E	25.9	Very low	38.8	Very low	168 Å²	168	155.3 Å²	155.3	79%	0.785	73%	0.725	S	S	*	*			trans	-58.5	99.2	151.5	-80.5	-169.6	146.8	0	0	106.1	E874 K878	E874-E876 PolarHBondContact O-N 3Å; E876-K878 VanDerWaalsContact C-N 3.32Å; E876-K878 PolarHBondContact O-N 3.23Å
877	K	30.5	Very low	41.6	Very low	184 Å²	184	150.4 Å²	150.4	80%	0.8	71%	0.708	S	S	*	*			trans	-55.7	106.9	157.8	-83	-177	177.5	178.6	0	104.8	K875 K879	K875-K877 PolarHBondContact O-N 3.44Å; K877-K879 PolarHBondContact O-N 2.92Å
878	K	29.3	Very low	44.4	Very low	197 Å²	197	142.7 Å²	142.7	86%	0.857	67%	0.672	S	S	*	*			trans	-47.5	112.3	163.8	-74.3	179.5	176.5	179	0	106	E876 E880	E876-K878 VanDerWaalsContact C-N 3.32Å; E876-K878 PolarHBondContact O-N 3.23Å; K878-E880 PolarHBondContact O-N 3.29Å
879	K	37.4	Very low	47.1	Very low	191 Å²	191	139.5 Å²	139.5	83%	0.83	66%	0.66	S	S	*	*			trans	-56.7	112.3	169.4	-72.6	-177.8	177.6	-178.4	0	105.6	K877 V881	K877-K879 PolarHBondContact O-N 2.92Å; K879-V881 PolarHBondContact O-N 2.93Å
880	E	39.6	Very low	49.9	Very low	175 Å²	175	130.7 Å²	130.7	82%	0.818	62%	0.622	S	S	*	*			trans	-51.6	140.7	169.8	-75.6	-175.7	150.3	0	0	108	K878 E882	K878-E880 PolarHBondContact O-N 3.29Å; E880-E882 VanDerWaalsContact C-N 3.29Å; E880-E882 PolarHBondContact O-N 3.36Å
881	V	50.1	Low	52.6	Low	149 Å²	149	124.7 Å²	124.7	90%	0.903	59%	0.591	S	S	*	*			trans	-65.3	97.8	176.5	179.4	0	0	0	0	106.5	K879	K879-V881 PolarHBondContact O-N 2.93Å
882	E	55.3	Low	55.4	Low	61 Å²	61	116.1 Å²	116.1	29%	0.285	55%	0.552	S	S	.	*			trans	-59.2	140.4	-176.3	-73.2	174.7	-153.9	0	0	110.9	S810 E880 N884	S810-E882 WeakPolarHBondContact CB-OE1 3.3Å; S810-E882 WeakPolarHBondContact CB-OE2 3.37Å; S810-E882 PolarHBondContact N-OE2 3.07Å; S810-E882 PolarHBondContact OG-OE1 3.24Å; S810-E882 PolarHBondContact OG-OE2 2.8Å; S810-E882 VanDerWaalsContact OG-OE2 3.09Å; E880-E882 VanDerWaalsContact C-N 3.29Å; E880-E882 PolarHBondContact O-N 3.36Å; E882-N884 PolarHBondContact O-N 3Å
883	P	69.3	Low	58.4	Low	76 Å²	76	109.2 Å²	109.2	49%	0.494	52%	0.518	S	S	.	.			trans	-59.3	139.1	173.9	25.6	-32.8	0	0	0	110	P809 F885	P809-P883 WeakPolarHBondContact CD-O 3.2Å; P809-P883 HydrophobicContact CG-CG 4.13Å; P883-F885 PolarHBondContact O-N 3.02Å
884	N	76.1	Confident	61.2	Low	113 Å²	113	100.6 Å²	100.6	60%	0.604	48%	0.481	S	S	*	.	S	Bend	trans	-73.3	-6.2	-179.6	-70.5	-33.1	0	0	0	113.3	C807 E882	C807-N884 CarbonylContact C-O 3.6Å; C807-N884 PolarHBondContact N-O 3.18Å; E882-N884 PolarHBondContact O-N 3Å
885	F	75.9	Confident	64	Low	96 Å²	96	93.6 Å²	93.6	42%	0.421	45%	0.449	S	S	.	.			trans	-136.8	149.9	177.8	65.8	-87.8	0	0	0	110.8	R804 S805 P883	R804-F885 HydrophobicContact CG-CB 4.37Å; S805-F885 VanDerWaalsContact O-CA 3.22Å; S805-F885 WeakPolarHBondContact O-CA 3.46Å; P883-F885 PolarHBondContact O-N 3.02Å
886	Q	80.3	Confident	66.5	Low	59 Å²	59	88.9 Å²	88.9	28%	0.276	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	135.9	174.4	-173	175.7	4	0	0	109.5	S805 P809 L888	S805-Q886 PolarHBondContact N-O 3.44Å; S805-Q886 PolarHBondContact O-N 3.15Å; P809-Q886 HydrophobicContact CG-CB 4.28Å; Q886-L888 HydrophobicContact CG-CD2 4Å
887	L	82.3	Confident	69.2	Low	86 Å²	86	83.8 Å²	83.8	45%	0.45	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	129.7	168.4	-62.8	175.1	0	0	0	108.5	Y803 R804	Y803-L887 CarbonylContact O-C 3.26Å; Y803-L887 WeakPolarHBondContact O-CA 3.22Å; R804-L887 HydrophobicContact CB-CD2 4.19Å
888	L	81.6	Confident	71.7	Confident	21 Å²	21	75.3 Å²	75.3	11%	0.11	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	133.8	-179.1	-60.3	174.3	0	0	0	109.5	Q802 Y803 Q886 A892 V894 L902	Q802-L888 CarbonylContact C-O 3.57Å; Q802-L888 VanDerWaalsContact CA-O 3.24Å; Q802-L888 WeakPolarHBondContact CA-O 3.43Å; Y803-L888 PolarHBondContact N-O 2.87Å; Y803-L888 PolarHBondContact O-N 3Å; Q886-L888 HydrophobicContact CG-CD2 4Å; L888-A892 HydrophobicContact CB-CB 3.81Å; L888-A892 HydrophobicContact CD1-CB 4.41Å; L888-V894 HydrophobicContact CD1-CG1 4.07Å; L888-L902 HydrophobicContact CD1-CD1 3.92Å
889	E	82.9	Confident	74.2	Confident	139 Å²	139	66.5 Å²	66.5	65%	0.65	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	148	-179.2	-62	-177	168.9	0	0	112.2	Q802 P891 A892	Q802-E889 HydrophobicContact CG-CG 4.43Å; E889-P891 CarbonylContact O-C 3.51Å; E889-A892 WeakPolarHBondContact O-CA 3.48Å; E889-A892 VanDerWaalsContact O-CB 3.28Å; E889-A892 WeakPolarHBondContact O-CB 3.08Å; E889-A892 PolarHBondContact O-N 3.27Å; E889-A892 VanDerWaalsContact O-N 3.13Å
