A0A5K4F515_SCHMA Loading...

Rho-GAP domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F515, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,178 aa.

						>A0A5K4F515_SCHMA|A0A5K4F515
MVIERLMKKMIVNPVPKKAFKPTTVLSIPRHPMLTFGASLEDVIERDKTEIPIVISDIFNFLLNKGGLQSEGIFRVNGNSRTVEMLRTIVDENGGYWHLGEFSSIAGDLDRLVDVFSVASLLKLYLRELPEGLISENTTALFLQIHSEYRSKQDVYLTQLENLVAQLPVVNYTLLKHLCQFLHRVSVYQSENKMSIESLGIVFGPNVFRYTPENLGYREQNSINHIMGNLIEHSDSLFRMIAPSCENVTTLNDNLSGNNCAQIHHIPFNDTSVQAVRSKKYENIFGYNTSDSLSNVKSHNNEDDVDTDNLTQSTTKVETNHTLTHITNTCDVLQIGNKASTTPAATATTKANKAVPELAKTNDIVDTTDNHFKRKSSSCDIISTYLEIAIRSCIQEHLFQERLSDFKVYDTIDTVNNFNQSSIGINQISKSDYSDVNVPKTNSVSQANLKNSETNYPKLPSTTDRPNEPNDQILNRSAYYLLYFKSRLREYEKQFEHDYGRKPTNADKYSNPKIAELLRQLSEVQETMRQIKLSGKISDGTFSSIIGQNGYSSAYNTYENYSIKTQKNITNTINNNNIHNGSINEKITSSAYSEKQSFPKMDNEVNDYTRELRSSNSTFSSKSSILPNNKVENENLSRQFDSNRPIIESTFLLLSKRLTEKRMIANRPEDLHLMTPKQIAAEKLALQKALLYFENLHGRPKEHQDRITMRPLYDRYRSVKRLLNCLQSNNNLNIAEHTEENSDTELQSSVPSIDDPMRRRSILSPNIMPLINDSSIQLKSIHSTGTTSSSIASFKSINPVPYSSLQSINRLYNPVSSISDNNLPVPSMMSLPTSASFNMPIYSPITSPQSTLSNNNHVNDRLDVTRKQPTVVTSIPSTIRHNFNPNSTGLFNPNARPAYVDEKQNKNNFAFNKQSFNLDSNVDLKYNELDCDAKRTSDRNSKVPCGNNNEWFGTIGLSKRNQDSVIHNYHVNTFNCHSQCFNETNHHPPVENALPTSTHMSTRLFDSVTRSNRLTSGFSSPIRQENFIGAKAPYFSPPPLSSSFSSPKIMQANISNEVPLSTNTTALMKNRRRLLDTSENAINTVLSNDKCTDSSQAISSSDLSSWSTADLKTALRTLRESKRQLQKTLKDFEHEFIQNTGQKVEREDRLCMRSEYCEYKALKTRLFQLETELKGRCA
					

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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	41.3	Very low	55.1	Low	151 Å²	151	124 Å²	124	74%	0.744	60%	0.595	S	S	*	*				0	-56	0	-151.8	170	73.4	0	0	114.3	I3 E4 R5	M1-I3 PolarHBondContact O-N 3.44Å; M1-E4 WeakPolarHBondContact CA-OE2 3.42Å; M1-E4 PolarHBondContact N-OE2 2.73Å; M1-E4 PolarHBondContact O-N 3.3Å; M1-R5 PolarHBondContact O-N 3.44Å
2	V	50.7	Low	54.8	Low	108 Å²	108	119.9 Å²	119.9	66%	0.655	58%	0.583	S	S	*	*	H	α-helix	trans	-62.4	-43.4	177.8	178	0	0	0	0	111.6	E4 R5 L6	V2-E4 PolarHBondContact O-N 2.8Å; V2-R5 CarbonylContact O-C 3.59Å; V2-R5 PolarHBondContact O-N 3.27Å; V2-R5 VanDerWaalsContact O-N 3.12Å; V2-L6 HydrophobicContact CG1-CD1 4.18Å; V2-L6 WeakPolarHBondContact O-CG 3.26Å; V2-L6 PolarHBondContact O-N 2.88Å
3	I	59.9	Low	53.5	Low	120 Å²	120	119.4 Å²	119.4	62%	0.615	59%	0.585	S	S	*	*	H	α-helix	trans	-60.9	-42.6	175.4	-57.5	176.8	0	0	0	111	M1 R5 L6 M7	M1-I3 PolarHBondContact O-N 3.44Å; I3-R5 VanDerWaalsContact C-N 3.35Å; I3-R5 PolarHBondContact O-N 3.43Å; I3-L6 CarbonylContact O-C 3.55Å; I3-L6 WeakPolarHBondContact O-CA 3.46Å; I3-L6 WeakPolarHBondContact O-CB 3.48Å; I3-L6 PolarHBondContact O-N 2.91Å; I3-L6 VanDerWaalsContact O-N 3.08Å; I3-M7 HydrophobicContact CG2-CE 4.25Å; I3-M7 HydrophobicContact CG2-CG 4.37Å; I3-M7 WeakPolarHBondContact O-CG 3.47Å; I3-M7 PolarHBondContact O-N 2.9Å
4	E	58	Low	52.6	Low	67 Å²	67	118.8 Å²	118.8	31%	0.313	60%	0.595	S	S	.	*	H	α-helix	trans	-61.2	-39.2	172.6	-69	150.2	91	0	0	112.8	M1 V2 L6 M7 K8 K1143	M1-E4 WeakPolarHBondContact CA-OE2 3.42Å; M1-E4 PolarHBondContact N-OE2 2.73Å; M1-E4 PolarHBondContact O-N 3.3Å; V2-E4 PolarHBondContact O-N 2.8Å; E4-L6 VanDerWaalsContact C-N 3.28Å; E4-L6 PolarHBondContact O-N 3.07Å; E4-M7 PolarHBondContact O-N 3.48Å; E4-K8 VanDerWaalsContact O-CB 3.27Å; E4-K8 WeakPolarHBondContact O-CB 3.27Å; E4-K8 PolarHBondContact O-N 3.16Å; E4-K1143 IonicContact OE1-NZ 2.81Å; E4-K1143 PolarHBondContact OE1-NZ 3.44Å; E4-K1143 IonicContact OE2-NZ 2.78Å; E4-K1143 PolarHBondContact OE2-NZ 2.91Å
5	R	65.6	Low	51.8	Low	179 Å²	179	118.4 Å²	118.4	68%	0.675	60%	0.601	S	S	*	*	H	α-helix	trans	-69.9	-23.7	174.2	-82.4	-176.6	170.5	173	-1.8	112.9	M1 V2 I3 K9	M1-R5 PolarHBondContact O-N 3.44Å; V2-R5 CarbonylContact O-C 3.59Å; V2-R5 PolarHBondContact O-N 3.27Å; V2-R5 VanDerWaalsContact O-N 3.12Å; I3-R5 VanDerWaalsContact C-N 3.35Å; I3-R5 PolarHBondContact O-N 3.43Å; R5-K9 WeakPolarHBondContact O-CB 3.25Å; R5-K9 VanDerWaalsContact O-CG 3.28Å; R5-K9 WeakPolarHBondContact O-CG 3.45Å; R5-K9 PolarHBondContact O-N 3.41Å
6	L	51.5	Low	50.8	Low	95 Å²	95	116.6 Å²	116.6	50%	0.497	60%	0.6	S	S	.	*	H	α-helix	trans	-77.9	-46.8	170.4	-72.3	166.8	0	0	0	110.7	V2 I3 E4 K9 M10	V2-L6 HydrophobicContact CG1-CD1 4.18Å; V2-L6 WeakPolarHBondContact O-CG 3.26Å; V2-L6 PolarHBondContact O-N 2.88Å; I3-L6 CarbonylContact O-C 3.55Å; I3-L6 WeakPolarHBondContact O-CA 3.46Å; I3-L6 WeakPolarHBondContact O-CB 3.48Å; I3-L6 PolarHBondContact O-N 2.91Å; I3-L6 VanDerWaalsContact O-N 3.08Å; E4-L6 VanDerWaalsContact C-N 3.28Å; E4-L6 PolarHBondContact O-N 3.07Å; L6-K9 CarbonylContact O-C 3.56Å; L6-K9 WeakPolarHBondContact O-CA 3.15Å; L6-K9 WeakPolarHBondContact O-CB 3.43Å; L6-K9 PolarHBondContact O-N 3.48Å; L6-M10 WeakPolarHBondContact O-CG 3.48Å; L6-M10 PolarHBondContact O-N 3.17Å
7	M	60.1	Low	50.1	Low	101 Å²	101	121.7 Å²	121.7	50%	0.498	62%	0.616	S	S	.	*	H	α-helix	trans	-63.9	-49	176.2	-65.8	-161.8	-66.9	0	0	112.1	I3 E4 K9 M10 I11	I3-M7 HydrophobicContact CG2-CE 4.25Å; I3-M7 HydrophobicContact CG2-CG 4.37Å; I3-M7 WeakPolarHBondContact O-CG 3.47Å; I3-M7 PolarHBondContact O-N 2.9Å; E4-M7 PolarHBondContact O-N 3.48Å; M7-K9 PolarHBondContact O-N 3.42Å; M7-M10 PolarHBondContact O-N 3.12Å; M7-M10 VanDerWaalsContact O-N 3.15Å; M7-I11 HydrophobicContact CB-CD1 4.48Å; M7-I11 WeakPolarHBondContact O-CB 3.29Å; M7-I11 VanDerWaalsContact O-CG1 3.28Å; M7-I11 WeakPolarHBondContact O-CG1 3.03Å; M7-I11 PolarHBondContact O-N 3.39Å
8	K	62.4	Low	49.3	Very low	118 Å²	118	124.6 Å²	124.6	51%	0.513	62%	0.624	S	S	.	*	H	α-helix	trans	-61.8	-12.1	171.8	-72.2	-172.8	174.9	-178.4	0	112.5	E4 V12 E1133	E4-K8 VanDerWaalsContact O-CB 3.27Å; E4-K8 WeakPolarHBondContact O-CB 3.27Å; E4-K8 PolarHBondContact O-N 3.16Å; K8-V12 WeakPolarHBondContact O-CB 3.42Å; K8-V12 WeakPolarHBondContact O-CG2 3.31Å; K8-E1133 IonicContact NZ-OE1 3.74Å; K8-E1133 PolarHBondContact NZ-OE1 3.33Å; K8-E1133 VanDerWaalsContact NZ-OE1 3.09Å
9	K	56.2	Low	48.5	Very low	152 Å²	152	122.3 Å²	122.3	66%	0.661	63%	0.626	S	S	*	*	H	α-helix	trans	-92.3	-43.4	167.9	-85.5	-178.8	174.9	-178.1	0	113.6	R5 L6 M7 I11 V12 N13	R5-K9 WeakPolarHBondContact O-CB 3.25Å; R5-K9 VanDerWaalsContact O-CG 3.28Å; R5-K9 WeakPolarHBondContact O-CG 3.45Å; R5-K9 PolarHBondContact O-N 3.41Å; L6-K9 CarbonylContact O-C 3.56Å; L6-K9 WeakPolarHBondContact O-CA 3.15Å; L6-K9 WeakPolarHBondContact O-CB 3.43Å; L6-K9 PolarHBondContact O-N 3.48Å; M7-K9 PolarHBondContact O-N 3.42Å; K9-I11 VanDerWaalsContact C-N 3.3Å; K9-I11 PolarHBondContact O-N 3.3Å; K9-V12 PolarHBondContact O-N 2.85Å; K9-N13 PolarHBondContact O-N 3Å
10	M	44.7	Very low	47.8	Very low	133 Å²	133	124 Å²	124	66%	0.655	63%	0.629	S	S	*	*	H	α-helix	trans	-66.2	-31.4	178.9	-71.3	168.8	63.2	0	0	112.6	L6 M7	L6-M10 WeakPolarHBondContact O-CG 3.48Å; L6-M10 PolarHBondContact O-N 3.17Å; M7-M10 PolarHBondContact O-N 3.12Å; M7-M10 VanDerWaalsContact O-N 3.15Å
11	I	56.1	Low	47.2	Very low	140 Å²	140	124.5 Å²	124.5	72%	0.718	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-26.7	176.7	-64.8	165.5	0	0	0	111.8	M7 K9	M7-I11 HydrophobicContact CB-CD1 4.48Å; M7-I11 WeakPolarHBondContact O-CB 3.29Å; M7-I11 VanDerWaalsContact O-CG1 3.28Å; M7-I11 WeakPolarHBondContact O-CG1 3.03Å; M7-I11 PolarHBondContact O-N 3.39Å; K9-I11 VanDerWaalsContact C-N 3.3Å; K9-I11 PolarHBondContact O-N 3.3Å
12	V	51.3	Low	46.8	Very low	75 Å²	75	118.5 Å²	118.5	46%	0.455	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.1	-32.2	-174.9	174.3	0	0	0	0	112.8	K8 K9	K8-V12 WeakPolarHBondContact O-CB 3.42Å; K8-V12 WeakPolarHBondContact O-CG2 3.31Å; K9-V12 PolarHBondContact O-N 2.85Å
13	N	38.2	Very low	46.2	Very low	113 Å²	113	118.9 Å²	118.9	60%	0.604	60%	0.602	S	S	*	*	S	Bend	trans	-118.4	102.6	169.3	-73.5	37.4	0	0	0	108.2	K9 V15	K9-N13 PolarHBondContact O-N 3Å; N13-V15 PolarHBondContact O-N 2.71Å
14	P	40.6	Very low	45.2	Very low	111 Å²	111	116 Å²	116	72%	0.721	59%	0.59	S	S	*	*			trans	-60.6	112.9	164.5	26.6	-32.2	0	0	0	107.4	P16	P14-P16 WeakPolarHBondContact O-CD 3.41Å; P14-P16 VanDerWaalsContact O-N 3.15Å
15	V	40.1	Very low	44.3	Very low	113 Å²	113	116.9 Å²	116.9	69%	0.685	60%	0.6	S	S	*	*			trans	-60.3	120.1	171.1	178.2	0	0	0	0	105.7	N13 K17	N13-V15 PolarHBondContact O-N 2.71Å; V15-K17 PolarHBondContact O-N 2.59Å
16	P	36.7	Very low	42.9	Very low	90 Å²	90	114.2 Å²	114.2	58%	0.584	60%	0.598	S	S	*	*			trans	-55.9	130.3	179.8	23.1	-33.2	0	0	0	107.6	P14 K18	P14-P16 WeakPolarHBondContact O-CD 3.41Å; P14-P16 VanDerWaalsContact O-N 3.15Å; P16-K18 VanDerWaalsContact C-N 3.33Å; P16-K18 PolarHBondContact O-N 3.36Å
17	K	37.6	Very low	42.2	Very low	203 Å²	203	114.7 Å²	114.7	88%	0.883	61%	0.61	S	S	*	*			trans	-51.1	96	-174.3	-72.5	-173	178.3	-173	0	109	V15 A19	V15-K17 PolarHBondContact O-N 2.59Å; K17-A19 VanDerWaalsContact C-N 3.31Å; K17-A19 PolarHBondContact O-N 3.13Å
18	K	36.4	Very low	41.2	Very low	174 Å²	174	112 Å²	112	76%	0.757	60%	0.597	S	S	*	*			trans	-73.2	96.7	170.1	-84.5	-160.8	167.2	-157.8	0	105.6	P16 F20	P16-K18 VanDerWaalsContact C-N 3.33Å; P16-K18 PolarHBondContact O-N 3.36Å; K18-F20 PolarHBondContact O-N 2.89Å
19	A	33.3	Very low	39.6	Very low	81 Å²	81	112.6 Å²	112.6	67%	0.669	61%	0.613	S	S	*	*			trans	-44.3	125	168.6	0	0	0	0	0	108.1	K17 K21	K17-A19 VanDerWaalsContact C-N 3.31Å; K17-A19 PolarHBondContact O-N 3.13Å; A19-K21 PolarHBondContact O-N 3.47Å
20	F	35.4	Very low	38.6	Very low	156 Å²	156	111.4 Å²	111.4	68%	0.684	60%	0.604	S	S	*	*			trans	-76	78.6	174.9	-168.6	-89.8	0	0	0	106.1	K18 P22 M85	K18-F20 PolarHBondContact O-N 2.89Å; F20-P22 VanDerWaalsContact O-CD 3.31Å; F20-P22 WeakPolarHBondContact O-CD 3.49Å; F20-P22 VanDerWaalsContact O-N 3.09Å; F20-M85 HydrophobicContact CD1-SD 4.41Å; F20-M85 HydrophobicContact CE1-SD 4.24Å
21	K	34.4	Very low	38.3	Very low	134 Å²	134	113.3 Å²	113.3	58%	0.583	61%	0.611	S	S	*	*			trans	-54.1	119.4	178.3	-77.7	-156.1	169.1	-145.4	0	107.7	A19 Y551	A19-K21 PolarHBondContact O-N 3.47Å; K21-Y551 PolarHBondContact NZ-OH 2.93Å
22	P	34.2	Very low	38.1	Very low	25 Å²	25	111.3 Å²	111.3	16%	0.162	61%	0.608	C	S	.	*			trans	-60.9	167.8	167.9	29.6	-35.9	0	0	0	109.5	F20 T24 T88 I89 E92	F20-P22 VanDerWaalsContact O-CD 3.31Å; F20-P22 WeakPolarHBondContact O-CD 3.49Å; F20-P22 VanDerWaalsContact O-N 3.09Å; P22-T24 PolarHBondContact O-N 3.44Å; P22-T88 HydrophobicContact CG-CG2 3.98Å; P22-I89 HydrophobicContact CB-CG1 4.39Å; P22-E92 WeakPolarHBondContact CG-OE1 3.4Å; P22-E92 VanDerWaalsContact CG-OE2 3.23Å; P22-E92 WeakPolarHBondContact CG-OE2 3.34Å
23	T	37.8	Very low	38.6	Very low	116 Å²	116	113.9 Å²	113.9	71%	0.712	62%	0.616	S	S	*	*			trans	-77.9	76.5	-177	-59.8	0	0	0	0	109.5	V25 Y555	T23-V25 PolarHBondContact O-N 2.95Å; T23-Y555 HydrophobicContact CG2-CE1 3.96Å; T23-Y555 VanDerWaalsContact CG2-OH 3.27Å; T23-Y555 WeakPolarHBondContact CG2-OH 3.23Å; T23-Y555 PolarHBondContact O-OH 3.47Å
24	T	38.1	Very low	40.7	Very low	59 Å²	59	112.7 Å²	112.7	36%	0.362	61%	0.609	S	S	.	*			trans	-47.2	97.8	-174.5	54.8	0	0	0	0	112.7	P22 Y555	P22-T24 PolarHBondContact O-N 3.44Å; T24-Y555 PolarHBondContact O-OH 3.49Å
25	V	40.5	Very low	42.9	Very low	87 Å²	87	107.5 Å²	107.5	53%	0.527	58%	0.575	S	S	.	*			trans	-56.9	149.3	165.8	-112.5	0	0	0	0	108.8	T23 S27	T23-V25 PolarHBondContact O-N 2.95Å; V25-S27 VanDerWaalsContact C-N 3.31Å; V25-S27 PolarHBondContact O-N 3.09Å
26	L	35.4	Very low	45.3	Very low	122 Å²	122	102.1 Å²	102.1	64%	0.639	54%	0.543	S	S	*	.			trans	-73.4	78.1	-167	-74.6	155.9	0	0	0	112.5
27	S	36.8	Very low	47.9	Very low	106 Å²	106	99.7 Å²	99.7	74%	0.741	53%	0.534	S	S	*	.			trans	-71.8	135.6	169	45.6	0	0	0	0	111.6	V25	V25-S27 VanDerWaalsContact C-N 3.31Å; V25-S27 PolarHBondContact O-N 3.09Å