890	N	81.6	Confident	76.4	Confident	8 Å²	8	65.3 Å²	65.3	4%	0.043	35%	0.345	C	S	.	.	S	Bend	trans	-76.4	125.8	175.2	-174.6	28.5	0	0	0	111.7	I790 G791 P799 V801 Y803	I790-N890 WeakPolarHBondContact CA-OD1 3.17Å; G791-N890 PolarHBondContact N-ND2 3.09Å; G791-N890 PolarHBondContact N-OD1 3.08Å; G791-N890 PolarHBondContact O-ND2 2.98Å; P799-N890 PolarHBondContact O-ND2 3.37Å; V801-N890 HydrophobicContact CG1-CB 3.49Å; V801-N890 VanDerWaalsContact CG1-CB 3.49Å; V801-N890 PolarHBondContact O-N 3.22Å; Y803-N890 HydrophobicContact CE2-CB 4.07Å
891	P	82.3	Confident	78.5	Confident	9 Å²	9	59 Å²	59	6%	0.058	32%	0.318	C	S	.	.	S	Bend	cis	-84.9	134.6	-2	33.2	-34.6	0	0	0	113.7	F342 N346 I790 M798 E889	F342-P891 HydrophobicContact CB-CB 4.27Å; F342-P891 HydrophobicContact CB-CG 4.12Å; F342-P891 HydrophobicContact CD2-CB 3.83Å; F342-P891 HydrophobicContact CD2-CG 3.98Å; F342-P891 HydrophobicContact CG-CB 4.46Å; N346-P891 PolarHBondContact ND2-O 3.22Å; N346-P891 VanDerWaalsContact ND2-O 3.16Å; I790-P891 HydrophobicContact CG1-CB 3.97Å; M798-P891 HydrophobicContact SD-CG 4.3Å; E889-P891 CarbonylContact O-C 3.51Å
892	A	82.4	Confident	80.1	Confident	6 Å²	6	52.1 Å²	52.1	5%	0.05	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	139.5	-176	0	0	0	0	0	112.2	A788 I789 L888 E889	A788-A892 CarbonylContact C-O 3.5Å; A788-A892 WeakPolarHBondContact CA-O 3.48Å; I789-A892 PolarHBondContact N-O 3.46Å; I789-A892 PolarHBondContact O-N 3.21Å; I789-A892 VanDerWaalsContact O-N 3.14Å; L888-A892 HydrophobicContact CB-CB 3.81Å; L888-A892 HydrophobicContact CD1-CB 4.41Å; E889-A892 WeakPolarHBondContact O-CA 3.48Å; E889-A892 VanDerWaalsContact O-CB 3.28Å; E889-A892 WeakPolarHBondContact O-CB 3.08Å; E889-A892 PolarHBondContact O-N 3.27Å; E889-A892 VanDerWaalsContact O-N 3.13Å
893	R	86.4	Confident	81.5	Confident	21 Å²	21	52 Å²	52	8%	0.079	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	130.6	164.1	178	-173.6	178.6	-123.6	10.6	109.5	F342 Q698 R743 N744 T787 F812 Y814	F342-R893 HydrophobicContact CE2-CB 4.36Å; F342-R893 HydrophobicContact CZ-CB 4.03Å; Q698-R893 PolarHBondContact O-NH2 3.17Å; R743-R893 VanDerWaalsContact O-CZ 3.29Å; R743-R893 PolarHBondContact O-NE 3.15Å; R743-R893 PolarHBondContact O-NH2 2.69Å; R743-R893 VanDerWaalsContact O-NH2 3.08Å; N744-R893 WeakPolarHBondContact OD1-CD 3.36Å; T787-R893 WeakPolarHBondContact O-CA 3.37Å; F812-R893 PolarHBondContact O-NH1 3.48Å; Y814-R893 VanDerWaalsContact OH-CB 3.3Å; Y814-R893 WeakPolarHBondContact OH-CB 3.42Å; Y814-R893 WeakPolarHBondContact OH-CD 3.3Å
894	V	84.3	Confident	81.9	Confident	5 Å²	5	50.1 Å²	50.1	3%	0.03	26%	0.264	C	S	.	.			trans	-140	134.3	175	-71.4	0	0	0	0	111.3	T787 I789 L888 L899	T787-V894 WeakPolarHBondContact CB-O 3.48Å; T787-V894 PolarHBondContact O-N 3.43Å; I789-V894 HydrophobicContact CB-CG2 4.09Å; I789-V894 HydrophobicContact CD1-CG1 4.23Å; I789-V894 HydrophobicContact CD1-CG2 3.81Å; I789-V894 HydrophobicContact CG1-CG2 3.69Å; L888-V894 HydrophobicContact CD1-CG1 4.07Å; V894-L899 HydrophobicContact CB-CD2 4.08Å; V894-L899 HydrophobicContact CG2-CD2 3.65Å; V894-L899 HydrophobicContact CG2-CG 4.47Å
895	M	83.4	Confident	82	Confident	14 Å²	14	46.2 Å²	46.2	7%	0.069	25%	0.245	C	C	.	.			trans	-84.4	155.5	174.3	-62.5	-172.3	-163.3	0	0	111.7	Q698 T700 F812 A897 Q898 L899	Q698-M895 WeakPolarHBondContact O-CE 3.47Å; T700-M895 HydrophobicContact CG2-CE 3.92Å; F812-M895 HydrophobicContact CD1-CB 4.37Å; F812-M895 HydrophobicContact CD1-CE 4.26Å; F812-M895 HydrophobicContact CD1-CG 4.27Å; F812-M895 HydrophobicContact CD1-SD 3.75Å; F812-M895 HydrophobicContact CE1-CB 4.46Å; F812-M895 HydrophobicContact CE1-SD 4.25Å; M895-A897 PolarHBondContact O-N 3.41Å; M895-A897 VanDerWaalsContact O-N 3.17Å; M895-Q898 HydrophobicContact CB-CB 4.17Å; M895-Q898 WeakPolarHBondContact O-CA 3.32Å; M895-Q898 VanDerWaalsContact O-CB 3.3Å; M895-Q898 WeakPolarHBondContact O-CB 3.27Å; M895-Q898 PolarHBondContact O-N 3.42Å; M895-L899 PolarHBondContact O-N 3.05Å
896	P	80.4	Confident	81.6	Confident	88 Å²	88	51.4 Å²	51.4	57%	0.571	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-36.5	175.2	-27.7	35.4	0	0	0	114.2	Q898	P896-Q898 VanDerWaalsContact C-N 3.34Å
897	A	82.2	Confident	81	Confident	62 Å²	62	54.1 Å²	54.1	51%	0.512	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-31.8	174.4	0	0	0	0	0	112.7	F812 M895	F812-A897 HydrophobicContact CE1-CB 4.39Å; M895-A897 PolarHBondContact O-N 3.41Å; M895-A897 VanDerWaalsContact O-N 3.17Å
898	Q	81.8	Confident	80.4	Confident	6 Å²	6	51.5 Å²	51.5	3%	0.028	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-75.4	-28.4	-180	-165.9	177.8	9.4	0	0	112.5	S805 F812 M895 P896 K900 V901 L902	S805-Q898 PolarHBondContact OG-NE2 3.28Å; F812-Q898 HydrophobicContact CD1-CB 4.05Å; F812-Q898 HydrophobicContact CD1-CG 4.36Å; F812-Q898 HydrophobicContact CD2-CB 4.24Å; F812-Q898 HydrophobicContact CD2-CG 3.76Å; F812-Q898 HydrophobicContact CE1-CB 3.86Å; F812-Q898 HydrophobicContact CE1-CG 4.44Å; F812-Q898 HydrophobicContact CE2-CB 4.04Å; F812-Q898 HydrophobicContact CE2-CG 3.84Å; F812-Q898 HydrophobicContact CG-CB 4.24Å; F812-Q898 HydrophobicContact CG-CG 4.03Å; F812-Q898 HydrophobicContact CZ-CB 3.85Å; F812-Q898 HydrophobicContact CZ-CG 4.18Å; M895-Q898 HydrophobicContact CB-CB 4.17Å; M895-Q898 WeakPolarHBondContact O-CA 3.32Å; M895-Q898 VanDerWaalsContact O-CB 3.3Å; M895-Q898 WeakPolarHBondContact O-CB 3.27Å; M895-Q898 PolarHBondContact O-N 3.42Å; P896-Q898 VanDerWaalsContact C-N 3.34Å; Q898-K900 PolarHBondContact O-N 2.99Å; Q898-V901 HydrophobicContact CG-CG2 4.3Å; Q898-V901 WeakPolarHBondContact O-CG2 3.27Å; Q898-V901 PolarHBondContact O-N 3.07Å; Q898-V901 VanDerWaalsContact O-N 3.09Å; Q898-L902 PolarHBondContact O-N 3.23Å
899	L	83.1	Confident	80.2	Confident	11 Å²	11	53 Å²	53	6%	0.058	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-59.1	-26.8	176.7	-68.2	175.4	0	0	0	113.3	I789 V894 M895 V901 H917	I789-L899 HydrophobicContact CD1-CD2 3.55Å; I789-L899 HydrophobicContact CG1-CD2 4.21Å; V894-L899 HydrophobicContact CB-CD2 4.08Å; V894-L899 HydrophobicContact CG2-CD2 3.65Å; V894-L899 HydrophobicContact CG2-CG 4.47Å; M895-L899 PolarHBondContact O-N 3.05Å; L899-V901 VanDerWaalsContact C-N 3.32Å; L899-H917 WeakPolarHBondContact CD1-O 3.47Å; L899-H917 PolarHBondContact O-ND1 2.85Å
900	K	83.4	Confident	80	Confident	167 Å²	167	46.9 Å²	46.9	73%	0.726	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-73.8	-24	178.8	-61.9	-177.8	-176.5	178.3	0	113.2	Q898	Q898-K900 PolarHBondContact O-N 2.99Å
901	V	83.7	Confident	79.8	Confident	42 Å²	42	52 Å²	52	26%	0.255	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	0.6	-175.7	-62.7	0	0	0	0	112.8	N806 C807 Q898 L899	N806-V901 WeakPolarHBondContact CB-O 3.48Å; N806-V901 PolarHBondContact N-O 3.36Å; N806-V901 PolarHBondContact ND2-O 2.96Å; C807-V901 HydrophobicContact CB-CG2 4.32Å; Q898-V901 HydrophobicContact CG-CG2 4.3Å; Q898-V901 WeakPolarHBondContact O-CG2 3.27Å; Q898-V901 PolarHBondContact O-N 3.07Å; Q898-V901 VanDerWaalsContact O-N 3.09Å; L899-V901 VanDerWaalsContact C-N 3.32Å
902	L	83.9	Confident	79.7	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.021	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	134.5	179.8	-155.6	81.6	0	0	0	110.5	I789 Y803 L888 Q898 L916	I789-L902 HydrophobicContact CD1-CD2 3.35Å; Y803-L902 HydrophobicContact CD1-CD2 4.34Å; Y803-L902 HydrophobicContact CG-CD2 4.29Å; L888-L902 HydrophobicContact CD1-CD1 3.92Å; Q898-L902 PolarHBondContact O-N 3.23Å; L902-L916 HydrophobicContact CD2-CD1 4.28Å
903	T	83.7	Confident	79.2	Confident	58 Å²	58	57.8 Å²	57.8	36%	0.356	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	146	178.8	48.9	0	0	0	0	110.1	R804 N806	R804-T903 WeakPolarHBondContact CB-O 3.46Å; R804-T903 PolarHBondContact N-O 3.09Å; R804-T903 PolarHBondContact O-N 3.29Å; R804-T903 VanDerWaalsContact O-O 3.13Å; R804-T903 PolarHBondContact O-OG1 3.36Å; N806-T903 WeakPolarHBondContact ND2-CG2 3.39Å; N806-T903 PolarHBondContact ND2-OG1 2.86Å