28	I	38.8	Very low	50.5	Low	45 Å²	45	90.9 Å²	90.9	23%	0.231	50%	0.499	C	S	.	.			trans	-63.7	148.1	162	-58.4	159.9	0	0	0	107	R30 L474	I28-R30 PolarHBondContact O-N 2.83Å; I28-L474 HydrophobicContact CD1-CB 4.5Å; I28-L474 HydrophobicContact CD1-CD2 3.7Å; I28-L474 HydrophobicContact CD1-CG 3.99Å; I28-L474 HydrophobicContact CG1-CD2 3.77Å; I28-L474 HydrophobicContact CG1-CG 4.43Å
29	P	29	Very low	53.1	Low	129 Å²	129	84 Å²	84	84%	0.838	47%	0.473	S	S	*	.			trans	-68.4	74.6	174.7	30.4	-37.3	0	0	0	112
30	R	34.7	Very low	56	Low	127 Å²	127	80.4 Å²	80.4	48%	0.479	44%	0.442	S	S	.	.			trans	-76.4	145.2	154.3	-63.6	-171.9	168.9	106.8	27.9	107.2	I28 P32 N475	I28-R30 PolarHBondContact O-N 2.83Å; R30-P32 WeakPolarHBondContact O-CD 3.17Å; R30-N475 VanDerWaalsContact CZ-OD1 3.22Å; R30-N475 PolarHBondContact NH1-OD1 3.27Å; R30-N475 VanDerWaalsContact NH2-CG 3.34Å; R30-N475 PolarHBondContact NH2-ND2 2.7Å; R30-N475 VanDerWaalsContact NH2-ND2 3.12Å; R30-N475 PolarHBondContact NH2-OD1 2.78Å
31	H	39.3	Very low	58.7	Low	173 Å²	173	77 Å²	77	80%	0.801	43%	0.429	S	S	*	.			trans	-57.2	124.5	171.9	-72	-100.9	0	0	0	108.1	M33	H31-M33 PolarHBondContact O-N 3.33Å
32	P	50.6	Low	61.3	Low	99 Å²	99	75.4 Å²	75.4	64%	0.643	43%	0.427	S	S	*	.			trans	-69.6	97	179.5	27.7	-32.8	0	0	0	108.2	R30 L34	R30-P32 WeakPolarHBondContact O-CD 3.17Å; P32-L34 VanDerWaalsContact C-N 3.3Å; P32-L34 PolarHBondContact O-N 3.23Å
33	M	62.8	Low	63.9	Low	129 Å²	129	74.3 Å²	74.3	64%	0.635	42%	0.419	S	S	*	.			trans	-70.1	92.9	172.4	-70.4	-174.3	119.2	0	0	107.8	H31 R46	H31-M33 PolarHBondContact O-N 3.33Å; M33-R46 PolarHBondContact O-NH1 2.9Å; M33-R46 VanDerWaalsContact O-NH1 3.1Å; M33-R46 HydrophobicContact SD-CG 4.45Å
34	L	81.7	Confident	66.4	Low	88 Å²	88	70 Å²	70	46%	0.461	39%	0.392	S	S	.	.			trans	-49.2	142.9	176.7	-62.4	174.5	0	0	0	110	P32 A38 R46 D91	P32-L34 VanDerWaalsContact C-N 3.3Å; P32-L34 PolarHBondContact O-N 3.23Å; L34-A38 WeakPolarHBondContact O-CB 3.39Å; L34-R46 PolarHBondContact O-NH1 3.39Å; L34-D91 HydrophobicContact CD2-CB 4.16Å
35	T	86.6	Confident	68.8	Low	1 Å²	1	74.6 Å²	74.6	1%	0.006	41%	0.409	C	S	.	.	S	Bend	trans	-103.6	-34.6	170.4	-56.8	0	0	0	0	109.3	V43 R46 V54 V90 D91 Y125	T35-V43 HydrophobicContact CG2-CG1 4.42Å; T35-R46 PolarHBondContact OG1-NH1 3.46Å; T35-R46 PolarHBondContact OG1-NH2 3.32Å; T35-R46 VanDerWaalsContact OG1-NH2 3.14Å; T35-V54 HydrophobicContact CG2-CB 4.45Å; T35-V54 HydrophobicContact CG2-CG1 3.82Å; T35-V90 HydrophobicContact CG2-CG1 3.74Å; T35-D91 PolarHBondContact N-OD1 3.16Å; T35-Y125 HydrophobicContact CG2-CE2 4.07Å; T35-Y125 VanDerWaalsContact O-CE2 3.27Å; T35-Y125 WeakPolarHBondContact O-CE2 3.27Å
36	F	91.9	Very high	70.9	Confident	1 Å²	1	73 Å²	73	0%	0.004	39%	0.394	C	S	.	.	S	Bend	trans	-90.8	116.6	171	-74.1	-102.4	0	0	0	111.1	R87 V90 D91 L121 L124 Y125	F36-R87 HydrophobicContact CB-CG 4.16Å; F36-R87 HydrophobicContact CD1-CG 3.86Å; F36-R87 HydrophobicContact CD2-CG 3.86Å; F36-R87 HydrophobicContact CE1-CG 4.2Å; F36-R87 HydrophobicContact CE2-CG 4.22Å; F36-R87 HydrophobicContact CG-CG 3.69Å; F36-R87 HydrophobicContact CZ-CG 4.4Å; F36-R87 PolarHBondContact O-NH2 3.26Å; F36-V90 HydrophobicContact CD2-CB 4.28Å; F36-V90 HydrophobicContact CD2-CG1 4.24Å; F36-V90 HydrophobicContact CE2-CB 3.82Å; F36-V90 HydrophobicContact CE2-CG1 3.87Å; F36-V90 HydrophobicContact CE2-CG2 4.13Å; F36-D91 PolarHBondContact N-OD1 2.98Å; F36-L121 HydrophobicContact CE1-CD1 4.01Å; F36-L121 HydrophobicContact CE2-CD1 4.37Å; F36-L121 HydrophobicContact CZ-CD1 3.51Å; F36-L121 HydrophobicContact CZ-CG 3.88Å; F36-L124 HydrophobicContact CD1-CG 4.35Å; F36-L124 HydrophobicContact CE1-CB 4.29Å; F36-L124 HydrophobicContact CE1-CD2 4.34Å; F36-L124 HydrophobicContact CE1-CG 4.15Å; F36-Y125 HydrophobicContact CD1-CD2 4.21Å; F36-Y125 HydrophobicContact CE1-CD2 4.12Å; F36-Y125 HydrophobicContact CE1-CG 4.39Å; F36-Y125 HydrophobicContact CE2-CD2 4.45Å; F36-Y125 HydrophobicContact CG-CD2 4.41Å; F36-Y125 HydrophobicContact CZ-CD2 4.22Å
37	G	91.1	Very high	73.2	Confident	39 Å²	39	68.1 Å²	68.1	40%	0.402	37%	0.368	S	S	.	.	S	Bend	trans	94.2	3	179.7	0	0	0	0	0	115.4	E128	G37-E128 WeakPolarHBondContact CA-O 3.45Å
38	A	91	Very high	75.6	Confident	18 Å²	18	71.9 Å²	71.9	15%	0.149	37%	0.371	C	S	.	.	S	Bend	trans	-79.8	166.9	162.9	0	0	0	0	0	110.7	L34 V43 P130	L34-A38 WeakPolarHBondContact O-CB 3.39Å; A38-V43 HydrophobicContact CB-CG2 3.79Å; A38-P130 WeakPolarHBondContact O-CD 3.49Å
39	S	92.3	Very high	77.8	Confident	28 Å²	28	72.4 Å²	72.4	20%	0.196	38%	0.376	C	S	.	.			trans	-62.7	166.1	167.9	74.9	0	0	0	0	110.5	E41 D42 V43	S39-E41 VanDerWaalsContact C-N 3.34Å; S39-E41 WeakPolarHBondContact CB-OE2 3.37Å; S39-D42 VanDerWaalsContact OG-CB 3.25Å; S39-D42 WeakPolarHBondContact OG-CB 3.41Å; S39-D42 PolarHBondContact OG-N 2.86Å; S39-D42 PolarHBondContact OG-OD1 3.4Å; S39-V43 WeakPolarHBondContact O-CG2 3.38Å
40	L	93.1	Very high	80.6	Confident	6 Å²	6	72.4 Å²	72.4	3%	0.031	37%	0.365	C	S	.	.	H	α-helix	trans	-73.9	-36.9	174.5	-179.5	55.1	0	0	0	109.9	V43 I44 P52 L133 V170 L174	L40-V43 PolarHBondContact O-N 3.23Å; L40-I44 HydrophobicContact CD1-CG1 4.14Å; L40-I44 HydrophobicContact CG-CG1 4.33Å; L40-I44 WeakPolarHBondContact O-CB 3.27Å; L40-I44 WeakPolarHBondContact O-CG1 3.16Å; L40-I44 PolarHBondContact O-N 2.97Å; L40-P52 HydrophobicContact CD1-CG 3.57Å; L40-L133 HydrophobicContact CD2-CD1 4.13Å; L40-V170 HydrophobicContact CB-CG2 4.36Å; L40-V170 HydrophobicContact CD2-CB 4.07Å; L40-V170 HydrophobicContact CD2-CG2 3.96Å; L40-V170 HydrophobicContact CG-CB 4.07Å; L40-V170 HydrophobicContact CG-CG2 3.95Å; L40-L174 HydrophobicContact CD1-CD2 3.65Å; L40-L174 HydrophobicContact CD2-CB 4.16Å; L40-L174 HydrophobicContact CD2-CD2 3.87Å; L40-L174 HydrophobicContact CG-CD2 4.45Å
41	E	91.5	Very high	83.4	Confident	85 Å²	85	67.2 Å²	67.2	40%	0.397	35%	0.347	S	S	.	.	H	α-helix	trans	-58	-54.6	178.9	-64.3	67.1	-154.1	0	0	111.7	S39 V43 I44 E45 V170 N171	S39-E41 VanDerWaalsContact C-N 3.34Å; S39-E41 WeakPolarHBondContact CB-OE2 3.37Å; E41-V43 PolarHBondContact O-N 2.98Å; E41-I44 PolarHBondContact O-N 3.28Å; E41-E45 PolarHBondContact O-N 2.96Å; E41-V170 HydrophobicContact CG-CG2 4.06Å; E41-V170 WeakPolarHBondContact OE1-CG2 3.48Å; E41-N171 PolarHBondContact OE1-OD1 3.28Å
42	D	90	Very high	85.9	Confident	101 Å²	101	59 Å²	59	54%	0.54	31%	0.308	S	S	.	.	H	α-helix	trans	-57.2	-40.2	180	-65.2	13.9	0	0	0	110.9	S39 R46	S39-D42 VanDerWaalsContact OG-CB 3.25Å; S39-D42 WeakPolarHBondContact OG-CB 3.41Å; S39-D42 PolarHBondContact OG-N 2.86Å; S39-D42 PolarHBondContact OG-OD1 3.4Å; D42-R46 WeakPolarHBondContact O-CB 3.43Å; D42-R46 PolarHBondContact O-N 3.33Å; D42-R46 VanDerWaalsContact O-N 3.08Å
43	V	89.3	Confident	87.6	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-73.5	-40.1	-178.4	176.3	0	0	0	0	110.8	T35 A38 S39 L40 E41 D47 P52	T35-V43 HydrophobicContact CG2-CG1 4.42Å; A38-V43 HydrophobicContact CB-CG2 3.79Å; S39-V43 WeakPolarHBondContact O-CG2 3.38Å; L40-V43 PolarHBondContact O-N 3.23Å; E41-V43 PolarHBondContact O-N 2.98Å; V43-D47 WeakPolarHBondContact O-CB 3.38Å; V43-D47 VanDerWaalsContact O-CG 3.25Å; V43-D47 PolarHBondContact O-N 2.89Å; V43-P52 HydrophobicContact CG1-CB 3.73Å; V43-P52 HydrophobicContact CG1-CG 4.06Å
44	I	90.1	Very high	88.8	Confident	27 Å²	27	49.9 Å²	49.9	14%	0.138	26%	0.257	C	S	.	.	H	α-helix	trans	-65.9	-44.7	175.7	-69.9	-74.5	0	0	0	111.4	L40 E41 R46 D47 K48 T49 P52 V170	L40-I44 HydrophobicContact CD1-CG1 4.14Å; L40-I44 HydrophobicContact CG-CG1 4.33Å; L40-I44 WeakPolarHBondContact O-CB 3.27Å; L40-I44 WeakPolarHBondContact O-CG1 3.16Å; L40-I44 PolarHBondContact O-N 2.97Å; E41-I44 PolarHBondContact O-N 3.28Å; I44-R46 VanDerWaalsContact C-N 3.34Å; I44-R46 PolarHBondContact O-N 2.91Å; I44-D47 PolarHBondContact O-N 3.37Å; I44-K48 WeakPolarHBondContact O-CA 3.46Å; I44-K48 PolarHBondContact O-N 3.28Å; I44-T49 WeakPolarHBondContact CD1-O 3.25Å; I44-P52 HydrophobicContact CD1-CG 4.26Å; I44-V170 HydrophobicContact CB-CG1 4.25Å; I44-V170 HydrophobicContact CG1-CB 4.29Å; I44-V170 HydrophobicContact CG1-CG1 4.08Å; I44-V170 HydrophobicContact CG2-CG1 3.92Å
45	E	88.4	Confident	89.3	Confident	155 Å²	155	45.7 Å²	45.7	72%	0.724	24%	0.235	S	C	*	.	H	α-helix	trans	-63.9	-40.4	178	-170.7	-175.6	167.8	0	0	111.7	E41 K48	E41-E45 PolarHBondContact O-N 2.96Å; E45-K48 WeakPolarHBondContact O-CG 3.46Å
46	R	84.2	Confident	89.5	Confident	54 Å²	54	47.4 Å²	47.4	20%	0.204	25%	0.247	C	C	.	.	H	α-helix	trans	-65.9	-48.3	176	-177	-163.5	75.3	-179.9	3.9	112.5	M33 L34 T35 D42 I44	M33-R46 PolarHBondContact O-NH1 2.9Å; M33-R46 VanDerWaalsContact O-NH1 3.1Å; M33-R46 HydrophobicContact SD-CG 4.45Å; L34-R46 PolarHBondContact O-NH1 3.39Å; T35-R46 PolarHBondContact OG1-NH1 3.46Å; T35-R46 PolarHBondContact OG1-NH2 3.32Å; T35-R46 VanDerWaalsContact OG1-NH2 3.14Å; D42-R46 WeakPolarHBondContact O-CB 3.43Å; D42-R46 PolarHBondContact O-N 3.33Å; D42-R46 VanDerWaalsContact O-N 3.08Å; I44-R46 VanDerWaalsContact C-N 3.34Å; I44-R46 PolarHBondContact O-N 2.91Å
47	D	84.4	Confident	89.2	Confident	18 Å²	18	47.9 Å²	47.9	10%	0.096	25%	0.25	C	C	.	.	H	α-helix	trans	-80.6	-25.7	-173.8	-72.9	9.1	0	0	0	112.6	V43 I44 I53	V43-D47 WeakPolarHBondContact O-CB 3.38Å; V43-D47 VanDerWaalsContact O-CG 3.25Å; V43-D47 PolarHBondContact O-N 2.89Å; I44-D47 PolarHBondContact O-N 3.37Å; D47-I53 HydrophobicContact CB-CD1 3.78Å; D47-I53 HydrophobicContact CB-CG1 3.89Å; D47-I53 PolarHBondContact OD2-N 3.38Å; D47-I53 VanDerWaalsContact OD2-N 3.13Å
48	K	85.7	Confident	89.2	Confident	185 Å²	185	46.3 Å²	46.3	80%	0.804	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.8	42.1	-178.2	-55.7	-171.7	179.4	-169.3	0	113.8	I44 E45	I44-K48 WeakPolarHBondContact O-CA 3.46Å; I44-K48 PolarHBondContact O-N 3.28Å; E45-K48 WeakPolarHBondContact O-CG 3.46Å
49	T	86.4	Confident	89.3	Confident	56 Å²	56	46 Å²	46	34%	0.344	23%	0.227	S	C	.	.	S	Bend	trans	-132.3	156.2	-179.6	49.8	0	0	0	0	111.2	I44 I51 I53	I44-T49 WeakPolarHBondContact CD1-O 3.25Å; T49-I51 VanDerWaalsContact C-N 3.25Å; T49-I51 WeakPolarHBondContact CB-O 3.33Å; T49-I51 PolarHBondContact O-N 2.99Å; T49-I51 PolarHBondContact OG1-O 2.89Å; T49-I53 HydrophobicContact CG2-CG1 4.17Å
50	E	88.1	Confident	89.2	Confident	129 Å²	129	45.6 Å²	45.6	60%	0.603	22%	0.223	S	C	*	.	S	Bend	trans	-64.4	-27.7	-178.2	-62.4	-179.7	166.6	0	0	113.8	T173	E50-T173 HydrophobicContact CB-CG2 4.13Å; E50-T173 WeakPolarHBondContact O-CG2 3.12Å
51	I	92.6	Very high	89	Confident	18 Å²	18	46.1 Å²	46.1	9%	0.092	23%	0.225	C	C	.	.	S	Bend	trans	-133.7	156.5	170.2	60	173.7	0	0	0	109.2	T49 I55 F59 T173 L174 H177	T49-I51 VanDerWaalsContact C-N 3.25Å; T49-I51 WeakPolarHBondContact CB-O 3.33Å; T49-I51 PolarHBondContact O-N 2.99Å; T49-I51 PolarHBondContact OG1-O 2.89Å; I51-I55 HydrophobicContact CD1-CG2 4.25Å; I51-F59 HydrophobicContact CD1-CE2 4.42Å; I51-T173 HydrophobicContact CG2-CG2 4.19Å; I51-L174 HydrophobicContact CB-CD1 4.4Å; I51-L174 HydrophobicContact CG2-CB 4.36Å; I51-L174 HydrophobicContact CG2-CD1 4.22Å; I51-H177 HydrophobicContact CD1-CB 4.34Å; I51-H177 HydrophobicContact CG2-CB 4.28Å; I51-H177 VanDerWaalsContact CG2-CD2 3.47Å; I51-H177 WeakPolarHBondContact CG2-CD2 3.33Å
52	P	91.5	Very high	89	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.206	C	C	.	.			trans	-57.8	139.3	179	-26	37.2	0	0	0	111.9	L40 V43 I44 V54 I55 S56 Y125	L40-P52 HydrophobicContact CD1-CG 3.57Å; V43-P52 HydrophobicContact CG1-CB 3.73Å; V43-P52 HydrophobicContact CG1-CG 4.06Å; I44-P52 HydrophobicContact CD1-CG 4.26Å; P52-V54 HydrophobicContact CB-CG1 4.06Å; P52-V54 PolarHBondContact O-N 3.19Å; P52-V54 VanDerWaalsContact O-N 3.16Å; P52-I55 HydrophobicContact CB-CG1 4.16Å; P52-I55 HydrophobicContact CG-CG1 4.35Å; P52-I55 WeakPolarHBondContact O-CB 3.4Å; P52-I55 PolarHBondContact O-N 3.38Å; P52-S56 PolarHBondContact O-N 2.93Å; P52-Y125 WeakPolarHBondContact CG-OH 3.44Å