904	M	78.1	Confident	78.5	Confident	38 Å²	38	57.3 Å²	57.3	19%	0.187	31%	0.31	C	S	.	.			trans	-75.4	138	167.5	-70.2	-59.6	-76.7	0	0	109.8	V801 Y803 C908 Y910 P912 L916	V801-M904 HydrophobicContact CG2-CE 3.79Å; Y803-M904 HydrophobicContact CD1-SD 3.41Å; Y803-M904 WeakPolarHBondContact CD1-SD 3.49Å; Y803-M904 HydrophobicContact CE1-CE 4.45Å; Y803-M904 HydrophobicContact CE1-SD 3.59Å; Y803-M904 VanDerWaalsContact CE1-SD 3.59Å; M904-C908 HydrophobicContact CE-CB 4.18Å; M904-Y910 WeakPolarHBondContact CE-O 3.4Å; M904-P912 HydrophobicContact CG-CG 3.82Å; M904-L916 HydrophobicContact CG-CD1 3.59Å; M904-L916 HydrophobicContact CG-CG 4.37Å; M904-L916 HydrophobicContact SD-CD1 3.93Å; M904-L916 HydrophobicContact SD-CD2 4.41Å
905	P	77.9	Confident	78.1	Confident	30 Å²	30	61.2 Å²	61.2	20%	0.195	34%	0.335	C	S	.	.			trans	-62	134.5	165.7	-17.6	30.6	0	0	0	110.7	Q802 R804 S907 C908	Q802-P905 VanDerWaalsContact O-CD 3.32Å; Q802-P905 WeakPolarHBondContact O-CD 3.45Å; R804-P905 HydrophobicContact CB-CG 4.36Å; P905-S907 PolarHBondContact O-N 2.8Å; P905-C908 WeakPolarHBondContact O-CB 3.37Å; P905-C908 PolarHBondContact O-N 2.6Å
906	E	67.4	Low	77.6	Confident	206 Å²	206	61.2 Å²	61.2	96%	0.963	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-20.3	177.1	-66.2	-179.3	176	0	0	113	C908	E906-C908 VanDerWaalsContact C-N 3.27Å; E906-C908 PolarHBondContact O-N 2.93Å
907	S	67.4	Low	77.2	Confident	115 Å²	115	62.6 Å²	62.6	80%	0.804	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	4	176	63.2	0	0	0	0	114.1	P905	P905-S907 PolarHBondContact O-N 2.8Å
908	C	70.8	Confident	76.5	Confident	31 Å²	31	61.5 Å²	61.5	21%	0.209	32%	0.321	C	S	.	.			trans	-83.2	132.2	-175.4	-164.8	0	0	0	0	111.8	V801 M904 P905 E906 Y910	V801-C908 WeakPolarHBondContact CG2-SG 3.25Å; M904-C908 HydrophobicContact CE-CB 4.18Å; P905-C908 WeakPolarHBondContact O-CB 3.37Å; P905-C908 PolarHBondContact O-N 2.6Å; E906-C908 VanDerWaalsContact C-N 3.27Å; E906-C908 PolarHBondContact O-N 2.93Å; C908-Y910 PolarHBondContact O-N 3.27Å
909	R	76.9	Confident	76.2	Confident	52 Å²	52	61.4 Å²	61.4	20%	0.196	32%	0.322	C	S	.	.	S	Bend	trans	-57.7	-28.9	175.2	171.6	172.9	174.9	173.3	-0.4	113.5	D926 T927 S928 E930 E931	R909-D926 WeakPolarHBondContact CG-OD1 3.43Å; R909-D926 IonicContact CZ-OD1 3.73Å; R909-D926 IonicContact CZ-OD2 2.88Å; R909-D926 VanDerWaalsContact CZ-OD2 3.29Å; R909-D926 IonicContact NE-OD1 2.85Å; R909-D926 PolarHBondContact NE-OD1 2.97Å; R909-D926 IonicContact NE-OD2 2.86Å; R909-D926 PolarHBondContact NE-OD2 2.83Å; R909-D926 VanDerWaalsContact NE-OD2 3.09Å; R909-D926 IonicContact NH2-OD1 3.71Å; R909-D926 IonicContact NH2-OD2 2.69Å; R909-D926 PolarHBondContact NH2-OD2 2.99Å; R909-T927 PolarHBondContact O-N 2.82Å; R909-T927 VanDerWaalsContact O-N 3.16Å; R909-T927 PolarHBondContact O-OG1 3.4Å; R909-S928 PolarHBondContact NH2-O 2.9Å; R909-E930 PolarHBondContact NH1-O 3.49Å; R909-E930 PolarHBondContact NH2-O 3Å; R909-E931 PolarHBondContact NH1-O 2.64Å
910	Y	78.4	Confident	76.2	Confident	12 Å²	12	61 Å²	61	5%	0.047	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	129.2	-174.8	-67.1	-74.7	0	0	0	111.6	P799 V801 M904 C908 L924 D926	P799-Y910 HydrophobicContact CB-CD2 4.37Å; P799-Y910 HydrophobicContact CB-CE1 4.14Å; P799-Y910 HydrophobicContact CB-CE2 3.72Å; P799-Y910 HydrophobicContact CG-CE1 4.42Å; P799-Y910 HydrophobicContact CG-CE2 4.42Å; V801-Y910 HydrophobicContact CB-CD2 4.48Å; M904-Y910 WeakPolarHBondContact CE-O 3.4Å; C908-Y910 PolarHBondContact O-N 3.27Å; Y910-L924 HydrophobicContact CD1-CB 4.16Å; Y910-L924 HydrophobicContact CG-CB 4.43Å; Y910-L924 HydrophobicContact CG-CD1 4.39Å; Y910-D926 HydrophobicContact CD1-CB 4.15Å; Y910-D926 HydrophobicContact CE1-CB 3.87Å
911	Q	78.1	Confident	76.3	Confident	114 Å²	114	53.7 Å²	53.7	53%	0.533	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126.7	174.2	-68.5	-174.8	-5.6	0	0	110.6	K925 T927	Q911-K925 PolarHBondContact N-O 3.2Å; Q911-K925 PolarHBondContact O-N 3.36Å; Q911-T927 HydrophobicContact CB-CG2 4.42Å; Q911-T927 HydrophobicContact CG-CG2 3.97Å
912	P	79.6	Confident	76.3	Confident	43 Å²	43	51.7 Å²	51.7	28%	0.279	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	135.3	179.8	30.8	-34.9	0	0	0	110.8	M904 K914 L916 I922 L924	M904-P912 HydrophobicContact CG-CG 3.82Å; P912-K914 VanDerWaalsContact C-N 3.34Å; P912-L916 HydrophobicContact CB-CD2 4.47Å; P912-L916 HydrophobicContact CG-CG 4.44Å; P912-I922 HydrophobicContact CB-CG2 4.1Å; P912-L924 HydrophobicContact CB-CD2 3.8Å