53	I	86.9	Confident	89.1	Confident	35 Å²	35	39.1 Å²	39.1	18%	0.179	19%	0.19	C	C	.	.	H	α-helix	trans	-59.4	-37.9	-172.7	-57.9	165.2	0	0	0	110.7	D47 T49 I55 S56 D57	D47-I53 HydrophobicContact CB-CD1 3.78Å; D47-I53 HydrophobicContact CB-CG1 3.89Å; D47-I53 PolarHBondContact OD2-N 3.38Å; D47-I53 VanDerWaalsContact OD2-N 3.13Å; T49-I53 HydrophobicContact CG2-CG1 4.17Å; I53-I55 PolarHBondContact O-N 2.75Å; I53-S56 PolarHBondContact O-N 3.23Å; I53-D57 WeakPolarHBondContact O-CB 3.27Å; I53-D57 PolarHBondContact O-N 3.22Å
54	V	87.7	Confident	89	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.012	22%	0.224	C	C	.	.	H	α-helix	trans	-55.8	-32.8	175.1	64.8	0	0	0	0	113.6	T35 P52 I58 V90 Y125	T35-V54 HydrophobicContact CG2-CB 4.45Å; T35-V54 HydrophobicContact CG2-CG1 3.82Å; P52-V54 HydrophobicContact CB-CG1 4.06Å; P52-V54 PolarHBondContact O-N 3.19Å; P52-V54 VanDerWaalsContact O-N 3.16Å; V54-I58 HydrophobicContact CG2-CD1 4.04Å; V54-I58 WeakPolarHBondContact O-CB 3.42Å; V54-I58 WeakPolarHBondContact O-CD1 3.19Å; V54-I58 WeakPolarHBondContact O-CG1 3.47Å; V54-I58 PolarHBondContact O-N 2.82Å; V54-V90 HydrophobicContact CB-CG1 4.21Å; V54-V90 HydrophobicContact CG2-CG1 3.94Å; V54-V90 HydrophobicContact CG2-CG2 4.04Å; V54-Y125 HydrophobicContact CG1-CD2 4.15Å; V54-Y125 HydrophobicContact CG1-CE2 3.97Å
55	I	92.9	Very high	88.7	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-76.6	-44.6	178.7	-60.3	-64.9	0	0	0	110.8	I51 P52 I53 D57 I58 F59 L122 Y125 L174	I51-I55 HydrophobicContact CD1-CG2 4.25Å; P52-I55 HydrophobicContact CB-CG1 4.16Å; P52-I55 HydrophobicContact CG-CG1 4.35Å; P52-I55 WeakPolarHBondContact O-CB 3.4Å; P52-I55 PolarHBondContact O-N 3.38Å; I53-I55 PolarHBondContact O-N 2.75Å; I55-D57 VanDerWaalsContact C-N 3.29Å; I55-D57 PolarHBondContact O-N 3.44Å; I55-I58 PolarHBondContact O-N 2.79Å; I55-F59 HydrophobicContact CG2-CD2 4.1Å; I55-F59 HydrophobicContact CG2-CE1 4.07Å; I55-F59 HydrophobicContact CG2-CE2 3.55Å; I55-F59 HydrophobicContact CG2-CZ 3.53Å; I55-F59 WeakPolarHBondContact O-CG 3.41Å; I55-F59 PolarHBondContact O-N 3.34Å; I55-L122 HydrophobicContact CD1-CD1 3.5Å; I55-L122 HydrophobicContact CG2-CD1 4.48Å; I55-Y125 HydrophobicContact CD1-CD1 3.6Å; I55-Y125 HydrophobicContact CD1-CE1 3.99Å; I55-Y125 HydrophobicContact CD1-CG 4.05Å; I55-Y125 HydrophobicContact CG1-CD1 4.28Å; I55-Y125 HydrophobicContact CG1-CE1 4.17Å; I55-L174 HydrophobicContact CB-CD1 4.39Å; I55-L174 HydrophobicContact CG1-CD1 4.15Å; I55-L174 HydrophobicContact CG2-CD1 3.86Å
56	S	90.2	Very high	88.6	Confident	37 Å²	37	41.8 Å²	41.8	26%	0.259	21%	0.212	S	C	.	.	H	α-helix	trans	-56.5	-46.1	173.4	-172.6	0	0	0	0	110.8	P52 I53 I58 F59 N60	P52-S56 PolarHBondContact O-N 2.93Å; I53-S56 PolarHBondContact O-N 3.23Å; S56-I58 PolarHBondContact O-N 2.89Å; S56-F59 PolarHBondContact O-N 3.43Å; S56-N60 WeakPolarHBondContact O-CB 3.33Å; S56-N60 PolarHBondContact O-N 3.23Å; S56-N60 PolarHBondContact O-ND2 2.8Å; S56-N60 PolarHBondContact OG-ND2 3.07Å
57	D	85.6	Confident	88.9	Confident	11 Å²	11	39.3 Å²	39.3	6%	0.059	20%	0.204	C	C	.	.	H	α-helix	trans	-60.6	-42.9	175.9	-95.1	38.5	0	0	0	113.6	I53 I55 N60 F61 W97 L99	I53-D57 WeakPolarHBondContact O-CB 3.27Å; I53-D57 PolarHBondContact O-N 3.22Å; I55-D57 VanDerWaalsContact C-N 3.29Å; I55-D57 PolarHBondContact O-N 3.44Å; D57-N60 PolarHBondContact O-N 3.31Å; D57-F61 WeakPolarHBondContact O-CB 3.39Å; D57-F61 PolarHBondContact O-N 3.04Å; D57-W97 VanDerWaalsContact CG-NE1 3.27Å; D57-W97 PolarHBondContact OD2-NE1 3.33Å; D57-L99 VanDerWaalsContact OD1-CA 3.28Å; D57-L99 WeakPolarHBondContact OD1-CA 3.48Å; D57-L99 VanDerWaalsContact OD1-CB 3.23Å; D57-L99 WeakPolarHBondContact OD1-CB 3.44Å; D57-L99 WeakPolarHBondContact OD1-CD1 3.49Å; D57-L99 WeakPolarHBondContact OD1-CG 3.46Å; D57-L99 WeakPolarHBondContact OD2-CA 3.19Å
58	I	91.3	Very high	89.5	Confident	5 Å²	5	39.1 Å²	39.1	3%	0.026	20%	0.202	C	C	.	.	H	α-helix	trans	-63.1	-45.5	176.6	-78.2	167.2	0	0	0	110.7	V54 I55 S56 F61 L62 V118 L121 L122	V54-I58 HydrophobicContact CG2-CD1 4.04Å; V54-I58 WeakPolarHBondContact O-CB 3.42Å; V54-I58 WeakPolarHBondContact O-CD1 3.19Å; V54-I58 WeakPolarHBondContact O-CG1 3.47Å; V54-I58 PolarHBondContact O-N 2.82Å; I55-I58 PolarHBondContact O-N 2.79Å; S56-I58 PolarHBondContact O-N 2.89Å; I58-F61 PolarHBondContact O-N 3.15Å; I58-L62 HydrophobicContact CG2-CD1 3.99Å; I58-L62 WeakPolarHBondContact O-CB 3.37Å; I58-L62 VanDerWaalsContact O-CG 3.25Å; I58-L62 WeakPolarHBondContact O-CG 3.28Å; I58-L62 PolarHBondContact O-N 3.09Å; I58-V118 HydrophobicContact CB-CG1 4.31Å; I58-V118 HydrophobicContact CG1-CG1 3.97Å; I58-V118 HydrophobicContact CG2-CG1 4.09Å; I58-L121 HydrophobicContact CD1-CB 4.43Å; I58-L121 HydrophobicContact CD1-CD2 4.07Å; I58-L121 HydrophobicContact CD1-CG 4.17Å; I58-L121 HydrophobicContact CG1-CD2 4.48Å; I58-L122 HydrophobicContact CG2-CB 3.95Å; I58-L122 HydrophobicContact CG2-CD1 4.14Å; I58-L122 HydrophobicContact CG2-CD2 4.39Å; I58-L122 HydrophobicContact CG2-CG 4.37Å
59	F	93.8	Very high	89.9	Confident	12 Å²	12	33.9 Å²	33.9	5%	0.053	18%	0.181	C	C	.	.	H	α-helix	trans	-62	-48.7	176.4	-65.7	-19.1	0	0	0	111.1	I51 I55 S56 F61 L62 L63 L122 H177 L178 F181	I51-F59 HydrophobicContact CD1-CE2 4.42Å; I55-F59 HydrophobicContact CG2-CD2 4.1Å; I55-F59 HydrophobicContact CG2-CE1 4.07Å; I55-F59 HydrophobicContact CG2-CE2 3.55Å; I55-F59 HydrophobicContact CG2-CZ 3.53Å; I55-F59 WeakPolarHBondContact O-CG 3.41Å; I55-F59 PolarHBondContact O-N 3.34Å; S56-F59 PolarHBondContact O-N 3.43Å; F59-F61 PolarHBondContact O-N 3.23Å; F59-L62 PolarHBondContact O-N 3.46Å; F59-L63 WeakPolarHBondContact O-CB 3.49Å; F59-L63 WeakPolarHBondContact O-CD1 3.34Å; F59-L63 WeakPolarHBondContact O-CG 3.29Å; F59-L63 PolarHBondContact O-N 2.91Å; F59-L122 HydrophobicContact CE1-CD1 4.24Å; F59-L122 HydrophobicContact CE1-CD2 3.91Å; F59-H177 HydrophobicContact CE2-CB 4.22Å; F59-L178 HydrophobicContact CE1-CD1 4.44Å; F59-L178 HydrophobicContact CZ-CD1 4.3Å; F59-F181 HydrophobicContact CB-CD2 3.75Å; F59-F181 HydrophobicContact CB-CE2 3.77Å; F59-F181 HydrophobicContact CD1-CB 4.27Å; F59-F181 AromaticContact CD1-CD1 3.89Å; F59-F181 HydrophobicContact CD1-CD1 3.89Å; F59-F181 AromaticContact CD1-CD2 3.4Å; F59-F181 HydrophobicContact CD1-CD2 3.4Å; F59-F181 HydrophobicContact CD1-CE1 4.09Å; F59-F181 AromaticContact CD1-CE2 3.6Å; F59-F181 HydrophobicContact CD1-CE2 3.6Å; F59-F181 AromaticContact CD1-CG 3.56Å; F59-F181 HydrophobicContact CD1-CG 3.56Å; F59-F181 AromaticContact CD1-CZ 3.96Å; F59-F181 HydrophobicContact CD1-CZ 3.96Å; F59-F181 HydrophobicContact CD2-CB 4.46Å; F59-F181 HydrophobicContact CD2-CD2 4.16Å; F59-F181 HydrophobicContact CD2-CG 4.44Å; F59-F181 HydrophobicContact CE1-CB 4Å; F59-F181 AromaticContact CE1-CD1 3.78Å; F59-F181 HydrophobicContact CE1-CD1 3.78Å; F59-F181 AromaticContact CE1-CD2 3.98Å; F59-F181 HydrophobicContact CE1-CD2 3.98Å; F59-F181 HydrophobicContact CE1-CE1 4.29Å; F59-F181 HydrophobicContact CE1-CE2 4.45Å; F59-F181 AromaticContact CE1-CG 3.63Å; F59-F181 HydrophobicContact CE1-CG 3.63Å; F59-F181 HydrophobicContact CE2-CB 4.21Å; F59-F181 HydrophobicContact CE2-CG 4.5Å; F59-F181 HydrophobicContact CG-CB 4.5Å; F59-F181 AromaticContact CG-CD2 3.51Å; F59-F181 HydrophobicContact CG-CD2 3.51Å; F59-F181 AromaticContact CG-CE2 3.88Å; F59-F181 HydrophobicContact CG-CE2 3.88Å; F59-F181 HydrophobicContact CG-CG 4Å; F59-F181 HydrophobicContact CZ-CB 3.97Å; F59-F181 HydrophobicContact CZ-CG 4.12Å
60	N	89.9	Confident	90.3	Very high	19 Å²	19	32.5 Å²	32.5	10%	0.102	17%	0.174	C	C	.	.	H	α-helix	trans	-59.4	-43.4	177.3	-77.9	-53.3	0	0	0	112.3	S56 D57 L63 N64 F285	S56-N60 WeakPolarHBondContact O-CB 3.33Å; S56-N60 PolarHBondContact O-N 3.23Å; S56-N60 PolarHBondContact O-ND2 2.8Å; S56-N60 PolarHBondContact OG-ND2 3.07Å; D57-N60 PolarHBondContact O-N 3.31Å; N60-L63 PolarHBondContact O-N 3.12Å; N60-N64 VanDerWaalsContact O-CB 3.24Å; N60-N64 WeakPolarHBondContact O-CB 3.47Å; N60-N64 PolarHBondContact O-N 3.26Å; N60-N64 PolarHBondContact O-ND2 3.41Å; N60-N64 VanDerWaalsContact O-ND2 3.13Å; N60-F285 VanDerWaalsContact OD1-CZ 3.26Å; N60-F285 WeakPolarHBondContact OD1-CZ 3.13Å
61	F	88.3	Confident	90.7	Very high	17 Å²	17	32.9 Å²	32.9	8%	0.075	18%	0.175	C	C	.	.	H	α-helix	trans	-63.2	-48.2	176.2	-179.7	-86.6	0	0	0	111.9	D57 I58 F59 L63 N64 K65 F102 V118	D57-F61 WeakPolarHBondContact O-CB 3.39Å; D57-F61 PolarHBondContact O-N 3.04Å; I58-F61 PolarHBondContact O-N 3.15Å; F59-F61 PolarHBondContact O-N 3.23Å; F61-L63 VanDerWaalsContact C-N 3.28Å; F61-L63 PolarHBondContact O-N 3.41Å; F61-N64 PolarHBondContact O-N 3.29Å; F61-K65 HydrophobicContact CD2-CG 4.26Å; F61-K65 HydrophobicContact CE1-CB 4.13Å; F61-K65 HydrophobicContact CE1-CG 4.23Å; F61-K65 HydrophobicContact CE2-CD 4.43Å; F61-K65 HydrophobicContact CE2-CG 3.79Å; F61-K65 HydrophobicContact CZ-CB 4.16Å; F61-K65 HydrophobicContact CZ-CD 4.36Å; F61-K65 HydrophobicContact CZ-CG 3.78Å; F61-K65 WeakPolarHBondContact O-CB 3.28Å; F61-K65 PolarHBondContact O-N 3.2Å; F61-F102 HydrophobicContact CD1-CE1 4.46Å; F61-F102 AromaticContact CD2-CD1 3.34Å; F61-F102 HydrophobicContact CD2-CD1 3.34Å; F61-F102 AromaticContact CD2-CE1 3.61Å; F61-F102 HydrophobicContact CD2-CE1 3.61Å; F61-F102 HydrophobicContact CD2-CG 4.13Å; F61-F102 HydrophobicContact CE1-CE1 4.23Å; F61-F102 AromaticContact CE2-CD1 3.34Å; F61-F102 HydrophobicContact CE2-CD1 3.34Å; F61-F102 AromaticContact CE2-CE1 3.31Å; F61-F102 HydrophobicContact CE2-CE1 3.31Å; F61-F102 HydrophobicContact CE2-CZ 4.44Å; F61-F102 HydrophobicContact CG-CD1 4.16Å; F61-F102 HydrophobicContact CG-CE1 4.18Å; F61-F102 HydrophobicContact CZ-CD1 4.17Å; F61-F102 AromaticContact CZ-CE1 3.65Å; F61-F102 HydrophobicContact CZ-CE1 3.65Å; F61-V118 HydrophobicContact CD1-CB 3.92Å; F61-V118 HydrophobicContact CD1-CG1 3.83Å; F61-V118 HydrophobicContact CD1-CG2 3.61Å; F61-V118 HydrophobicContact CE1-CB 4.12Å; F61-V118 HydrophobicContact CE1-CG2 3.47Å; F61-V118 VanDerWaalsContact CE1-CG2 3.47Å; F61-V118 HydrophobicContact CG-CG1 4.4Å; F61-V118 HydrophobicContact CG-CG2 4.43Å; F61-V118 HydrophobicContact CZ-CG2 4.18Å
62	L	91.8	Very high	90.9	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-63.2	-35.3	-179.7	-70.3	175.8	0	0	0	111.8	I58 F59 G67 I73 F74 V115 V118 A119 F181	I58-L62 HydrophobicContact CG2-CD1 3.99Å; I58-L62 WeakPolarHBondContact O-CB 3.37Å; I58-L62 VanDerWaalsContact O-CG 3.25Å; I58-L62 WeakPolarHBondContact O-CG 3.28Å; I58-L62 PolarHBondContact O-N 3.09Å; F59-L62 PolarHBondContact O-N 3.46Å; L62-G67 WeakPolarHBondContact O-CA 3.48Å; L62-G67 PolarHBondContact O-N 3.32Å; L62-I73 HydrophobicContact CD2-CD1 4.32Å; L62-F74 HydrophobicContact CD1-CE1 4.15Å; L62-F74 HydrophobicContact CD1-CZ 3.64Å; L62-V115 HydrophobicContact CD2-CG1 3.59Å; L62-V118 HydrophobicContact CD2-CB 4.11Å; L62-V118 HydrophobicContact CD2-CG1 4.27Å; L62-V118 HydrophobicContact CG-CG1 4.22Å; L62-A119 HydrophobicContact CD2-CB 4.43Å; L62-F181 HydrophobicContact CB-CZ 4.05Å; L62-F181 HydrophobicContact CD1-CE1 4.38Å; L62-F181 HydrophobicContact CD1-CZ 3.89Å
63	L	91.4	Very high	91.2	Very high	38 Å²	38	32.4 Å²	32.4	20%	0.199	17%	0.174	C	C	.	.	H	α-helix	trans	-72	-44.1	175.8	-73.3	157.4	0	0	0	111.5	F59 N60 F61 K65 L68 F181 F285	F59-L63 WeakPolarHBondContact O-CB 3.49Å; F59-L63 WeakPolarHBondContact O-CD1 3.34Å; F59-L63 WeakPolarHBondContact O-CG 3.29Å; F59-L63 PolarHBondContact O-N 2.91Å; N60-L63 PolarHBondContact O-N 3.12Å; F61-L63 VanDerWaalsContact C-N 3.28Å; F61-L63 PolarHBondContact O-N 3.41Å; L63-K65 PolarHBondContact O-N 3.47Å; L63-L68 HydrophobicContact CD2-CD1 3.52Å; L63-L68 HydrophobicContact CD2-CD2 3.88Å; L63-L68 HydrophobicContact CD2-CG 3.7Å; L63-F181 HydrophobicContact CD1-CD2 4.12Å; L63-F181 HydrophobicContact CD1-CE2 3.81Å; L63-F181 HydrophobicContact CG-CE2 4.03Å; L63-F285 HydrophobicContact CB-CE1 4.15Å; L63-F285 HydrophobicContact CD1-CD1 4.1Å; L63-F285 HydrophobicContact CD1-CE1 3.36Å; L63-F285 HydrophobicContact CD1-CE2 3.93Å; L63-F285 HydrophobicContact CD1-CZ 3.25Å; L63-F285 HydrophobicContact CG-CE1 4.26Å; L63-F285 HydrophobicContact CG-CZ 4.47Å
64	N	87.1	Confident	91.7	Very high	133 Å²	133	30.8 Å²	30.8	71%	0.711	17%	0.166	S	C	*	.	H	α-helix	trans	-75.5	-21.8	-177.4	-68.2	-24.9	0	0	0	114.9	N60 F61	N60-N64 VanDerWaalsContact O-CB 3.24Å; N60-N64 WeakPolarHBondContact O-CB 3.47Å; N60-N64 PolarHBondContact O-N 3.26Å; N60-N64 PolarHBondContact O-ND2 3.41Å; N60-N64 VanDerWaalsContact O-ND2 3.13Å; F61-N64 PolarHBondContact O-N 3.29Å
65	K	84.4	Confident	92.1	Very high	78 Å²	78	38.8 Å²	38.8	34%	0.339	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	21	-179.4	-73.9	-92.8	-175	173.2	0	113.9	F61 L63 D110 V115	F61-K65 HydrophobicContact CD2-CG 4.26Å; F61-K65 HydrophobicContact CE1-CB 4.13Å; F61-K65 HydrophobicContact CE1-CG 4.23Å; F61-K65 HydrophobicContact CE2-CD 4.43Å; F61-K65 HydrophobicContact CE2-CG 3.79Å; F61-K65 HydrophobicContact CZ-CB 4.16Å; F61-K65 HydrophobicContact CZ-CD 4.36Å; F61-K65 HydrophobicContact CZ-CG 3.78Å; F61-K65 WeakPolarHBondContact O-CB 3.28Å; F61-K65 PolarHBondContact O-N 3.2Å; L63-K65 PolarHBondContact O-N 3.47Å; K65-D110 IonicContact NZ-OD1 3.31Å; K65-D110 PolarHBondContact NZ-OD1 2.93Å; K65-D110 IonicContact NZ-OD2 2.69Å; K65-D110 PolarHBondContact NZ-OD2 3.2Å; K65-V115 HydrophobicContact CB-CG2 4.44Å
66	G	87.2	Confident	92.3	Very high	28 Å²	28	41.7 Å²	41.7	29%	0.289	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	27.7	174.1	0	0	0	0	0	114.7	L68 Q69 S70	G66-L68 VanDerWaalsContact C-N 3.3Å; G66-L68 PolarHBondContact O-N 3.34Å; G66-Q69 PolarHBondContact O-N 3.4Å; G66-Q69 PolarHBondContact O-OE1 2.97Å; G66-S70 PolarHBondContact O-N 3.49Å; G66-S70 PolarHBondContact O-OG 2.85Å
67	G	90.7	Very high	92.4	Very high	2 Å²	2	45.6 Å²	45.6	2%	0.021	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-24.4	179.4	0	0	0	0	0	113.9	L62 Q69 S70 I73	L62-G67 WeakPolarHBondContact O-CA 3.48Å; L62-G67 PolarHBondContact O-N 3.32Å; G67-Q69 VanDerWaalsContact C-N 3.33Å; G67-S70 PolarHBondContact O-N 3.29Å; G67-I73 WeakPolarHBondContact O-CG1 3.15Å
68	L	95.2	Very high	92.7	Very high	13 Å²	13	45.9 Å²	45.9	7%	0.068	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-33.5	173.6	-60.9	-166.7	0	0	0	112.3	L63 G66 V185 Y188 N192	L63-L68 HydrophobicContact CD2-CD1 3.52Å; L63-L68 HydrophobicContact CD2-CD2 3.88Å; L63-L68 HydrophobicContact CD2-CG 3.7Å; G66-L68 VanDerWaalsContact C-N 3.3Å; G66-L68 PolarHBondContact O-N 3.34Å; L68-V185 HydrophobicContact CD2-CB 4.47Å; L68-V185 HydrophobicContact CD2-CG2 3.65Å; L68-Y188 HydrophobicContact CB-CD1 4.37Å; L68-Y188 HydrophobicContact CB-CD2 3.88Å; L68-Y188 HydrophobicContact CB-CE2 4.23Å; L68-Y188 HydrophobicContact CB-CG 3.95Å; L68-Y188 HydrophobicContact CD1-CD2 3.72Å; L68-Y188 HydrophobicContact CD1-CE2 3.41Å; L68-Y188 VanDerWaalsContact CD1-CE2 3.41Å; L68-Y188 HydrophobicContact CG-CD2 4.39Å; L68-Y188 HydrophobicContact CG-CE2 4.47Å; L68-Y188 VanDerWaalsContact O-CB 3.26Å; L68-Y188 WeakPolarHBondContact O-CB 3.48Å; L68-N192 VanDerWaalsContact O-CB 3.26Å; L68-N192 WeakPolarHBondContact O-CB 3.28Å; L68-N192 PolarHBondContact O-ND2 2.87Å
69	Q	95.7	Very high	92.5	Very high	76 Å²	76	49.2 Å²	49.2	36%	0.355	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-12.8	-180	-61.1	83.7	-6.4	0	0	113.1	G66 G67 E71 Y188 E191	G66-Q69 PolarHBondContact O-N 3.4Å; G66-Q69 PolarHBondContact O-OE1 2.97Å; G67-Q69 VanDerWaalsContact C-N 3.33Å; Q69-E71 PolarHBondContact O-N 3.43Å; Q69-Y188 HydrophobicContact CG-CD1 4.21Å; Q69-E191 HydrophobicContact CB-CB 4.49Å; Q69-E191 VanDerWaalsContact CG-OE2 3.26Å; Q69-E191 WeakPolarHBondContact CG-OE2 3.33Å
70	S	95	Very high	92.3	Very high	27 Å²	27	53 Å²	53	19%	0.189	28%	0.283	C	S	.	.	S	Bend	trans	-68.5	116	-171.4	-70.5	0	0	0	0	112.6	G66 G67 G72 I73 N192	G66-S70 PolarHBondContact O-N 3.49Å; G66-S70 PolarHBondContact O-OG 2.85Å; G67-S70 PolarHBondContact O-N 3.29Å; S70-G72 PolarHBondContact O-N 3.04Å; S70-I73 WeakPolarHBondContact O-CB 3.32Å; S70-I73 PolarHBondContact O-N 3.35Å; S70-N192 WeakPolarHBondContact O-CB 3.33Å
71	E	96.5	Very high	92.1	Very high	136 Å²	136	61.9 Å²	61.9	64%	0.636	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	125.9	-177.9	-177.8	170	-166.3	0	0	112.7	Q69 I73 F116 K193	Q69-E71 PolarHBondContact O-N 3.43Å; E71-I73 VanDerWaalsContact C-N 3.34Å; E71-F116 WeakPolarHBondContact O-CE1 3.49Å; E71-K193 HydrophobicContact CG-CG 4.02Å
72	G	95.4	Very high	91.9	Very high	7 Å²	7	61.2 Å²	61.2	7%	0.072	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	25.4	-179.3	0	0	0	0	0	114.1	S70 F74 R75 V76 N192	S70-G72 PolarHBondContact O-N 3.04Å; G72-F74 PolarHBondContact O-N 3.1Å; G72-R75 CarbonylContact O-C 3.54Å; G72-R75 WeakPolarHBondContact O-CB 3.36Å; G72-R75 PolarHBondContact O-N 2.69Å; G72-V76 WeakPolarHBondContact O-CB 3.35Å; G72-V76 WeakPolarHBondContact O-CG2 3.43Å; G72-V76 PolarHBondContact O-N 3.45Å; G72-N192 PolarHBondContact N-O 3.03Å
73	I	97.3	Very high	91.7	Very high	1 Å²	1	61.8 Å²	61.8	1%	0.005	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	138.3	174.7	-169.5	64.7	0	0	0	111.7	L62 G67 S70 E71 R75 V115 F116 A119 V185 N192 M194	L62-I73 HydrophobicContact CD2-CD1 4.32Å; G67-I73 WeakPolarHBondContact O-CG1 3.15Å; S70-I73 WeakPolarHBondContact O-CB 3.32Å; S70-I73 PolarHBondContact O-N 3.35Å; E71-I73 VanDerWaalsContact C-N 3.34Å; I73-R75 PolarHBondContact O-N 3.45Å; I73-V115 HydrophobicContact CD1-CG1 3.59Å; I73-F116 HydrophobicContact CD1-CD1 4.46Å; I73-A119 HydrophobicContact CD1-CB 3.67Å; I73-A119 HydrophobicContact CG1-CB 4.45Å; I73-V185 HydrophobicContact CG2-CG1 3.66Å; I73-N192 HydrophobicContact CG2-CB 4.17Å; I73-M194 HydrophobicContact CG2-CB 4.38Å; I73-M194 HydrophobicContact CG2-CG 3.9Å; I73-M194 WeakPolarHBondContact O-CE 3.49Å; I73-M194 VanDerWaalsContact O-CG 3.3Å; I73-M194 WeakPolarHBondContact O-CG 3.49Å
74	F	98	Very high	91.6	Very high	1 Å²	1	65.3 Å²	65.3	0%	0.004	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	-30.3	-168.6	-55.7	-73.3	0	0	0	117.2	L62 G72 A119 L122 K123 F181 L182 V185 L199 V202 F203	L62-F74 HydrophobicContact CD1-CE1 4.15Å; L62-F74 HydrophobicContact CD1-CZ 3.64Å; G72-F74 PolarHBondContact O-N 3.1Å; F74-A119 HydrophobicContact CD1-CB 3.58Å; F74-A119 WeakPolarHBondContact CD1-O 3.49Å; F74-A119 HydrophobicContact CE1-CB 3.59Å; F74-A119 HydrophobicContact CG-CB 4.25Å; F74-A119 HydrophobicContact CZ-CB 4.27Å; F74-L122 HydrophobicContact CE1-CB 4.25Å; F74-L122 HydrophobicContact CE1-CD2 3.64Å; F74-L122 HydrophobicContact CZ-CD2 3.97Å; F74-K123 HydrophobicContact CD1-CG 4.38Å; F74-K123 WeakPolarHBondContact O-CE 3.21Å; F74-K123 PolarHBondContact O-NZ 2.94Å; F74-F181 AromaticContact CE2-CE1 3.89Å; F74-F181 HydrophobicContact CE2-CE1 3.89Å; F74-F181 AromaticContact CZ-CE1 3.72Å; F74-F181 HydrophobicContact CZ-CE1 3.72Å; F74-F181 HydrophobicContact CZ-CZ 4.41Å; F74-L182 HydrophobicContact CD2-CD2 4.31Å; F74-L182 HydrophobicContact CE2-CD2 4.09Å; F74-V185 HydrophobicContact CE2-CG2 4.16Å; F74-L199 HydrophobicContact CD2-CD2 4.25Å; F74-V202 HydrophobicContact CB-CG1 3.89Å; F74-F203 HydrophobicContact CB-CE2 3.85Å; F74-F203 HydrophobicContact CB-CZ 4.34Å; F74-F203 AromaticContact CD1-CE2 3.87Å; F74-F203 HydrophobicContact CD1-CE2 3.87Å; F74-F203 AromaticContact CD1-CZ 3.5Å; F74-F203 HydrophobicContact CD1-CZ 3.5Å; F74-F203 HydrophobicContact CD2-CE2 4.01Å; F74-F203 HydrophobicContact CD2-CZ 4.26Å; F74-F203 HydrophobicContact CE1-CE2 4.48Å; F74-F203 AromaticContact CE1-CZ 3.81Å; F74-F203 HydrophobicContact CE1-CZ 3.81Å; F74-F203 AromaticContact CG-CE2 3.62Å; F74-F203 HydrophobicContact CG-CE2 3.62Å; F74-F203 AromaticContact CG-CZ 3.77Å; F74-F203 HydrophobicContact CG-CZ 3.77Å; F74-F203 HydrophobicContact CZ-CZ 4.31Å
75	R	97.2	Very high	91.4	Very high	170 Å²	170	59.9 Å²	59.9	64%	0.642	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-42	173.6	176.2	179.8	177.5	-171.6	-0.3	112.1	G72 I73 M194 V202	G72-R75 CarbonylContact O-C 3.54Å; G72-R75 WeakPolarHBondContact O-CB 3.36Å; G72-R75 PolarHBondContact O-N 2.69Å; I73-R75 PolarHBondContact O-N 3.45Å; R75-M194 HydrophobicContact CB-CE 3.79Å; R75-M194 HydrophobicContact CB-SD 3.51Å; R75-M194 VanDerWaalsContact CB-SD 3.51Å; R75-M194 HydrophobicContact CG-SD 4.39Å; R75-V202 HydrophobicContact CB-CG2 4.43Å
76	V	95.6	Very high	91.5	Very high	62 Å²	62	56.4 Å²	56.4	38%	0.376	29%	0.287	S	S	.	.	S	Bend	trans	-73.9	132.5	171.5	175.4	0	0	0	0	108.8	G72 F116	G72-V76 WeakPolarHBondContact O-CB 3.35Å; G72-V76 WeakPolarHBondContact O-CG2 3.43Å; G72-V76 PolarHBondContact O-N 3.45Å; V76-F116 HydrophobicContact CB-CD1 3.63Å; V76-F116 HydrophobicContact CB-CE1 3.91Å; V76-F116 HydrophobicContact CB-CG 4.16Å; V76-F116 HydrophobicContact CG1-CB 4.12Å; V76-F116 HydrophobicContact CG1-CD1 3.73Å; V76-F116 HydrophobicContact CG1-CD2 4.12Å; V76-F116 HydrophobicContact CG1-CE1 4.12Å; V76-F116 HydrophobicContact CG1-CE2 4.48Å; V76-F116 HydrophobicContact CG1-CG 3.72Å; V76-F116 HydrophobicContact CG1-CZ 4.48Å; V76-F116 HydrophobicContact CG2-CE1 4.33Å
77	N	93.7	Very high	91.5	Very high	119 Å²	119	57.5 Å²	57.5	64%	0.636	28%	0.283	S	S	*	.			trans	-92.8	132.5	174.9	-67.2	-48.1	0	0	0	109.9	K123	N77-K123 PolarHBondContact OD1-NZ 2.64Å
78	G	90.5	Very high	91.2	Very high	17 Å²	17	59.1 Å²	59.1	18%	0.175	29%	0.292	C	S	.	.			trans	-73.2	-177.6	175.5	0	0	0	0	0	113.6	S80 F116 S120	G78-S80 PolarHBondContact O-N 3.27Å; G78-F116 PolarHBondContact N-O 3.39Å; G78-S120 PolarHBondContact N-OG 3Å
79	N	87.6	Confident	90.4	Very high	75 Å²	75	59.5 Å²	59.5	40%	0.401	29%	0.294	S	S	.	.			trans	-66.9	106.7	177.9	175.1	10.5	0	0	0	110.6	R81 T82 V83 S117	N79-R81 PolarHBondContact O-N 3.15Å; N79-R81 PolarHBondContact OD1-N 3.26Å; N79-R81 VanDerWaalsContact OD1-N 3.16Å; N79-T82 PolarHBondContact ND2-OG1 2.86Å; N79-T82 WeakPolarHBondContact O-CA 3.44Å; N79-T82 WeakPolarHBondContact O-CB 3.5Å; N79-T82 PolarHBondContact O-N 2.87Å; N79-V83 PolarHBondContact O-N 3.09Å; N79-S117 PolarHBondContact N-OG 3.1Å
80	S	90.8	Very high	89.8	Confident	92 Å²	92	55.9 Å²	55.9	64%	0.643	28%	0.277	S	S	*	.	H	α-helix	trans	-51.7	-26.7	-179.5	56.4	0	0	0	0	115	G78 E84	G78-S80 PolarHBondContact O-N 3.27Å; S80-E84 VanDerWaalsContact O-CB 3.3Å; S80-E84 WeakPolarHBondContact O-CB 3.43Å; S80-E84 PolarHBondContact O-N 3.46Å
81	R	85.5	Confident	89.3	Confident	205 Å²	205	55.2 Å²	55.2	77%	0.774	27%	0.272	S	S	*	.	H	α-helix	trans	-74.9	-36.3	173	-59.1	-174.4	-165.9	146.7	8.3	113.1	N79 M85	N79-R81 PolarHBondContact O-N 3.15Å; N79-R81 PolarHBondContact OD1-N 3.26Å; N79-R81 VanDerWaalsContact OD1-N 3.16Å; R81-M85 VanDerWaalsContact O-CB 3.23Å; R81-M85 WeakPolarHBondContact O-CB 3.47Å; R81-M85 PolarHBondContact O-N 3Å
82	T	83.3	Confident	88.2	Confident	4 Å²	4	53.3 Å²	53.3	3%	0.025	26%	0.263	C	S	.	.	H	α-helix	trans	-67.2	-44.3	172.9	-59.8	0	0	0	0	109.3	N79 E84 M85 L86 L112 V113	N79-T82 PolarHBondContact ND2-OG1 2.86Å; N79-T82 WeakPolarHBondContact O-CA 3.44Å; N79-T82 WeakPolarHBondContact O-CB 3.5Å; N79-T82 PolarHBondContact O-N 2.87Å; T82-E84 PolarHBondContact O-N 3.3Å; T82-M85 HydrophobicContact CG2-CE 4.48Å; T82-M85 WeakPolarHBondContact O-CB 3.3Å; T82-M85 PolarHBondContact O-N 3.01Å; T82-L86 HydrophobicContact CG2-CD1 4.09Å; T82-L86 HydrophobicContact CG2-CG 4.4Å; T82-L86 VanDerWaalsContact O-CG 3.28Å; T82-L86 WeakPolarHBondContact O-CG 3.27Å; T82-L86 PolarHBondContact O-N 3.4Å; T82-L112 WeakPolarHBondContact CG2-O 3.28Å; T82-L112 PolarHBondContact OG1-O 3.25Å; T82-L112 VanDerWaalsContact OG1-O 3.06Å; T82-V113 HydrophobicContact CG2-CB 4.31Å; T82-V113 HydrophobicContact CG2-CG1 4Å; T82-V113 HydrophobicContact CG2-CG2 4.17Å