913	F	71.3	Confident	76.3	Confident	95 Å²	95	51.5 Å²	51.5	42%	0.417	28%	0.275	S	S	.	.	S	Bend	trans	-74.8	-28.5	177	-162	-98.3	0	0	0	112.3	M245 I923	M245-F913 HydrophobicContact CB-CE1 4.02Å; M245-F913 HydrophobicContact CB-CZ 4.17Å; M245-F913 HydrophobicContact CE-CE1 3.74Å; M245-F913 HydrophobicContact CE-CZ 3.81Å; M245-F913 HydrophobicContact CG-CE1 4.09Å; M245-F913 HydrophobicContact CG-CZ 4.5Å; F913-I923 WeakPolarHBondContact CB-O 3.38Å; F913-I923 PolarHBondContact N-O 3.24Å
914	K	73.3	Confident	76.2	Confident	11 Å²	11	48.9 Å²	48.9	5%	0.048	26%	0.259	C	S	.	.	S	Bend	trans	-111.3	145.8	179.1	-169.8	171.7	-179.7	172.3	0	110.2	I215 Q248 D252 P912 L916 T918 I922	I215-K914 HydrophobicContact CD1-CD 4.29Å; I215-K914 HydrophobicContact CD1-CG 4.31Å; Q248-K914 HydrophobicContact CG-CD 4.19Å; D252-K914 IonicContact OD1-NZ 3.03Å; D252-K914 PolarHBondContact OD1-NZ 2.9Å; D252-K914 IonicContact OD2-NZ 3.67Å; D252-K914 PolarHBondContact OD2-NZ 3.23Å; P912-K914 VanDerWaalsContact C-N 3.34Å; K914-L916 PolarHBondContact O-N 2.93Å; K914-T918 WeakPolarHBondContact CE-OG1 3.43Å; K914-I922 HydrophobicContact CB-CG2 4.29Å
915	P	75.5	Confident	76.3	Confident	86 Å²	86	52.7 Å²	52.7	56%	0.558	28%	0.275	S	S	*	.			trans	-54.7	132.8	171.4	-23.8	33.1	0	0	0	111.2	H917 T918	P915-H917 PolarHBondContact O-N 3.3Å; P915-T918 PolarHBondContact O-N 3.12Å
916	L	73.3	Confident	76.3	Confident	15 Å²	15	53.1 Å²	53.1	8%	0.079	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-60.3	-16.7	-179.4	-72.9	173.8	0	0	0	113.9	Y803 L902 M904 P912 K914 T918 G919 I922	Y803-L916 HydrophobicContact CD1-CD1 4.49Å; Y803-L916 HydrophobicContact CD1-CD2 4.22Å; Y803-L916 HydrophobicContact CE1-CD2 4.03Å; L902-L916 HydrophobicContact CD2-CD1 4.28Å; M904-L916 HydrophobicContact CG-CD1 3.59Å; M904-L916 HydrophobicContact CG-CG 4.37Å; M904-L916 HydrophobicContact SD-CD1 3.93Å; M904-L916 HydrophobicContact SD-CD2 4.41Å; P912-L916 HydrophobicContact CB-CD2 4.47Å; P912-L916 HydrophobicContact CG-CG 4.44Å; K914-L916 PolarHBondContact O-N 2.93Å; L916-T918 PolarHBondContact O-N 3.49Å; L916-T918 VanDerWaalsContact O-N 3.16Å; L916-G919 PolarHBondContact O-N 3.3Å; L916-G919 VanDerWaalsContact O-N 3.13Å; L916-I922 HydrophobicContact CD2-CD1 3.87Å
917	H	70.8	Confident	76.7	Confident	117 Å²	117	47 Å²	47	54%	0.542	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-61.1	-22.7	-178.4	-62.2	-44.7	0	0	0	114.1	L899 P915	L899-H917 WeakPolarHBondContact CD1-O 3.47Å; L899-H917 PolarHBondContact O-ND1 2.85Å; P915-H917 PolarHBondContact O-N 3.3Å
918	T	67.3	Low	76.6	Confident	39 Å²	39	43.8 Å²	43.8	24%	0.239	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-80.4	-22.8	179	-45.8	0	0	0	0	112.4	R752 K914 P915 L916	R752-T918 HydrophobicContact CB-CG2 4.37Å; R752-T918 WeakPolarHBondContact CD-O 3.33Å; K914-T918 WeakPolarHBondContact CE-OG1 3.43Å; P915-T918 PolarHBondContact O-N 3.12Å; L916-T918 PolarHBondContact O-N 3.49Å; L916-T918 VanDerWaalsContact O-N 3.16Å
919	G	76.9	Confident	75.9	Confident	4 Å²	4	52.1 Å²	52.1	4%	0.041	27%	0.266	C	S	.	.			trans	62.5	-168.5	-173.6	0	0	0	0	0	113.4	L916	L916-G919 PolarHBondContact O-N 3.3Å; L916-G919 VanDerWaalsContact O-N 3.13Å
920	G	82.7	Confident	74.9	Confident	2 Å²	2	56.7 Å²	56.7	2%	0.021	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	82.1	-152.8	177.8	0	0	0	0	0	114.1	A788 I789 I790	A788-G920 VanDerWaalsContact O-CA 3.28Å; A788-G920 WeakPolarHBondContact O-CA 3.37Å; A788-G920 PolarHBondContact O-N 2.7Å; I789-G920 WeakPolarHBondContact CA-O 3.49Å; I790-G920 PolarHBondContact N-O 2.72Å
921	I	84.5	Confident	73.8	Confident	13 Å²	13	65.2 Å²	65.2	7%	0.067	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	121.1	177.1	-58.7	173.8	0	0	0	108.3	Q248 F251 L338 I790 L792	Q248-I921 PolarHBondContact NE2-O 2.85Å; F251-I921 HydrophobicContact CD1-CB 4.25Å; F251-I921 HydrophobicContact CD1-CD1 3.72Å; F251-I921 HydrophobicContact CD1-CG2 4.08Å; F251-I921 HydrophobicContact CD2-CG2 3.95Å; F251-I921 HydrophobicContact CE1-CD1 3.65Å; F251-I921 HydrophobicContact CE1-CG2 4.02Å; F251-I921 HydrophobicContact CE2-CG2 3.91Å; F251-I921 HydrophobicContact CG-CB 4.32Å; F251-I921 HydrophobicContact CG-CG2 4.06Å; F251-I921 HydrophobicContact CZ-CD1 4.49Å; F251-I921 HydrophobicContact CZ-CG2 3.94Å; L338-I921 HydrophobicContact CD1-CD1 3.97Å; I790-I921 HydrophobicContact CB-CG1 4.3Å; I790-I921 WeakPolarHBondContact O-CA 3.5Å; L792-I921 HydrophobicContact CD1-CG2 3.37Å; L792-I921 HydrophobicContact CG-CG2 3.96Å
922	I	84.5	Confident	72.9	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.005	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	126.8	-177.2	-57.2	173.5	0	0	0	108.6	I789 I790 G791 L792 P912 K914 L916 L924	I789-I922 HydrophobicContact CG1-CD1 4.47Å; I790-I922 PolarHBondContact O-N 3.48Å; G791-I922 WeakPolarHBondContact CA-O 2.99Å; L792-I922 PolarHBondContact N-O 3.41Å; P912-I922 HydrophobicContact CB-CG2 4.1Å; K914-I922 HydrophobicContact CB-CG2 4.29Å; L916-I922 HydrophobicContact CD2-CD1 3.87Å; I922-L924 PolarHBondContact O-N 2.98Å
923	I	83.4	Confident	71.9	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	125.5	171.4	-54.5	-57.2	0	0	0	109.7	L244 Q248 F251 L792 L796 F913	L244-I923 HydrophobicContact CB-CG2 4.06Å; L244-I923 HydrophobicContact CD2-CG2 3.97Å; L244-I923 HydrophobicContact CG-CG2 3.81Å; Q248-I923 HydrophobicContact CB-CG1 4.34Å; Q248-I923 VanDerWaalsContact OE1-N 3.16Å; F251-I923 HydrophobicContact CD2-CD1 4.28Å; F251-I923 HydrophobicContact CE2-CD1 3.97Å; L792-I923 HydrophobicContact CB-CD1 4.11Å; L796-I923 HydrophobicContact CD2-CD1 4.4Å; F913-I923 WeakPolarHBondContact CB-O 3.38Å; F913-I923 PolarHBondContact N-O 3.24Å
924	L	82	Confident	71.3	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.01	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	127.2	175.9	-63.2	179.9	0	0	0	109.1	L792 P799 V801 Y910 P912 I922	L792-L924 PolarHBondContact O-N 3.13Å; P799-L924 HydrophobicContact CG-CD1 3.99Å; V801-L924 HydrophobicContact CB-CD1 4.48Å; V801-L924 HydrophobicContact CG1-CD1 3.88Å; Y910-L924 HydrophobicContact CD1-CB 4.16Å; Y910-L924 HydrophobicContact CG-CB 4.43Å; Y910-L924 HydrophobicContact CG-CD1 4.39Å; P912-L924 HydrophobicContact CB-CD2 3.8Å; I922-L924 PolarHBondContact O-N 2.98Å
925	K	80.3	Confident	70.6	Confident	118 Å²	118	66.6 Å²	66.6	51%	0.513	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	124.7	170.8	-174.3	178.2	179.1	-177.9	0	108.7	L244 Q911	L244-K925 HydrophobicContact CD2-CB 4.21Å; L244-K925 HydrophobicContact CD2-CG 4.38Å; Q911-K925 PolarHBondContact N-O 3.2Å; Q911-K925 PolarHBondContact O-N 3.36Å
926	D	78.9	Confident	69.5	Low	40 Å²	40	70.3 Å²	70.3	21%	0.214	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	137.7	170	-163.5	-6.1	0	0	0	110.4	R909 Y910 S928	R909-D926 WeakPolarHBondContact CG-OD1 3.43Å; R909-D926 IonicContact CZ-OD1 3.73Å; R909-D926 IonicContact CZ-OD2 2.88Å; R909-D926 VanDerWaalsContact CZ-OD2 3.29Å; R909-D926 IonicContact NE-OD1 2.85Å; R909-D926 PolarHBondContact NE-OD1 2.97Å; R909-D926 IonicContact NE-OD2 2.86Å; R909-D926 PolarHBondContact NE-OD2 2.83Å; R909-D926 VanDerWaalsContact NE-OD2 3.09Å; R909-D926 IonicContact NH2-OD1 3.71Å; R909-D926 IonicContact NH2-OD2 2.69Å; R909-D926 PolarHBondContact NH2-OD2 2.99Å; Y910-D926 HydrophobicContact CD1-CB 4.15Å; Y910-D926 HydrophobicContact CE1-CB 3.87Å; D926-S928 PolarHBondContact OD1-N 2.95Å
927	T	74.8	Confident	68.5	Low	78 Å²	78	74.2 Å²	74.2	48%	0.479	37%	0.374	S	S	.	.			trans	-116.2	-2.7	178.8	59.2	0	0	0	0	113.5	R909 Q911	R909-T927 PolarHBondContact O-N 2.82Å; R909-T927 VanDerWaalsContact O-N 3.16Å; R909-T927 PolarHBondContact O-OG1 3.4Å; Q911-T927 HydrophobicContact CB-CG2 4.42Å; Q911-T927 HydrophobicContact CG-CG2 3.97Å
928	S	65.4	Low	67.6	Low	47 Å²	47	70.5 Å²	70.5	33%	0.329	36%	0.359	S	S	.	.			trans	-115.5	152	177.8	-171	0	0	0	0	112.2	R909 D926	R909-S928 PolarHBondContact NH2-O 2.9Å; D926-S928 PolarHBondContact OD1-N 2.95Å
929	E	56.3	Low	66.8	Low	206 Å²	206	72.8 Å²	72.8	96%	0.963	38%	0.377	S	S	*	.			trans	-92.7	2.6	-177.8	-66.1	-175.3	167.6	0	0	114.2
930	E	56.6	Low	65.1	Low	147 Å²	147	73.7 Å²	73.7	69%	0.687	38%	0.384	S	S	*	.	S	Bend	trans	-73.4	168.5	-179.7	-67.4	178.8	163.8	0	0	113	R909	R909-E930 PolarHBondContact NH1-O 3.49Å; R909-E930 PolarHBondContact NH2-O 3Å
931	E	54.7	Low	63.1	Low	191 Å²	191	78.6 Å²	78.6	89%	0.893	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-66.6	144.2	174.9	-70.9	-173	164.2	0	0	111.6	R909	R909-E931 PolarHBondContact NH1-O 2.64Å
932	E	58.5	Low	60.9	Low	70 Å²	70	78.5 Å²	78.5	33%	0.327	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-86.2	129.7	-175.1	-64.7	-173.6	171.9	0	0	112.5	N793	N793-E932 PolarHBondContact ND2-OE2 3.29Å