83	V	88.7	Confident	86.9	Confident	13 Å²	13	55 Å²	55	8%	0.079	27%	0.27	C	S	.	.	H	α-helix	trans	-59.5	-48.6	175.9	-173.7	0	0	0	0	111.6	N79 M85 L86 R87 L121 L124	N79-V83 PolarHBondContact O-N 3.09Å; V83-M85 VanDerWaalsContact C-N 3.34Å; V83-M85 PolarHBondContact O-N 2.85Å; V83-L86 PolarHBondContact O-N 3.09Å; V83-R87 WeakPolarHBondContact O-CB 3.39Å; V83-R87 PolarHBondContact O-N 3.1Å; V83-L121 HydrophobicContact CG1-CB 4.45Å; V83-L121 HydrophobicContact CG1-CD1 4.09Å; V83-L124 HydrophobicContact CG1-CD2 3.71Å
84	E	87.7	Confident	85.2	Confident	113 Å²	113	55.4 Å²	55.4	53%	0.528	27%	0.274	S	S	.	.	H	α-helix	trans	-61.1	-40.2	176.2	-173.3	88.5	-135.3	0	0	112.2	S80 T82 T88	S80-E84 VanDerWaalsContact O-CB 3.3Å; S80-E84 WeakPolarHBondContact O-CB 3.43Å; S80-E84 PolarHBondContact O-N 3.46Å; T82-E84 PolarHBondContact O-N 3.3Å; E84-T88 WeakPolarHBondContact O-CB 3.35Å; E84-T88 PolarHBondContact O-N 3.44Å; E84-T88 PolarHBondContact O-OG1 3.38Å
85	M	84.3	Confident	83.1	Confident	18 Å²	18	56.7 Å²	56.7	9%	0.089	29%	0.288	C	S	.	.	H	α-helix	trans	-63.7	-44.6	175.6	-178.3	-171.6	77.1	0	0	111.5	F20 R81 T82 V83 T88 I89 V113	F20-M85 HydrophobicContact CD1-SD 4.41Å; F20-M85 HydrophobicContact CE1-SD 4.24Å; R81-M85 VanDerWaalsContact O-CB 3.23Å; R81-M85 WeakPolarHBondContact O-CB 3.47Å; R81-M85 PolarHBondContact O-N 3Å; T82-M85 HydrophobicContact CG2-CE 4.48Å; T82-M85 WeakPolarHBondContact O-CB 3.3Å; T82-M85 PolarHBondContact O-N 3.01Å; V83-M85 VanDerWaalsContact C-N 3.34Å; V83-M85 PolarHBondContact O-N 2.85Å; M85-T88 WeakPolarHBondContact O-CB 3.37Å; M85-T88 PolarHBondContact O-N 3.44Å; M85-I89 HydrophobicContact CG-CD1 4.02Å; M85-I89 VanDerWaalsContact O-CG1 3.28Å; M85-I89 WeakPolarHBondContact O-CG1 3.23Å; M85-I89 PolarHBondContact O-N 3.26Å; M85-V113 HydrophobicContact CE-CG2 4.48Å
86	L	84.8	Confident	80.9	Confident	5 Å²	5	56.2 Å²	56.2	3%	0.026	29%	0.287	C	S	.	.	H	α-helix	trans	-64.3	-46.8	176.8	-68.2	171.4	0	0	0	111.3	T82 V83 T88 I89 V90 F102 V113 L121	T82-L86 HydrophobicContact CG2-CD1 4.09Å; T82-L86 HydrophobicContact CG2-CG 4.4Å; T82-L86 VanDerWaalsContact O-CG 3.28Å; T82-L86 WeakPolarHBondContact O-CG 3.27Å; T82-L86 PolarHBondContact O-N 3.4Å; V83-L86 PolarHBondContact O-N 3.09Å; L86-T88 VanDerWaalsContact C-N 3.26Å; L86-T88 PolarHBondContact O-N 2.96Å; L86-I89 PolarHBondContact O-N 3.38Å; L86-I89 VanDerWaalsContact O-N 3.09Å; L86-V90 WeakPolarHBondContact O-CG2 3.26Å; L86-V90 PolarHBondContact O-N 3.05Å; L86-F102 HydrophobicContact CD1-CE2 3.89Å; L86-F102 HydrophobicContact CD1-CZ 3.78Å; L86-F102 HydrophobicContact CD2-CD2 4.33Å; L86-F102 HydrophobicContact CD2-CE2 3.56Å; L86-F102 HydrophobicContact CD2-CZ 3.81Å; L86-F102 HydrophobicContact CG-CE2 4.32Å; L86-F102 HydrophobicContact CG-CZ 4.46Å; L86-V113 HydrophobicContact CD1-CG1 4.01Å; L86-V113 HydrophobicContact CD2-CG1 4.43Å; L86-L121 HydrophobicContact CB-CD1 4.07Å; L86-L121 HydrophobicContact CB-CD2 3.81Å; L86-L121 HydrophobicContact CD1-CD2 4.18Å
87	R	88.5	Confident	79.1	Confident	51 Å²	51	53.7 Å²	53.7	19%	0.192	27%	0.271	C	S	.	.	H	α-helix	trans	-51.1	-47.4	172.1	-171.1	-159.1	-177.5	-66.8	-13.4	111	F36 V83 I89 V90 D91 L121 L124 E128	F36-R87 HydrophobicContact CB-CG 4.16Å; F36-R87 HydrophobicContact CD1-CG 3.86Å; F36-R87 HydrophobicContact CD2-CG 3.86Å; F36-R87 HydrophobicContact CE1-CG 4.2Å; F36-R87 HydrophobicContact CE2-CG 4.22Å; F36-R87 HydrophobicContact CG-CG 3.69Å; F36-R87 HydrophobicContact CZ-CG 4.4Å; F36-R87 PolarHBondContact O-NH2 3.26Å; V83-R87 WeakPolarHBondContact O-CB 3.39Å; V83-R87 PolarHBondContact O-N 3.1Å; R87-I89 PolarHBondContact O-N 2.87Å; R87-V90 PolarHBondContact O-N 3.26Å; R87-D91 IonicContact CZ-OD2 2.94Å; R87-D91 IonicContact NH1-OD2 3.57Å; R87-D91 PolarHBondContact NH1-OD2 2.83Å; R87-D91 IonicContact NH2-OD2 3.64Å; R87-D91 PolarHBondContact O-N 3.32Å; R87-L121 HydrophobicContact CB-CD1 4.25Å; R87-L124 HydrophobicContact CB-CD2 4.29Å; R87-L124 HydrophobicContact CG-CD2 4.24Å; R87-E128 IonicContact CZ-OE2 2.71Å; R87-E128 IonicContact NE-OE1 3.56Å; R87-E128 IonicContact NE-OE2 2.64Å; R87-E128 PolarHBondContact NE-OE2 3.31Å; R87-E128 IonicContact NH2-OE2 3.8Å; R87-E128 PolarHBondContact NH2-OE2 2.93Å
88	T	84.4	Confident	77	Confident	37 Å²	37	53.2 Å²	53.2	23%	0.227	27%	0.265	C	S	.	.	H	α-helix	trans	-62.5	-42.2	178.6	-52.5	0	0	0	0	112	P22 E84 M85 L86 D91 E92	P22-T88 HydrophobicContact CG-CG2 3.98Å; E84-T88 WeakPolarHBondContact O-CB 3.35Å; E84-T88 PolarHBondContact O-N 3.44Å; E84-T88 PolarHBondContact O-OG1 3.38Å; M85-T88 WeakPolarHBondContact O-CB 3.37Å; M85-T88 PolarHBondContact O-N 3.44Å; L86-T88 VanDerWaalsContact C-N 3.26Å; L86-T88 PolarHBondContact O-N 2.96Å; T88-D91 PolarHBondContact O-N 3.21Å; T88-E92 HydrophobicContact CG2-CG 4.28Å; T88-E92 WeakPolarHBondContact O-CB 3.5Å; T88-E92 WeakPolarHBondContact O-CG 3.33Å; T88-E92 PolarHBondContact O-N 3.06Å
89	I	78.3	Confident	74.7	Confident	20 Å²	20	57.8 Å²	57.8	10%	0.103	29%	0.285	C	S	.	.	H	α-helix	trans	-68.2	-39.8	179.3	-62.5	159.9	0	0	0	111	P22 M85 L86 R87 E92 N93 W97 I105	P22-I89 HydrophobicContact CB-CG1 4.39Å; M85-I89 HydrophobicContact CG-CD1 4.02Å; M85-I89 VanDerWaalsContact O-CG1 3.28Å; M85-I89 WeakPolarHBondContact O-CG1 3.23Å; M85-I89 PolarHBondContact O-N 3.26Å; L86-I89 PolarHBondContact O-N 3.38Å; L86-I89 VanDerWaalsContact O-N 3.09Å; R87-I89 PolarHBondContact O-N 2.87Å; I89-E92 PolarHBondContact O-N 2.86Å; I89-N93 WeakPolarHBondContact O-CB 3.37Å; I89-N93 PolarHBondContact O-N 3.4Å; I89-N93 PolarHBondContact O-OD1 3.29Å; I89-W97 HydrophobicContact CG2-CZ3 4Å; I89-I105 HydrophobicContact CG2-CD1 4.4Å
90	V	82.3	Confident	72.7	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64.5	-40.3	176.4	-178.1	0	0	0	0	111.3	T35 F36 V54 L86 R87 G94 W97	T35-V90 HydrophobicContact CG2-CG1 3.74Å; F36-V90 HydrophobicContact CD2-CB 4.28Å; F36-V90 HydrophobicContact CD2-CG1 4.24Å; F36-V90 HydrophobicContact CE2-CB 3.82Å; F36-V90 HydrophobicContact CE2-CG1 3.87Å; F36-V90 HydrophobicContact CE2-CG2 4.13Å; V54-V90 HydrophobicContact CB-CG1 4.21Å; V54-V90 HydrophobicContact CG2-CG1 3.94Å; V54-V90 HydrophobicContact CG2-CG2 4.04Å; L86-V90 WeakPolarHBondContact O-CG2 3.26Å; L86-V90 PolarHBondContact O-N 3.05Å; R87-V90 PolarHBondContact O-N 3.26Å; V90-G94 PolarHBondContact O-N 3.41Å; V90-W97 HydrophobicContact CB-CE3 4.15Å; V90-W97 HydrophobicContact CB-CZ3 4.44Å; V90-W97 HydrophobicContact CG1-CD2 4.48Å; V90-W97 HydrophobicContact CG1-CE3 4.44Å; V90-W97 HydrophobicContact CG2-CD2 4Å; V90-W97 HydrophobicContact CG2-CE3 3.58Å; V90-W97 HydrophobicContact CG2-CH2 3.93Å; V90-W97 HydrophobicContact CG2-CZ2 4.33Å; V90-W97 HydrophobicContact CG2-CZ3 3.54Å
91	D	85	Confident	70.7	Confident	14 Å²	14	54 Å²	54	8%	0.075	26%	0.264	C	S	.	.	H	α-helix	trans	-74.4	-29.1	175.8	-75.2	-18.7	0	0	0	113.4	L34 T35 F36 R87 T88	L34-D91 HydrophobicContact CD2-CB 4.16Å; T35-D91 PolarHBondContact N-OD1 3.16Å; F36-D91 PolarHBondContact N-OD1 2.98Å; R87-D91 IonicContact CZ-OD2 2.94Å; R87-D91 IonicContact NH1-OD2 3.57Å; R87-D91 PolarHBondContact NH1-OD2 2.83Å; R87-D91 IonicContact NH2-OD2 3.64Å; R87-D91 PolarHBondContact O-N 3.32Å; T88-D91 PolarHBondContact O-N 3.21Å
92	E	73.9	Confident	69.1	Low	95 Å²	95	44.9 Å²	44.9	44%	0.444	23%	0.23	S	C	.	.	H	α-helix	trans	-74.6	-30.8	173.6	-78.3	-175.3	-170.2	0	0	112.5	P22 T88 I89	P22-E92 WeakPolarHBondContact CG-OE1 3.4Å; P22-E92 VanDerWaalsContact CG-OE2 3.23Å; P22-E92 WeakPolarHBondContact CG-OE2 3.34Å; T88-E92 HydrophobicContact CG2-CG 4.28Å; T88-E92 WeakPolarHBondContact O-CB 3.5Å; T88-E92 WeakPolarHBondContact O-CG 3.33Å; T88-E92 PolarHBondContact O-N 3.06Å; I89-E92 PolarHBondContact O-N 2.86Å
93	N	67.2	Low	67.4	Low	44 Å²	44	48 Å²	48	24%	0.235	25%	0.253	C	S	.	.	H	α-helix	trans	-87.9	-28.3	176.9	-74.8	31.2	0	0	0	113.3	I89 Y96 E101	I89-N93 WeakPolarHBondContact O-CB 3.37Å; I89-N93 PolarHBondContact O-N 3.4Å; I89-N93 PolarHBondContact O-OD1 3.29Å; N93-Y96 PolarHBondContact O-N 3.19Å; N93-Y96 VanDerWaalsContact O-N 3.11Å; N93-E101 PolarHBondContact ND2-OE2 3.05Å; N93-E101 VanDerWaalsContact ND2-OE2 3.09Å
94	G	62.5	Low	65.2	Low	8 Å²	8	49.5 Å²	49.5	8%	0.082	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	58	-135.9	-179.2	0	0	0	0	0	112.8	V90 Y96 W97	V90-G94 PolarHBondContact O-N 3.41Å; G94-Y96 PolarHBondContact O-N 3.27Å; G94-Y96 VanDerWaalsContact O-N 3.11Å; G94-W97 WeakPolarHBondContact O-CB 3.3Å; G94-W97 PolarHBondContact O-N 2.56Å; G94-W97 VanDerWaalsContact O-N 3.08Å
95	G	52.6	Low	63.4	Low	29 Å²	29	46.6 Å²	46.6	30%	0.299	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-68	1	175	0	0	0	0	0	115.5	W97	G95-W97 VanDerWaalsContact C-N 3.34Å
96	Y	52.5	Low	61.4	Low	159 Å²	159	45.9 Å²	45.9	62%	0.624	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-98.9	22.3	167.5	-61.8	-79.7	0	0	0	112	N93 G94 H98	N93-Y96 PolarHBondContact O-N 3.19Å; N93-Y96 VanDerWaalsContact O-N 3.11Å; G94-Y96 PolarHBondContact O-N 3.27Å; G94-Y96 VanDerWaalsContact O-N 3.11Å; Y96-H98 PolarHBondContact O-CD2 3.04Å; Y96-H98 VanDerWaalsContact O-CD2 3.24Å; Y96-H98 PolarHBondContact O-N 3.17Å
97	W	57.5	Low	59.3	Low	10 Å²	10	47.9 Å²	47.9	4%	0.038	27%	0.269	C	S	.	.			trans	-65.9	112.3	165.8	177.6	-92.4	0	0	0	109.6	D57 I89 V90 G94 G95 F102	D57-W97 VanDerWaalsContact CG-NE1 3.27Å; D57-W97 PolarHBondContact OD2-NE1 3.33Å; I89-W97 HydrophobicContact CG2-CZ3 4Å; V90-W97 HydrophobicContact CB-CE3 4.15Å; V90-W97 HydrophobicContact CB-CZ3 4.44Å; V90-W97 HydrophobicContact CG1-CD2 4.48Å; V90-W97 HydrophobicContact CG1-CE3 4.44Å; V90-W97 HydrophobicContact CG2-CD2 4Å; V90-W97 HydrophobicContact CG2-CE3 3.58Å; V90-W97 HydrophobicContact CG2-CH2 3.93Å; V90-W97 HydrophobicContact CG2-CZ2 4.33Å; V90-W97 HydrophobicContact CG2-CZ3 3.54Å; G94-W97 WeakPolarHBondContact O-CB 3.3Å; G94-W97 PolarHBondContact O-N 2.56Å; G94-W97 VanDerWaalsContact O-N 3.08Å; G95-W97 VanDerWaalsContact C-N 3.34Å; W97-F102 AromaticContact CH2-CD2 3.89Å; W97-F102 HydrophobicContact CH2-CD2 3.89Å; W97-F102 HydrophobicContact CZ2-CB 4.42Å; W97-F102 AromaticContact CZ2-CD2 3.92Å; W97-F102 HydrophobicContact CZ2-CD2 3.92Å
98	H	49.7	Very low	57.1	Low	108 Å²	108	51 Å²	51	50%	0.5	29%	0.29	S	S	.	.			trans	-107.8	127.4	-170.3	-78.4	-57.1	0	0	0	113.4	Y96 G100 E101	Y96-H98 PolarHBondContact O-CD2 3.04Å; Y96-H98 VanDerWaalsContact O-CD2 3.24Å; Y96-H98 PolarHBondContact O-N 3.17Å; H98-G100 PolarHBondContact O-N 3.3Å; H98-E101 HydrophobicContact CB-CG 4.09Å; H98-E101 PolarHBondContact O-N 2.8Å
99	L	42.4	Very low	55.4	Low	114 Å²	114	52 Å²	52	60%	0.597	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	109.4	176	-165.2	150.7	0	0	0	111.2	D57	D57-L99 VanDerWaalsContact OD1-CA 3.28Å; D57-L99 WeakPolarHBondContact OD1-CA 3.48Å; D57-L99 VanDerWaalsContact OD1-CB 3.23Å; D57-L99 WeakPolarHBondContact OD1-CB 3.44Å; D57-L99 WeakPolarHBondContact OD1-CD1 3.49Å; D57-L99 WeakPolarHBondContact OD1-CG 3.46Å; D57-L99 WeakPolarHBondContact OD2-CA 3.19Å
100	G	43.9	Very low	53.9	Low	37 Å²	37	55.7 Å²	55.7	38%	0.381	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.8	-13.6	-178.6	0	0	0	0	0	116.2	H98 F102 S103 S104	H98-G100 PolarHBondContact O-N 3.3Å; G100-F102 PolarHBondContact O-N 3.29Å; G100-S103 PolarHBondContact O-N 3.22Å; G100-S104 PolarHBondContact O-N 3.4Å; G100-S104 VanDerWaalsContact O-N 3.16Å