933	E	58.8	Low	58.4	Low	128 Å²	128	82.5 Å²	82.5	60%	0.598	43%	0.434	S	S	*	.			trans	-85.8	114.9	167.8	-74.2	-165.7	-150.8	0	0	111.6	K800	K800-E933 HydrophobicContact CD-CB 4.1Å; K800-E933 WeakPolarHBondContact CD-OE2 3.33Å; K800-E933 PolarHBondContact N-O 2.91Å; K800-E933 IonicContact NZ-OE2 3.15Å; K800-E933 PolarHBondContact NZ-OE2 2.81Å
934	L	59.5	Low	56	Low	57 Å²	57	89.2 Å²	89.2	30%	0.298	46%	0.464	S	S	.	.	B	Isolated β-bridge	trans	-101.5	155.4	-178.9	-62.5	170.8	0	0	0	111.7	K797 M798 K800	K797-L934 HydrophobicContact CB-CD1 4.32Å; K797-L934 HydrophobicContact CB-CD2 3.77Å; K797-L934 HydrophobicContact CD-CD1 3.54Å; K797-L934 HydrophobicContact CD-CD2 4.48Å; M798-L934 WeakPolarHBondContact O-CA 3.35Å; K800-L934 WeakPolarHBondContact CE-O 3.5Å
935	V	59.1	Low	53.9	Low	38 Å²	38	95.8 Å²	95.8	23%	0.23	50%	0.497	C	S	.	.	P	Polyproline II helix	trans	-88.2	124.1	173.7	-156.7	0	0	0	0	110.3	R345 M798 K800	R345-V935 VanDerWaalsContact CZ-CG1 3.42Å; M798-V935 HydrophobicContact CB-CB 4.28Å; M798-V935 HydrophobicContact CB-CG2 4.12Å; M798-V935 PolarHBondContact O-N 3.43Å; K800-V935 HydrophobicContact CG-CG2 3.85Å
936	E	51.9	Low	51.8	Low	164 Å²	164	96.5 Å²	96.5	77%	0.766	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-71.6	124.8	-174.5	-66	-173.4	166.6	0	0	113	R345 V938	R345-E936 VanDerWaalsContact NH2-C 3.29Å; R345-E936 PolarHBondContact NH2-O 3.21Å; E936-V938 PolarHBondContact O-N 3.22Å
937	P	51.2	Low	49.7	Very low	96 Å²	96	101.2 Å²	101.2	62%	0.623	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-60.5	127.2	-177.5	26.5	-34.3	0	0	0	111.1	Q341	Q341-P937 VanDerWaalsContact NE2-CB 3.28Å
938	V	53.4	Low	47.8	Very low	39 Å²	39	106.2 Å²	106.2	24%	0.236	54%	0.541	C	S	.	.	P	Polyproline II helix	trans	-86.6	134.5	-179.4	175.5	0	0	0	0	109.4	I344 R345 E936	I344-V938 HydrophobicContact CG2-CG1 3.9Å; R345-V938 HydrophobicContact CG-CB 4.27Å; R345-V938 HydrophobicContact CG-CG2 3.79Å; E936-V938 PolarHBondContact O-N 3.22Å
939	S	48.8	Very low	46.3	Very low	87 Å²	87	111.9 Å²	111.9	61%	0.608	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-69.4	156.6	176.6	50.2	0	0	0	0	112.1	H941 G942	S939-H941 PolarHBondContact O-N 2.95Å; S939-G942 PolarHBondContact O-N 3.19Å; S939-G942 VanDerWaalsContact O-N 3.12Å
940	A	41.3	Very low	45.2	Very low	24 Å²	24	109.1 Å²	109.1	20%	0.198	55%	0.549	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	140.1	175.8	0	0	0	0	0	110.7
941	H	41.7	Very low	44.4	Very low	105 Å²	105	110.3 Å²	110.3	49%	0.486	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	83.4	4.1	-167.1	-52.3	72.5	0	0	0	116.6	T382 D384 S939	T382-H941 PolarHBondContact OG1-N 3.47Å; D384-H941 IonicContact OD1-NE2 3.72Å; S939-H941 PolarHBondContact O-N 2.95Å
942	G	37	Very low	43.7	Very low	11 Å²	11	107 Å²	107	11%	0.113	55%	0.55	C	S	.	*			trans	74.1	176.3	176.6	0	0	0	0	0	112.7	S939 K944	S939-G942 PolarHBondContact O-N 3.19Å; S939-G942 VanDerWaalsContact O-N 3.12Å; G942-K944 PolarHBondContact O-N 3.24Å
943	P	32.6	Very low	42.9	Very low	84 Å²	84	111.7 Å²	111.7	55%	0.545	57%	0.572	S	S	.	*	S	Bend	trans	-60.1	127.8	166.8	29	-32.1	0	0	0	107.1	I945	P943-I945 PolarHBondContact O-N 3.24Å
944	K	34.3	Very low	42.3	Very low	142 Å²	142	111.1 Å²	111.1	62%	0.617	58%	0.579	S	S	*	*			trans	-58.2	130.4	172.3	-76.6	174.4	155.5	-153.3	0	107.1	G942 E946 E947	G942-K944 PolarHBondContact O-N 3.24Å; K944-E946 HydrophobicContact CB-CB 4.08Å; K944-E946 HydrophobicContact CB-CG 4.43Å; K944-E946 WeakPolarHBondContact CD-OE2 3.42Å; K944-E946 IonicContact NZ-OE2 2.91Å; K944-E946 PolarHBondContact NZ-OE2 3.09Å; K944-E946 PolarHBondContact O-N 3.27Å; K944-E947 PolarHBondContact O-N 2.89Å
945	I	37.6	Very low	41.8	Very low	140 Å²	140	114.2 Å²	114.2	72%	0.718	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-56.8	-16.6	171.8	-60.8	168.2	0	0	0	111	P943 E947 E948	P943-I945 PolarHBondContact O-N 3.24Å; I945-E947 PolarHBondContact O-N 3.3Å; I945-E948 PolarHBondContact O-N 2.91Å
946	E	34.9	Very low	41.4	Very low	132 Å²	132	121 Å²	121	62%	0.617	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-59.9	-17.2	169.4	-59.5	178.9	161.9	0	0	114	K944 E949	K944-E946 HydrophobicContact CB-CB 4.08Å; K944-E946 HydrophobicContact CB-CG 4.43Å; K944-E946 WeakPolarHBondContact CD-OE2 3.42Å; K944-E946 IonicContact NZ-OE2 2.91Å; K944-E946 PolarHBondContact NZ-OE2 3.09Å; K944-E946 PolarHBondContact O-N 3.27Å; E946-E949 CarbonylContact O-C 3.57Å