101	E	49.5	Very low	52.5	Low	50 Å²	50	67.8 Å²	67.8	23%	0.234	36%	0.359	C	S	.	.	H	α-helix	trans	-59	-33.1	169.4	-84.2	-151.7	137.7	0	0	111.1	N93 H98 S103 S104 I105	N93-E101 PolarHBondContact ND2-OE2 3.05Å; N93-E101 VanDerWaalsContact ND2-OE2 3.09Å; H98-E101 HydrophobicContact CB-CG 4.09Å; H98-E101 PolarHBondContact O-N 2.8Å; E101-S103 VanDerWaalsContact C-N 3.26Å; E101-S103 PolarHBondContact O-N 2.62Å; E101-S104 PolarHBondContact O-N 2.83Å; E101-I105 WeakPolarHBondContact O-CG1 3.34Å; E101-I105 PolarHBondContact O-N 2.78Å
102	F	52.2	Low	51.1	Low	14 Å²	14	71.4 Å²	71.4	6%	0.061	38%	0.378	C	S	.	.	H	α-helix	trans	-51.5	-45.1	170.1	-156.9	-68.8	0	0	0	112.1	F61 L86 W97 G100 S104 A106 V113 V118	F61-F102 HydrophobicContact CD1-CE1 4.46Å; F61-F102 AromaticContact CD2-CD1 3.34Å; F61-F102 HydrophobicContact CD2-CD1 3.34Å; F61-F102 AromaticContact CD2-CE1 3.61Å; F61-F102 HydrophobicContact CD2-CE1 3.61Å; F61-F102 HydrophobicContact CD2-CG 4.13Å; F61-F102 HydrophobicContact CE1-CE1 4.23Å; F61-F102 AromaticContact CE2-CD1 3.34Å; F61-F102 HydrophobicContact CE2-CD1 3.34Å; F61-F102 AromaticContact CE2-CE1 3.31Å; F61-F102 HydrophobicContact CE2-CE1 3.31Å; F61-F102 HydrophobicContact CE2-CZ 4.44Å; F61-F102 HydrophobicContact CG-CD1 4.16Å; F61-F102 HydrophobicContact CG-CE1 4.18Å; F61-F102 HydrophobicContact CZ-CD1 4.17Å; F61-F102 AromaticContact CZ-CE1 3.65Å; F61-F102 HydrophobicContact CZ-CE1 3.65Å; L86-F102 HydrophobicContact CD1-CE2 3.89Å; L86-F102 HydrophobicContact CD1-CZ 3.78Å; L86-F102 HydrophobicContact CD2-CD2 4.33Å; L86-F102 HydrophobicContact CD2-CE2 3.56Å; L86-F102 HydrophobicContact CD2-CZ 3.81Å; L86-F102 HydrophobicContact CG-CE2 4.32Å; L86-F102 HydrophobicContact CG-CZ 4.46Å; W97-F102 AromaticContact CH2-CD2 3.89Å; W97-F102 HydrophobicContact CH2-CD2 3.89Å; W97-F102 HydrophobicContact CZ2-CB 4.42Å; W97-F102 AromaticContact CZ2-CD2 3.92Å; W97-F102 HydrophobicContact CZ2-CD2 3.92Å; G100-F102 PolarHBondContact O-N 3.29Å; F102-S104 VanDerWaalsContact C-N 3.34Å; F102-A106 HydrophobicContact CD1-CB 4.23Å; F102-A106 HydrophobicContact CE1-CB 4.26Å; F102-A106 WeakPolarHBondContact O-CA 3.48Å; F102-A106 WeakPolarHBondContact O-CB 3.33Å; F102-A106 PolarHBondContact O-N 2.99Å; F102-V113 HydrophobicContact CE1-CB 4.39Å; F102-V113 HydrophobicContact CE1-CG1 3.46Å; F102-V113 VanDerWaalsContact CE1-CG1 3.46Å; F102-V113 HydrophobicContact CZ-CG1 3.37Å; F102-V118 HydrophobicContact CE1-CG2 3.93Å; F102-V118 HydrophobicContact CE2-CG2 4.08Å; F102-V118 HydrophobicContact CZ-CG2 3.32Å
103	S	46.6	Very low	50.9	Low	70 Å²	70	67.4 Å²	67.4	49%	0.49	36%	0.36	S	S	.	.	H	α-helix	trans	-78.9	-15.7	-179.1	-151.2	0	0	0	0	113.3	G100 E101 G107	G100-S103 PolarHBondContact O-N 3.22Å; E101-S103 VanDerWaalsContact C-N 3.26Å; E101-S103 PolarHBondContact O-N 2.62Å; S103-G107 VanDerWaalsContact O-CA 3.3Å; S103-G107 WeakPolarHBondContact O-CA 3.41Å; S103-G107 PolarHBondContact O-N 3.41Å
104	S	43.8	Very low	51.6	Low	44 Å²	44	67.9 Å²	67.9	31%	0.308	36%	0.363	S	S	.	.	H	α-helix	trans	-84.4	-46.9	171.1	-168.9	0	0	0	0	111.3	G100 E101 F102 G107 D108	G100-S104 PolarHBondContact O-N 3.4Å; G100-S104 VanDerWaalsContact O-N 3.16Å; E101-S104 PolarHBondContact O-N 2.83Å; F102-S104 VanDerWaalsContact C-N 3.34Å; S104-G107 WeakPolarHBondContact O-CA 3.4Å; S104-G107 PolarHBondContact O-N 3.4Å; S104-D108 PolarHBondContact O-N 3.12Å
105	I	49	Very low	52.9	Low	52 Å²	52	68.6 Å²	68.6	27%	0.267	37%	0.365	S	S	.	.	H	α-helix	trans	-64.5	-49.1	175.2	-64.3	170.5	0	0	0	109.8	I89 E101 G107 L109	I89-I105 HydrophobicContact CG2-CD1 4.4Å; E101-I105 WeakPolarHBondContact O-CG1 3.34Å; E101-I105 PolarHBondContact O-N 2.78Å; I105-G107 PolarHBondContact O-N 2.96Å; I105-L109 VanDerWaalsContact O-CB 3.29Å; I105-L109 WeakPolarHBondContact O-CB 3.18Å; I105-L109 PolarHBondContact O-N 3.42Å; I105-L109 VanDerWaalsContact O-N 3.12Å
106	A	42.4	Very low	54.9	Low	3 Å²	3	69.9 Å²	69.9	3%	0.025	36%	0.363	C	S	.	.	H	α-helix	trans	-75.6	1.7	170.6	0	0	0	0	0	113.6	F102 L109 D110 V113	F102-A106 HydrophobicContact CD1-CB 4.23Å; F102-A106 HydrophobicContact CE1-CB 4.26Å; F102-A106 WeakPolarHBondContact O-CA 3.48Å; F102-A106 WeakPolarHBondContact O-CB 3.33Å; F102-A106 PolarHBondContact O-N 2.99Å; A106-L109 CarbonylContact O-C 3.55Å; A106-L109 VanDerWaalsContact O-C 3.26Å; A106-D110 WeakPolarHBondContact O-CA 3.34Å; A106-D110 WeakPolarHBondContact O-CB 3.38Å; A106-D110 PolarHBondContact O-N 3.43Å; A106-V113 HydrophobicContact CB-CB 4.01Å; A106-V113 HydrophobicContact CB-CG2 4.12Å
107	G	40.5	Very low	56.8	Low	46 Å²	46	62.3 Å²	62.3	47%	0.474	33%	0.333	S	S	.	.	H	α-helix	trans	-75.8	-51.9	168.9	0	0	0	0	0	110.9	S103 S104 I105 L109	S103-G107 VanDerWaalsContact O-CA 3.3Å; S103-G107 WeakPolarHBondContact O-CA 3.41Å; S103-G107 PolarHBondContact O-N 3.41Å; S104-G107 WeakPolarHBondContact O-CA 3.4Å; S104-G107 PolarHBondContact O-N 3.4Å; I105-G107 PolarHBondContact O-N 2.96Å; G107-L109 PolarHBondContact O-N 2.94Å
108	D	42.2	Very low	58.4	Low	118 Å²	118	61.8 Å²	61.8	63%	0.631	33%	0.331	S	S	*	.	H	α-helix	trans	-68.3	-23.8	167.8	-82.2	-46.8	0	0	0	112.1	S104	S104-D108 PolarHBondContact O-N 3.12Å
109	L	49.7	Very low	60.6	Low	56 Å²	56	56.7 Å²	56.7	29%	0.293	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	34.7	-177.5	-80.5	58.3	0	0	0	113.7	I105 A106 G107 R111 L112 V113	I105-L109 VanDerWaalsContact O-CB 3.29Å; I105-L109 WeakPolarHBondContact O-CB 3.18Å; I105-L109 PolarHBondContact O-N 3.42Å; I105-L109 VanDerWaalsContact O-N 3.12Å; A106-L109 CarbonylContact O-C 3.55Å; A106-L109 VanDerWaalsContact O-C 3.26Å; G107-L109 PolarHBondContact O-N 2.94Å; L109-R111 PolarHBondContact O-N 3.45Å; L109-L112 HydrophobicContact CB-CB 3.8Å; L109-L112 HydrophobicContact CD2-CB 4.15Å; L109-L112 HydrophobicContact CD2-CD2 3.61Å; L109-L112 HydrophobicContact CG-CB 3.95Å; L109-L112 HydrophobicContact CG-CD2 4.03Å; L109-L112 PolarHBondContact O-N 3.37Å; L109-V113 HydrophobicContact CB-CG2 4.35Å; L109-V113 PolarHBondContact O-N 3.22Å
110	D	47.2	Very low	63.2	Low	98 Å²	98	51.9 Å²	51.9	52%	0.524	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	9.5	-178.5	-138.1	4.1	0	0	0	113.4	K65 A106	K65-D110 IonicContact NZ-OD1 3.31Å; K65-D110 PolarHBondContact NZ-OD1 2.93Å; K65-D110 IonicContact NZ-OD2 2.69Å; K65-D110 PolarHBondContact NZ-OD2 3.2Å; A106-D110 WeakPolarHBondContact O-CA 3.34Å; A106-D110 WeakPolarHBondContact O-CB 3.38Å; A106-D110 PolarHBondContact O-N 3.43Å
111	R	52	Low	65.6	Low	254 Å²	254	50.2 Å²	50.2	96%	0.958	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.6	-1.2	169.9	-68.3	-178.2	170.6	179.7	-2	114.2	L109	L109-R111 PolarHBondContact O-N 3.45Å
112	L	55.1	Low	67.8	Low	91 Å²	91	47.9 Å²	47.9	48%	0.476	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	-18.8	-172.2	-141.6	80.9	0	0	0	114	T82 L109	T82-L112 WeakPolarHBondContact CG2-O 3.28Å; T82-L112 PolarHBondContact OG1-O 3.25Å; T82-L112 VanDerWaalsContact OG1-O 3.06Å; L109-L112 HydrophobicContact CB-CB 3.8Å; L109-L112 HydrophobicContact CD2-CB 4.15Å; L109-L112 HydrophobicContact CD2-CD2 3.61Å; L109-L112 HydrophobicContact CG-CB 3.95Å; L109-L112 HydrophobicContact CG-CD2 4.03Å; L109-L112 PolarHBondContact O-N 3.37Å
113	V	69.8	Low	69.9	Low	11 Å²	11	48.1 Å²	48.1	7%	0.067	26%	0.256	C	S	.	.			trans	-122.9	97.5	-175.9	-165.7	0	0	0	0	110.3	T82 M85 L86 F102 A106 L109 V118	T82-V113 HydrophobicContact CG2-CB 4.31Å; T82-V113 HydrophobicContact CG2-CG1 4Å; T82-V113 HydrophobicContact CG2-CG2 4.17Å; M85-V113 HydrophobicContact CE-CG2 4.48Å; L86-V113 HydrophobicContact CD1-CG1 4.01Å; L86-V113 HydrophobicContact CD2-CG1 4.43Å; F102-V113 HydrophobicContact CE1-CB 4.39Å; F102-V113 HydrophobicContact CE1-CG1 3.46Å; F102-V113 VanDerWaalsContact CE1-CG1 3.46Å; F102-V113 HydrophobicContact CZ-CG1 3.37Å; A106-V113 HydrophobicContact CB-CB 4.01Å; A106-V113 HydrophobicContact CB-CG2 4.12Å; L109-V113 HydrophobicContact CB-CG2 4.35Å; L109-V113 PolarHBondContact O-N 3.22Å; V113-V118 HydrophobicContact CG1-CG2 4.42Å
114	D	81.2	Confident	72.3	Confident	54 Å²	54	45.8 Å²	45.8	29%	0.289	24%	0.238	S	C	.	.			trans	-90.7	155.1	-177.4	62.1	-72.4	0	0	0	113	F116 S117 V118	D114-F116 PolarHBondContact O-N 2.91Å; D114-F116 WeakPolarHBondContact OD2-CA 3.33Å; D114-F116 WeakPolarHBondContact OD2-CB 3.46Å; D114-F116 PolarHBondContact OD2-N 3.04Å; D114-S117 VanDerWaalsContact CG-OG 3.29Å; D114-S117 WeakPolarHBondContact O-CB 3.32Å; D114-S117 PolarHBondContact O-N 3.5Å; D114-S117 WeakPolarHBondContact OD1-CB 3.46Å; D114-S117 PolarHBondContact OD1-OG 3Å; D114-S117 PolarHBondContact OD2-N 2.86Å; D114-S117 PolarHBondContact OD2-OG 3.37Å; D114-V118 PolarHBondContact O-N 2.79Å
115	V	91.1	Very high	74.7	Confident	23 Å²	23	43.8 Å²	43.8	14%	0.139	22%	0.224	C	C	.	.	H	α-helix	trans	-52	-40.8	176.3	179.6	0	0	0	0	111.9	L62 K65 I73 S117 V118 A119	L62-V115 HydrophobicContact CD2-CG1 3.59Å; K65-V115 HydrophobicContact CB-CG2 4.44Å; I73-V115 HydrophobicContact CD1-CG1 3.59Å; V115-S117 VanDerWaalsContact C-N 3.33Å; V115-S117 PolarHBondContact O-N 3.34Å; V115-V118 PolarHBondContact O-N 3.07Å; V115-A119 WeakPolarHBondContact O-CB 3.38Å; V115-A119 PolarHBondContact O-N 2.99Å
116	F	94.4	Very high	77	Confident	55 Å²	55	41.3 Å²	41.3	24%	0.241	21%	0.211	C	C	.	.	H	α-helix	trans	-69.7	-28.7	-179.4	-50	-71.9	0	0	0	112.8	E71 I73 V76 G78 D114 S120	E71-F116 WeakPolarHBondContact O-CE1 3.49Å; I73-F116 HydrophobicContact CD1-CD1 4.46Å; V76-F116 HydrophobicContact CB-CD1 3.63Å; V76-F116 HydrophobicContact CB-CE1 3.91Å; V76-F116 HydrophobicContact CB-CG 4.16Å; V76-F116 HydrophobicContact CG1-CB 4.12Å; V76-F116 HydrophobicContact CG1-CD1 3.73Å; V76-F116 HydrophobicContact CG1-CD2 4.12Å; V76-F116 HydrophobicContact CG1-CE1 4.12Å; V76-F116 HydrophobicContact CG1-CE2 4.48Å; V76-F116 HydrophobicContact CG1-CG 3.72Å; V76-F116 HydrophobicContact CG1-CZ 4.48Å; V76-F116 HydrophobicContact CG2-CE1 4.33Å; G78-F116 PolarHBondContact N-O 3.39Å; D114-F116 PolarHBondContact O-N 2.91Å; D114-F116 WeakPolarHBondContact OD2-CA 3.33Å; D114-F116 WeakPolarHBondContact OD2-CB 3.46Å; D114-F116 PolarHBondContact OD2-N 3.04Å; F116-S120 VanDerWaalsContact O-CB 3.23Å; F116-S120 WeakPolarHBondContact O-CB 3.42Å; F116-S120 PolarHBondContact O-N 2.96Å; F116-S120 PolarHBondContact O-OG 3.28Å
117	S	91.6	Very high	79.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-66.4	-39.5	170.5	-71.2	0	0	0	0	111.5	N79 D114 V115 S120 L121	N79-S117 PolarHBondContact N-OG 3.1Å; D114-S117 VanDerWaalsContact CG-OG 3.29Å; D114-S117 WeakPolarHBondContact O-CB 3.32Å; D114-S117 PolarHBondContact O-N 3.5Å; D114-S117 WeakPolarHBondContact OD1-CB 3.46Å; D114-S117 PolarHBondContact OD1-OG 3Å; D114-S117 PolarHBondContact OD2-N 2.86Å; D114-S117 PolarHBondContact OD2-OG 3.37Å; V115-S117 VanDerWaalsContact C-N 3.33Å; V115-S117 PolarHBondContact O-N 3.34Å; S117-S120 CarbonylContact O-C 3.57Å; S117-S120 PolarHBondContact O-N 3.33Å; S117-L121 WeakPolarHBondContact O-CB 3.41Å; S117-L121 PolarHBondContact O-N 3.1Å
118	V	92.2	Very high	82.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-70.9	-42.6	176.4	-171	0	0	0	0	111.4	I58 F61 L62 F102 V113 D114 V115 S120 L121 L122	I58-V118 HydrophobicContact CB-CG1 4.31Å; I58-V118 HydrophobicContact CG1-CG1 3.97Å; I58-V118 HydrophobicContact CG2-CG1 4.09Å; F61-V118 HydrophobicContact CD1-CB 3.92Å; F61-V118 HydrophobicContact CD1-CG1 3.83Å; F61-V118 HydrophobicContact CD1-CG2 3.61Å; F61-V118 HydrophobicContact CE1-CB 4.12Å; F61-V118 HydrophobicContact CE1-CG2 3.47Å; F61-V118 VanDerWaalsContact CE1-CG2 3.47Å; F61-V118 HydrophobicContact CG-CG1 4.4Å; F61-V118 HydrophobicContact CG-CG2 4.43Å; F61-V118 HydrophobicContact CZ-CG2 4.18Å; L62-V118 HydrophobicContact CD2-CB 4.11Å; L62-V118 HydrophobicContact CD2-CG1 4.27Å; L62-V118 HydrophobicContact CG-CG1 4.22Å; F102-V118 HydrophobicContact CE1-CG2 3.93Å; F102-V118 HydrophobicContact CE2-CG2 4.08Å; F102-V118 HydrophobicContact CZ-CG2 3.32Å; V113-V118 HydrophobicContact CG1-CG2 4.42Å; D114-V118 PolarHBondContact O-N 2.79Å; V115-V118 PolarHBondContact O-N 3.07Å; V118-S120 PolarHBondContact O-N 2.95Å; V118-L121 WeakPolarHBondContact O-CB 3.35Å; V118-L121 PolarHBondContact O-N 3.25Å; V118-L122 PolarHBondContact O-N 3.18Å; V118-L122 VanDerWaalsContact O-N 3.08Å