947	E	34.4	Very low	41.2	Very low	139 Å²	139	119 Å²	119	65%	0.65	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-85.2	-17	177.7	-125.6	172.1	-170.6	0	0	113.4	K944 I945	K944-E947 PolarHBondContact O-N 2.89Å; I945-E947 PolarHBondContact O-N 3.3Å
948	E	36.3	Very low	41.1	Very low	183 Å²	183	122.6 Å²	122.6	86%	0.855	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-14.6	171.1	-67.8	-171.8	170.9	0	0	112.7	I945	I945-E948 PolarHBondContact O-N 2.91Å
949	E	32.8	Very low	40.7	Very low	166 Å²	166	129.2 Å²	129.2	78%	0.776	67%	0.668	S	S	*	*			trans	-102.8	52	165.6	-88.3	-176.8	160.7	0	0	110.6	E946 E951	E946-E949 CarbonylContact O-C 3.57Å; E949-E951 PolarHBondContact O-N 3.37Å; E949-E951 VanDerWaalsContact O-N 3.09Å
950	Q	34.6	Very low	40.8	Very low	148 Å²	148	134.2 Å²	134.2	69%	0.692	68%	0.675	S	S	*	*			trans	-67.3	105.6	153.4	-89.6	-176.9	3	0	0	107.5
951	E	38.2	Very low	41.1	Very low	173 Å²	173	140.9 Å²	140.9	81%	0.808	71%	0.705	S	S	*	*			trans	-45	134.4	153.5	-71.6	-175.6	151.8	0	0	107.8	E949 E953	E949-E951 PolarHBondContact O-N 3.37Å; E949-E951 VanDerWaalsContact O-N 3.09Å; E951-E953 PolarHBondContact O-N 3.24Å
952	P	40.9	Very low	41.2	Very low	121 Å²	121	143.2 Å²	143.2	79%	0.786	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-54	132.8	176.6	22	-31.5	0	0	0	108.8
953	E	41.6	Very low	41.2	Very low	169 Å²	169	155.3 Å²	155.3	79%	0.79	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-49.5	132.8	177.9	-70	-173.4	152.7	0	0	109.4	E951	E951-E953 PolarHBondContact O-N 3.24Å
954	P	47	Very low	41.7	Very low	115 Å²	115	158.9 Å²	158.9	75%	0.747	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-57.1	135.8	177	23	-31.1	0	0	0	108.6	E956	P954-E956 PolarHBondContact O-N 3.39Å
955	P	47.2	Very low	42.1	Very low	123 Å²	123	159.8 Å²	159.8	80%	0.799	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-57.1	138.4	-178.3	23.1	-32.4	0	0	0	110
956	E	51.3	Low	42.3	Very low	181 Å²	181	160.9 Å²	160.9	85%	0.846	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-48.9	140.9	178	-69.5	-179	154.6	0	0	111	P954 F958	P954-E956 PolarHBondContact O-N 3.39Å; E956-F958 PolarHBondContact O-N 3.05Å; E956-F958 VanDerWaalsContact O-N 3.14Å
957	P	47.4	Very low	42.8	Very low	122 Å²	122	162.6 Å²	162.6	79%	0.792	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-59.4	122.6	-179.1	23.4	-31.3	0	0	0	109.8	E959	P957-E959 PolarHBondContact O-N 3.14Å
958	F	49.5	Very low	43.3	Very low	170 Å²	170	164.1 Å²	164.1	75%	0.746	82%	0.82	S	S	*	*			trans	-50.6	111.9	175	-169	-96.5	0	0	0	109.9	E956 Y960	E956-F958 PolarHBondContact O-N 3.05Å; E956-F958 VanDerWaalsContact O-N 3.14Å; F958-Y960 HydrophobicContact CD1-CD2 4.35Å; F958-Y960 HydrophobicContact CD1-CE2 4.33Å; F958-Y960 PolarHBondContact O-N 3.34Å
959	E	45.1	Very low	43.7	Very low	178 Å²	178	162.8 Å²	162.8	83%	0.832	82%	0.818	S	S	*	*			trans	-62.4	109.2	170	-72.4	-174.4	159.8	0	0	108.1	P957 I961	P957-E959 PolarHBondContact O-N 3.14Å; E959-I961 PolarHBondContact O-N 3.06Å
960	Y	51.7	Low	44.5	Very low	192 Å²	192	162.6 Å²	162.6	75%	0.753	82%	0.821	S	S	*	*			trans	-68.9	119.5	161.1	-77	-93.3	0	0	0	107	F958 D962	F958-Y960 HydrophobicContact CD1-CD2 4.35Å; F958-Y960 HydrophobicContact CD1-CE2 4.33Å; F958-Y960 PolarHBondContact O-N 3.34Å; Y960-D962 PolarHBondContact O-N 3.13Å; Y960-D962 VanDerWaalsContact O-N 3.13Å
961	I	46.6	Very low	45.3	Very low	165 Å²	165	163.7 Å²	163.7	85%	0.846	83%	0.831	S	S	*	*			trans	-67.9	107.8	162.3	-60.3	170.5	0	0	0	105.5	E959 E963	E959-I961 PolarHBondContact O-N 3.06Å; I961-E963 PolarHBondContact O-N 3.36Å
962	D	45	Very low	45.9	Very low	153 Å²	153	162.9 Å²	162.9	82%	0.818	83%	0.833	S	S	*	*			trans	-61.9	122.2	171.3	-75	-30.3	0	0	0	109.7	Y960	Y960-D962 PolarHBondContact O-N 3.13Å; Y960-D962 VanDerWaalsContact O-N 3.13Å
963	E	37.3	Very low	46.3	Very low	266 Å²	266	166.7 Å²	166.7	100%	1.243	84%	0.837	S	S	*	*			trans	-93.8	0	148.1	-103.2	-168.4	171.1	0	0	109.5	I961	I961-E963 PolarHBondContact O-N 3.36Å

Retrieved 963 of 963 residues in 863.9 ms (Link to these results)

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