119	A	95.8	Very high	84.6	Confident	0 Å²	0	43 Å²	43	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.2	-30.7	170.9	0	0	0	0	0	112.8	L62 I73 F74 V115 K123	L62-A119 HydrophobicContact CD2-CB 4.43Å; I73-A119 HydrophobicContact CD1-CB 3.67Å; I73-A119 HydrophobicContact CG1-CB 4.45Å; F74-A119 HydrophobicContact CD1-CB 3.58Å; F74-A119 WeakPolarHBondContact CD1-O 3.49Å; F74-A119 HydrophobicContact CE1-CB 3.59Å; F74-A119 HydrophobicContact CG-CB 4.25Å; F74-A119 HydrophobicContact CZ-CB 4.27Å; V115-A119 WeakPolarHBondContact O-CB 3.38Å; V115-A119 PolarHBondContact O-N 2.99Å; A119-K123 WeakPolarHBondContact O-CG 3.42Å
120	S	95.9	Very high	86.5	Confident	14 Å²	14	43.4 Å²	43.4	10%	0.098	20%	0.202	C	C	.	.	H	α-helix	trans	-78.9	-28.7	174.2	-60	0	0	0	0	113.1	G78 F116 S117 V118 L124	G78-S120 PolarHBondContact N-OG 3Å; F116-S120 VanDerWaalsContact O-CB 3.23Å; F116-S120 WeakPolarHBondContact O-CB 3.42Å; F116-S120 PolarHBondContact O-N 2.96Å; F116-S120 PolarHBondContact O-OG 3.28Å; S117-S120 CarbonylContact O-C 3.57Å; S117-S120 PolarHBondContact O-N 3.33Å; V118-S120 PolarHBondContact O-N 2.95Å; S120-L124 WeakPolarHBondContact O-CB 3.27Å; S120-L124 PolarHBondContact O-N 3.48Å
121	L	94.5	Very high	88.4	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-67.8	-39.3	173.8	-169.3	68.8	0	0	0	111.4	F36 I58 V83 L86 R87 S117 V118 L124 Y125	F36-L121 HydrophobicContact CE1-CD1 4.01Å; F36-L121 HydrophobicContact CE2-CD1 4.37Å; F36-L121 HydrophobicContact CZ-CD1 3.51Å; F36-L121 HydrophobicContact CZ-CG 3.88Å; I58-L121 HydrophobicContact CD1-CB 4.43Å; I58-L121 HydrophobicContact CD1-CD2 4.07Å; I58-L121 HydrophobicContact CD1-CG 4.17Å; I58-L121 HydrophobicContact CG1-CD2 4.48Å; V83-L121 HydrophobicContact CG1-CB 4.45Å; V83-L121 HydrophobicContact CG1-CD1 4.09Å; L86-L121 HydrophobicContact CB-CD1 4.07Å; L86-L121 HydrophobicContact CB-CD2 3.81Å; L86-L121 HydrophobicContact CD1-CD2 4.18Å; R87-L121 HydrophobicContact CB-CD1 4.25Å; S117-L121 WeakPolarHBondContact O-CB 3.41Å; S117-L121 PolarHBondContact O-N 3.1Å; V118-L121 WeakPolarHBondContact O-CB 3.35Å; V118-L121 PolarHBondContact O-N 3.25Å; L121-L124 HydrophobicContact CD1-CD2 4.47Å; L121-L124 WeakPolarHBondContact O-CB 3.47Å; L121-L124 PolarHBondContact O-N 2.79Å; L121-Y125 PolarHBondContact O-N 3.21Å
122	L	96.6	Very high	90.2	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-57.6	-52.5	172.8	-173.9	58.8	0	0	0	111.8	I55 I58 F59 F74 V118 L124 Y125 L126 L178 F203	I55-L122 HydrophobicContact CD1-CD1 3.5Å; I55-L122 HydrophobicContact CG2-CD1 4.48Å; I58-L122 HydrophobicContact CG2-CB 3.95Å; I58-L122 HydrophobicContact CG2-CD1 4.14Å; I58-L122 HydrophobicContact CG2-CD2 4.39Å; I58-L122 HydrophobicContact CG2-CG 4.37Å; F59-L122 HydrophobicContact CE1-CD1 4.24Å; F59-L122 HydrophobicContact CE1-CD2 3.91Å; F74-L122 HydrophobicContact CE1-CB 4.25Å; F74-L122 HydrophobicContact CE1-CD2 3.64Å; F74-L122 HydrophobicContact CZ-CD2 3.97Å; V118-L122 PolarHBondContact O-N 3.18Å; V118-L122 VanDerWaalsContact O-N 3.08Å; L122-L124 PolarHBondContact O-N 3.12Å; L122-Y125 PolarHBondContact O-N 3.33Å; L122-L126 HydrophobicContact CD1-CD1 4.42Å; L122-L126 HydrophobicContact CG-CD1 4.26Å; L122-L126 WeakPolarHBondContact O-CG 3.22Å; L122-L126 PolarHBondContact O-N 3.08Å; L122-L126 VanDerWaalsContact O-N 3.17Å; L122-L178 HydrophobicContact CD2-CD1 4.16Å; L122-F203 HydrophobicContact CD2-CE1 4.15Å; L122-F203 HydrophobicContact CD2-CZ 4.15Å; L122-F203 HydrophobicContact CG-CE1 4.48Å
123	K	97.2	Very high	92.2	Very high	19 Å²	19	29.3 Å²	29.3	8%	0.083	14%	0.144	C	C	.	.	H	α-helix	trans	-61.2	-31.7	177.4	-64.2	-178.3	-59	175	0	111.9	F74 N77 A119 R127 V202 F203 N206	F74-K123 HydrophobicContact CD1-CG 4.38Å; F74-K123 WeakPolarHBondContact O-CE 3.21Å; F74-K123 PolarHBondContact O-NZ 2.94Å; N77-K123 PolarHBondContact OD1-NZ 2.64Å; A119-K123 WeakPolarHBondContact O-CG 3.42Å; K123-R127 VanDerWaalsContact O-CB 3.28Å; K123-R127 WeakPolarHBondContact O-CB 3.46Å; K123-R127 PolarHBondContact O-N 3.42Å; K123-V202 HydrophobicContact CD-CG1 3.76Å; K123-F203 HydrophobicContact CG-CE1 4.36Å; K123-F203 HydrophobicContact CG-CZ 4.32Å; K123-N206 PolarHBondContact O-OD1 3.32Å
124	L	95.4	Very high	93.4	Very high	21 Å²	21	28.8 Å²	28.8	11%	0.11	14%	0.141	C	C	.	.	H	α-helix	trans	-69.4	-45	176.5	-173.3	62.9	0	0	0	111.5	F36 V83 R87 S120 L121 L122 R127 E128	F36-L124 HydrophobicContact CD1-CG 4.35Å; F36-L124 HydrophobicContact CE1-CB 4.29Å; F36-L124 HydrophobicContact CE1-CD2 4.34Å; F36-L124 HydrophobicContact CE1-CG 4.15Å; V83-L124 HydrophobicContact CG1-CD2 3.71Å; R87-L124 HydrophobicContact CB-CD2 4.29Å; R87-L124 HydrophobicContact CG-CD2 4.24Å; S120-L124 WeakPolarHBondContact O-CB 3.27Å; S120-L124 PolarHBondContact O-N 3.48Å; L121-L124 HydrophobicContact CD1-CD2 4.47Å; L121-L124 WeakPolarHBondContact O-CB 3.47Å; L121-L124 PolarHBondContact O-N 2.79Å; L122-L124 PolarHBondContact O-N 3.12Å; L124-R127 PolarHBondContact O-N 3.17Å; L124-E128 HydrophobicContact CD1-CG 4.25Å; L124-E128 WeakPolarHBondContact CD1-OE1 3.48Å; L124-E128 WeakPolarHBondContact O-CB 3.19Å; L124-E128 WeakPolarHBondContact O-CG 3.25Å; L124-E128 PolarHBondContact O-N 2.94Å
125	Y	95.7	Very high	93.9	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.008	14%	0.136	C	C	.	.	H	α-helix	trans	-59.8	-56	179.3	179.7	-88.6	0	0	0	111	T35 F36 P52 V54 I55 L121 L122 R127 E128 L129 L174	T35-Y125 HydrophobicContact CG2-CE2 4.07Å; T35-Y125 VanDerWaalsContact O-CE2 3.27Å; T35-Y125 WeakPolarHBondContact O-CE2 3.27Å; F36-Y125 HydrophobicContact CD1-CD2 4.21Å; F36-Y125 HydrophobicContact CE1-CD2 4.12Å; F36-Y125 HydrophobicContact CE1-CG 4.39Å; F36-Y125 HydrophobicContact CE2-CD2 4.45Å; F36-Y125 HydrophobicContact CG-CD2 4.41Å; F36-Y125 HydrophobicContact CZ-CD2 4.22Å; P52-Y125 WeakPolarHBondContact CG-OH 3.44Å; V54-Y125 HydrophobicContact CG1-CD2 4.15Å; V54-Y125 HydrophobicContact CG1-CE2 3.97Å; I55-Y125 HydrophobicContact CD1-CD1 3.6Å; I55-Y125 HydrophobicContact CD1-CE1 3.99Å; I55-Y125 HydrophobicContact CD1-CG 4.05Å; I55-Y125 HydrophobicContact CG1-CD1 4.28Å; I55-Y125 HydrophobicContact CG1-CE1 4.17Å; L121-Y125 PolarHBondContact O-N 3.21Å; L122-Y125 PolarHBondContact O-N 3.33Å; Y125-R127 PolarHBondContact O-N 2.93Å; Y125-E128 PolarHBondContact O-N 3.37Å; Y125-L129 HydrophobicContact CE1-CD1 4.48Å; Y125-L129 HydrophobicContact CE1-CD2 3.93Å; Y125-L129 HydrophobicContact CE1-CG 4.35Å; Y125-L129 PolarHBondContact O-N 3.46Å; Y125-L174 HydrophobicContact CE1-CD2 4.46Å
126	L	97	Very high	93.8	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-57.2	-37.3	-177.7	-64.3	170.7	0	0	0	112.4	L122 L133 L174 L178 F203 N206	L122-L126 HydrophobicContact CD1-CD1 4.42Å; L122-L126 HydrophobicContact CG-CD1 4.26Å; L122-L126 WeakPolarHBondContact O-CG 3.22Å; L122-L126 PolarHBondContact O-N 3.08Å; L122-L126 VanDerWaalsContact O-N 3.17Å; L126-L133 HydrophobicContact CD2-CD2 4.09Å; L126-L174 HydrophobicContact CD2-CD2 4.43Å; L126-L178 HydrophobicContact CD1-CD1 4.18Å; L126-L178 HydrophobicContact CD1-CD2 3.69Å; L126-L178 HydrophobicContact CD2-CD2 4.31Å; L126-F203 HydrophobicContact CD1-CD1 4.09Å; L126-F203 HydrophobicContact CD1-CE1 3.95Å; L126-N206 CarbonylContact C-O 3.59Å; L126-N206 HydrophobicContact CB-CB 4.47Å; L126-N206 WeakPolarHBondContact CB-O 3.18Å
127	R	94.7	Very high	93.5	Very high	137 Å²	137	33.3 Å²	33.3	52%	0.517	17%	0.167	S	C	.	.	H	α-helix	trans	-79.1	-20.8	178.9	-165.6	-174.3	65.9	-133.4	-1.4	114.1	K123 L124 Y125 N206	K123-R127 VanDerWaalsContact O-CB 3.28Å; K123-R127 WeakPolarHBondContact O-CB 3.46Å; K123-R127 PolarHBondContact O-N 3.42Å; L124-R127 PolarHBondContact O-N 3.17Å; Y125-R127 PolarHBondContact O-N 2.93Å; R127-N206 HydrophobicContact CB-CB 4.39Å
128	E	94.7	Very high	93.6	Very high	60 Å²	60	34.5 Å²	34.5	28%	0.28	17%	0.174	S	C	.	.	H	α-helix	trans	-90.6	-5.1	176.3	-73.8	-174.6	-172.4	0	0	113	G37 R87 L124 Y125	G37-E128 WeakPolarHBondContact CA-O 3.45Å; R87-E128 IonicContact CZ-OE2 2.71Å; R87-E128 IonicContact NE-OE1 3.56Å; R87-E128 IonicContact NE-OE2 2.64Å; R87-E128 PolarHBondContact NE-OE2 3.31Å; R87-E128 IonicContact NH2-OE2 3.8Å; R87-E128 PolarHBondContact NH2-OE2 2.93Å; L124-E128 HydrophobicContact CD1-CG 4.25Å; L124-E128 WeakPolarHBondContact CD1-OE1 3.48Å; L124-E128 WeakPolarHBondContact O-CB 3.19Å; L124-E128 WeakPolarHBondContact O-CG 3.25Å; L124-E128 PolarHBondContact O-N 2.94Å; Y125-E128 PolarHBondContact O-N 3.37Å
129	L	94.1	Very high	93.6	Very high	6 Å²	6	34.7 Å²	34.7	3%	0.031	18%	0.175	C	C	.	.	S	Bend	trans	-56.7	130.4	169.5	-68.7	174.7	0	0	0	111	Y125 E131 G132 L133 R209	Y125-L129 HydrophobicContact CE1-CD1 4.48Å; Y125-L129 HydrophobicContact CE1-CD2 3.93Å; Y125-L129 HydrophobicContact CE1-CG 4.35Å; Y125-L129 PolarHBondContact O-N 3.46Å; L129-E131 VanDerWaalsContact C-N 3.34Å; L129-E131 PolarHBondContact O-N 2.75Å; L129-G132 PolarHBondContact O-N 3.23Å; L129-G132 VanDerWaalsContact O-N 3.11Å; L129-L133 HydrophobicContact CD1-CB 4.19Å; L129-R209 PolarHBondContact O-NH1 3.25Å
130	P	90.6	Very high	93.3	Very high	63 Å²	63	36.6 Å²	36.6	41%	0.409	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-46.4	-174.1	-31.6	35.6	0	0	0	114.5	A38 R209	A38-P130 WeakPolarHBondContact O-CD 3.49Å; P130-R209 PolarHBondContact O-NH1 2.93Å; P130-R209 PolarHBondContact O-NH2 3.24Å
131	E	86.8	Confident	93.1	Very high	137 Å²	137	39.7 Å²	39.7	64%	0.64	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-4.5	-179.4	-55.5	-164.5	172.3	0	0	113.8	L129 R209	L129-E131 VanDerWaalsContact C-N 3.34Å; L129-E131 PolarHBondContact O-N 2.75Å; E131-R209 WeakPolarHBondContact O-CB 3.31Å; E131-R209 WeakPolarHBondContact O-CG 3.44Å
132	G	91	Very high	93.1	Very high	10 Å²	10	39.6 Å²	39.6	10%	0.103	21%	0.206	C	C	.	.			trans	79.8	-180	-160.9	0	0	0	0	0	112.4	L129	L129-G132 PolarHBondContact O-N 3.23Å; L129-G132 VanDerWaalsContact O-N 3.11Å
133	L	95.6	Very high	92.9	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.21	C	C	.	.	S	Bend	trans	-82.7	-35.1	175	179.1	57.4	0	0	0	111.4	L40 L126 L129 N171 L174 L175 L178 V207	L40-L133 HydrophobicContact CD2-CD1 4.13Å; L126-L133 HydrophobicContact CD2-CD2 4.09Å; L129-L133 HydrophobicContact CD1-CB 4.19Å; L133-N171 HydrophobicContact CD1-CB 4.21Å; L133-N171 PolarHBondContact O-ND2 2.83Å; L133-L174 HydrophobicContact CD1-CB 4.11Å; L133-L174 HydrophobicContact CD1-CD2 3.95Å; L133-L174 HydrophobicContact CD1-CG 4.05Å; L133-L174 HydrophobicContact CD2-CG 4.32Å; L133-L175 HydrophobicContact CD2-CB 4.1Å; L133-L175 HydrophobicContact CD2-CD1 3.87Å; L133-L175 HydrophobicContact CG-CB 4.42Å; L133-L175 HydrophobicContact CG-CD1 4.46Å; L133-L178 HydrophobicContact CD2-CD2 3.99Å; L133-V207 HydrophobicContact CB-CG1 4.3Å; L133-V207 HydrophobicContact CD2-CG1 4.31Å; L133-V207 PolarHBondContact N-O 3.46Å; L133-V207 VanDerWaalsContact N-O 3.15Å
134	I	95	Very high	92.6	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-112	119.4	168	-62.4	175.6	0	0	0	107.2	T138 T139 F142 L175 V207 F208 R209 L230	I134-T138 HydrophobicContact CG2-CG2 4.27Å; I134-T139 PolarHBondContact O-OG1 3.03Å; I134-F142 HydrophobicContact CD1-CE2 3.95Å; I134-F142 HydrophobicContact CD1-CZ 4.34Å; I134-F142 HydrophobicContact CG2-CD2 3.8Å; I134-F142 HydrophobicContact CG2-CE2 3.69Å; I134-L175 HydrophobicContact CD1-CD1 4.35Å; I134-L175 HydrophobicContact CD1-CD2 3.85Å; I134-L175 HydrophobicContact CG1-CD2 4.17Å; I134-V207 HydrophobicContact CD1-CG1 3.76Å; I134-V207 HydrophobicContact CG1-CG1 3.96Å; I134-V207 PolarHBondContact N-O 3.32Å; I134-F208 HydrophobicContact CB-CD1 4.08Å; I134-F208 HydrophobicContact CB-CE1 4.43Å; I134-F208 HydrophobicContact CD1-CD1 3.94Å; I134-F208 HydrophobicContact CD1-CD2 4.45Å; I134-F208 HydrophobicContact CD1-CE1 3.49Å; I134-F208 VanDerWaalsContact CD1-CE1 3.49Å; I134-F208 HydrophobicContact CD1-CE2 4.04Å; I134-F208 HydrophobicContact CD1-CG 4.42Å; I134-F208 HydrophobicContact CD1-CZ 3.55Å; I134-F208 HydrophobicContact CG2-CD1 3.9Å; I134-F208 HydrophobicContact CG2-CE1 4.13Å; I134-R209 PolarHBondContact O-N 3.44Å; I134-L230 HydrophobicContact CD1-CD1 4.42Å
135	S	92.2	Very high	92.5	Very high	25 Å²	25	44.6 Å²	44.6	18%	0.175	23%	0.23	C	C	.	.			trans	-59.3	161.9	-176.3	85.1	0	0	0	0	112.4	N137 T138 T139	S135-N137 PolarHBondContact O-N 2.95Å; S135-T138 PolarHBondContact O-N 2.83Å; S135-T138 PolarHBondContact OG-N 3.49Å; S135-T138 VanDerWaalsContact OG-N 3.12Å; S135-T138 PolarHBondContact OG-OG1 3.43Å; S135-T139 WeakPolarHBondContact O-CB 3.41Å; S135-T139 PolarHBondContact O-N 2.98Å; S135-T139 PolarHBondContact O-OG1 3.26Å
136	E	88.8	Confident	92.3	Very high	71 Å²	71	45.1 Å²	45.1	33%	0.332	23%	0.232	S	C	.	.	H	α-helix	trans	-59.3	-45.1	177.5	-169.1	171.4	88.6	0	0	112.2	T139 A140 R209 T211	E136-T139 WeakPolarHBondContact O-CB 3.39Å; E136-T139 PolarHBondContact O-N 2.81Å; E136-A140 PolarHBondContact O-N 3.41Å; E136-R209 HydrophobicContact CB-CB 4.37Å; E136-R209 HydrophobicContact CB-CG 4.22Å; E136-T211 HydrophobicContact CG-CG2 3.75Å; E136-T211 WeakPolarHBondContact OE1-CG2 3.46Å; E136-T211 WeakPolarHBondContact OE2-CA 3.28Å; E136-T211 PolarHBondContact OE2-N 3.01Å
137	N	88.5	Confident	91.9	Very high	132 Å²	132	49.8 Å²	49.8	71%	0.706	27%	0.265	S	S	*	.	H	α-helix	trans	-62.2	-45.3	176.1	-69.2	-33.9	0	0	0	111.9	S135 T139 A140 L141	S135-N137 PolarHBondContact O-N 2.95Å; N137-T139 VanDerWaalsContact C-N 3.33Å; N137-T139 PolarHBondContact O-N 3.25Å; N137-A140 PolarHBondContact O-N 3.25Å; N137-L141 PolarHBondContact O-N 3.13Å
138	T	92.5	Very high	91.7	Very high	24 Å²	24	48.2 Å²	48.2	15%	0.147	26%	0.264	C	S	.	.	H	α-helix	trans	-69.3	-33.4	178.2	-35.6	0	0	0	0	111.5	I134 S135 A140 L141 F142 L163 L167	I134-T138 HydrophobicContact CG2-CG2 4.27Å; S135-T138 PolarHBondContact O-N 2.83Å; S135-T138 PolarHBondContact OG-N 3.49Å; S135-T138 VanDerWaalsContact OG-N 3.12Å; S135-T138 PolarHBondContact OG-OG1 3.43Å; T138-A140 VanDerWaalsContact C-N 3.3Å; T138-A140 PolarHBondContact O-N 2.82Å; T138-L141 WeakPolarHBondContact O-CB 3.47Å; T138-L141 PolarHBondContact O-N 3.25Å; T138-L141 VanDerWaalsContact O-N 3.09Å; T138-F142 HydrophobicContact CG2-CD2 4.04Å; T138-F142 HydrophobicContact CG2-CE2 3.74Å; T138-F142 VanDerWaalsContact O-CD2 3.25Å; T138-F142 WeakPolarHBondContact O-CD2 3.25Å; T138-F142 PolarHBondContact O-N 2.97Å; T138-L163 HydrophobicContact CG2-CD1 3.9Å; T138-L163 HydrophobicContact CG2-CD2 4.43Å; T138-L163 HydrophobicContact CG2-CG 4.18Å; T138-L167 HydrophobicContact CG2-CD2 3.89Å
139	T	92.7	Very high	91.5	Very high	4 Å²	4	47.9 Å²	47.9	3%	0.025	26%	0.26	C	S	.	.	H	α-helix	trans	-60.4	-39.7	176.5	-62.9	0	0	0	0	111.4	I134 S135 E136 N137 L141 F142 L143 F208 R209 I223	I134-T139 PolarHBondContact O-OG1 3.03Å; S135-T139 WeakPolarHBondContact O-CB 3.41Å; S135-T139 PolarHBondContact O-N 2.98Å; S135-T139 PolarHBondContact O-OG1 3.26Å; E136-T139 WeakPolarHBondContact O-CB 3.39Å; E136-T139 PolarHBondContact O-N 2.81Å; N137-T139 VanDerWaalsContact C-N 3.33Å; N137-T139 PolarHBondContact O-N 3.25Å; T139-L141 VanDerWaalsContact C-N 3.35Å; T139-L141 PolarHBondContact O-N 3.43Å; T139-F142 PolarHBondContact O-N 3.24Å; T139-L143 HydrophobicContact CG2-CD1 4.16Å; T139-L143 WeakPolarHBondContact O-CG 3.35Å; T139-L143 PolarHBondContact O-N 2.96Å; T139-F208 HydrophobicContact CG2-CB 4.03Å; T139-F208 HydrophobicContact CG2-CD1 3.92Å; T139-F208 HydrophobicContact CG2-CG 4.45Å; T139-R209 WeakPolarHBondContact CB-O 3.4Å; T139-R209 WeakPolarHBondContact CG2-O 3.46Å; T139-R209 PolarHBondContact OG1-N 3.25Å; T139-R209 PolarHBondContact OG1-O 3.03Å; T139-I223 HydrophobicContact CG2-CD1 3.79Å
140	A	90.1	Very high	91.1	Very high	41 Å²	41	53.4 Å²	53.4	34%	0.339	28%	0.28	S	S	.	.	H	α-helix	trans	-61.9	-39.3	173	0	0	0	0	0	112.7	E136 N137 T138 L143 Q144	E136-A140 PolarHBondContact O-N 3.41Å; N137-A140 PolarHBondContact O-N 3.25Å; T138-A140 VanDerWaalsContact C-N 3.3Å; T138-A140 PolarHBondContact O-N 2.82Å; A140-L143 PolarHBondContact O-N 3.44Å; A140-Q144 PolarHBondContact O-N 3.49Å
141	L	92.2	Very high	91	Very high	78 Å²	78	56.3 Å²	56.3	41%	0.408	30%	0.302	S	S	.	.	H	α-helix	trans	-67.4	-40.2	176	-61.7	175.1	0	0	0	112.3	N137 T138 T139 L143 Q144 I145 L163	N137-L141 PolarHBondContact O-N 3.13Å; T138-L141 WeakPolarHBondContact O-CB 3.47Å; T138-L141 PolarHBondContact O-N 3.25Å; T138-L141 VanDerWaalsContact O-N 3.09Å; T139-L141 VanDerWaalsContact C-N 3.35Å; T139-L141 PolarHBondContact O-N 3.43Å; L141-L143 VanDerWaalsContact C-N 3.3Å; L141-L143 PolarHBondContact O-N 3.34Å; L141-Q144 PolarHBondContact O-N 2.88Å; L141-I145 WeakPolarHBondContact O-CG1 3.05Å; L141-I145 PolarHBondContact O-N 3.43Å; L141-L163 HydrophobicContact CB-CD1 3.96Å; L141-L163 HydrophobicContact CB-CD2 3.71Å; L141-L163 HydrophobicContact CD1-CD1 3.88Å
142	F	94	Very high	91.2	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-60.1	-40.6	172.9	-83.9	-71.9	0	0	0	111.7	I134 T138 T139 H146 L160 L163 V164 F208 I226	I134-F142 HydrophobicContact CD1-CE2 3.95Å; I134-F142 HydrophobicContact CD1-CZ 4.34Å; I134-F142 HydrophobicContact CG2-CD2 3.8Å; I134-F142 HydrophobicContact CG2-CE2 3.69Å; T138-F142 HydrophobicContact CG2-CD2 4.04Å; T138-F142 HydrophobicContact CG2-CE2 3.74Å; T138-F142 VanDerWaalsContact O-CD2 3.25Å; T138-F142 WeakPolarHBondContact O-CD2 3.25Å; T138-F142 PolarHBondContact O-N 2.97Å; T139-F142 PolarHBondContact O-N 3.24Å; F142-H146 WeakPolarHBondContact O-CB 3.45Å; F142-H146 PolarHBondContact O-N 3.02Å; F142-L160 HydrophobicContact CD1-CD2 3.58Å; F142-L160 HydrophobicContact CE1-CD2 3.77Å; F142-L163 HydrophobicContact CB-CD2 4.22Å; F142-L163 HydrophobicContact CD1-CD2 3.7Å; F142-L163 HydrophobicContact CD2-CD2 3.67Å; F142-L163 HydrophobicContact CD2-CG 4.4Å; F142-L163 HydrophobicContact CE1-CD2 3.88Å; F142-L163 HydrophobicContact CE1-CG 4.25Å; F142-L163 HydrophobicContact CE2-CD2 3.85Å; F142-L163 HydrophobicContact CE2-CG 4.08Å; F142-L163 HydrophobicContact CG-CD2 3.58Å; F142-L163 HydrophobicContact CZ-CD2 3.94Å; F142-L163 HydrophobicContact CZ-CG 4Å; F142-V164 HydrophobicContact CE1-CG2 3.96Å; F142-V164 HydrophobicContact CZ-CG2 3.78Å; F142-F208 HydrophobicContact CB-CE1 4.12Å; F142-F208 AromaticContact CD2-CE1 3.81Å; F142-F208 HydrophobicContact CD2-CE1 3.81Å; F142-F208 HydrophobicContact CE2-CE1 4.39Å; F142-F208 AromaticContact CG-CE1 3.91Å; F142-F208 HydrophobicContact CG-CE1 3.91Å; F142-I226 HydrophobicContact CB-CD1 4.36Å; F142-I226 HydrophobicContact CB-CG2 4.43Å; F142-I226 HydrophobicContact CD1-CG2 3.88Å; F142-I226 HydrophobicContact CG-CG2 4.42Å
143	L	92.1	Very high	91	Very high	17 Å²	17	59.5 Å²	59.5	9%	0.089	31%	0.312	C	S	.	.	H	α-helix	trans	-67.7	-40.2	175.8	-74.7	163.3	0	0	0	112.6	T139 A140 L141 H146 S147 E219 I223 I226	T139-L143 HydrophobicContact CG2-CD1 4.16Å; T139-L143 WeakPolarHBondContact O-CG 3.35Å; T139-L143 PolarHBondContact O-N 2.96Å; A140-L143 PolarHBondContact O-N 3.44Å; L141-L143 VanDerWaalsContact C-N 3.3Å; L141-L143 PolarHBondContact O-N 3.34Å; L143-H146 PolarHBondContact O-N 3.11Å; L143-S147 WeakPolarHBondContact O-CB 3.33Å; L143-S147 PolarHBondContact O-N 2.96Å; L143-E219 HydrophobicContact CD1-CB 4.29Å; L143-E219 VanDerWaalsContact CD1-OE2 3.27Å; L143-E219 WeakPolarHBondContact CD1-OE2 3.1Å; L143-E219 HydrophobicContact CD2-CB 3.95Å; L143-I223 HydrophobicContact CD1-CD1 4Å; L143-I223 HydrophobicContact CD2-CD1 3.66Å; L143-I223 HydrophobicContact CD2-CG1 4.06Å; L143-I223 HydrophobicContact CG-CD1 3.68Å; L143-I223 HydrophobicContact CG-CG1 4.5Å; L143-I226 HydrophobicContact CD2-CD1 4.29Å
144	Q	91	Very high	90.6	Very high	105 Å²	105	66 Å²	66	49%	0.491	35%	0.347	S	S	.	.	H	α-helix	trans	-59.6	-53.6	173.7	-176.4	-176.4	-25.5	0	0	110.8	A140 L141 H146 S147 E148	A140-Q144 PolarHBondContact O-N 3.49Å; L141-Q144 PolarHBondContact O-N 2.88Å; Q144-H146 VanDerWaalsContact C-N 3.26Å; Q144-H146 PolarHBondContact O-N 3.2Å; Q144-S147 PolarHBondContact O-N 2.91Å; Q144-S147 PolarHBondContact O-OG 3.1Å; Q144-E148 WeakPolarHBondContact O-CB 3.46Å; Q144-E148 PolarHBondContact O-N 2.91Å
145	I	92.6	Very high	90.5	Very high	23 Å²	23	68.9 Å²	68.9	12%	0.118	36%	0.364	C	S	.	.	H	α-helix	trans	-57.1	-41.3	179	-69.1	170.5	0	0	0	111.1	L141 E148 Y149 Y156 Q159 L160 L163	L141-I145 WeakPolarHBondContact O-CG1 3.05Å; L141-I145 PolarHBondContact O-N 3.43Å; I145-E148 PolarHBondContact O-N 3.3Å; I145-Y149 HydrophobicContact CG2-CD2 4.26Å; I145-Y149 WeakPolarHBondContact O-CB 3.34Å; I145-Y149 PolarHBondContact O-N 2.85Å; I145-Y156 HydrophobicContact CG2-CD2 3.88Å; I145-Y156 HydrophobicContact CG2-CE2 4.16Å; I145-Q159 HydrophobicContact CD1-CB 4.15Å; I145-Q159 HydrophobicContact CG1-CB 4.36Å; I145-Q159 HydrophobicContact CG2-CB 3.75Å; I145-L160 HydrophobicContact CG2-CD2 4.33Å; I145-L163 HydrophobicContact CD1-CB 3.89Å; I145-L163 HydrophobicContact CD1-CD2 3.66Å; I145-L163 HydrophobicContact CD1-CG 4.35Å
146	H	92	Very high	90.6	Very high	14 Å²	14	67.7 Å²	67.7	7%	0.065	36%	0.356	C	S	.	.	H	α-helix	trans	-65.8	-38	174.5	177.6	-89.8	0	0	0	113	F142 L143 Q144 E148 R150 Y156 S222 H225 I226	F142-H146 WeakPolarHBondContact O-CB 3.45Å; F142-H146 PolarHBondContact O-N 3.02Å; L143-H146 PolarHBondContact O-N 3.11Å; Q144-H146 VanDerWaalsContact C-N 3.26Å; Q144-H146 PolarHBondContact O-N 3.2Å; H146-E148 VanDerWaalsContact C-N 3.35Å; H146-R150 PolarHBondContact NE2-NH1 2.95Å; H146-R150 WeakPolarHBondContact O-CB 3.15Å; H146-R150 PolarHBondContact O-N 3.28Å; H146-Y156 HydrophobicContact CB-CE2 4.13Å; H146-S222 VanDerWaalsContact CE1-CB 3.45Å; H146-S222 WeakPolarHBondContact CE1-CB 3.5Å; H146-S222 PolarHBondContact CE1-OG 3.17Å; H146-H225 AromaticContact CD2-CD2 3.97Å; H146-H225 AromaticContact NE2-CD2 3.63Å; H146-I226 HydrophobicContact CB-CD1 3.69Å; H146-I226 HydrophobicContact CB-CG1 3.89Å
147	S	89.1	Confident	90.8	Very high	98 Å²	98	65.8 Å²	65.8	69%	0.685	35%	0.348	S	S	*	.	H	α-helix	trans	-68.5	-33.2	176.6	75.9	0	0	0	0	113.1	L143 Q144	L143-S147 WeakPolarHBondContact O-CB 3.33Å; L143-S147 PolarHBondContact O-N 2.96Å; Q144-S147 PolarHBondContact O-N 2.91Å; Q144-S147 PolarHBondContact O-OG 3.1Å
148	E	91	Very high	90.9	Very high	105 Å²	105	63 Å²	63	49%	0.491	34%	0.336	S	S	.	.	H	α-helix	trans	-91.7	-38.9	-172	-168.4	-179.3	156.1	0	0	112.7	Q144 I145 H146	Q144-E148 WeakPolarHBondContact O-CB 3.46Å; Q144-E148 PolarHBondContact O-N 2.91Å; I145-E148 PolarHBondContact O-N 3.3Å; H146-E148 VanDerWaalsContact C-N 3.35Å
149	Y	90.9	Very high	91	Very high	53 Å²	53	64.8 Å²	64.8	21%	0.208	34%	0.343	C	S	.	.	H	α-helix	trans	-112.3	-6.7	-169	-63.6	-81.4	0	0	0	115.9	I145 S151 K152 V155 Q159	I145-Y149 HydrophobicContact CG2-CD2 4.26Å; I145-Y149 WeakPolarHBondContact O-CB 3.34Å; I145-Y149 PolarHBondContact O-N 2.85Å; Y149-S151 PolarHBondContact O-N 3.45Å; Y149-K152 PolarHBondContact O-N 3.4Å; Y149-V155 HydrophobicContact CD1-CB 4.08Å; Y149-V155 HydrophobicContact CD1-CG1 3.42Å; Y149-V155 VanDerWaalsContact CD1-CG1 3.42Å; Y149-V155 HydrophobicContact CE1-CG1 3.6Å; Y149-V155 HydrophobicContact CG-CG1 4.38Å; Y149-Q159 HydrophobicContact CD2-CG 4.33Å; Y149-Q159 HydrophobicContact CE2-CG 4.33Å
150	R	85.7	Confident	91	Very high	122 Å²	122	64.6 Å²	64.6	46%	0.46	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-23.6	-177.6	169.7	179.4	-174.3	74.8	16	115.7	H146 K152 H225	H146-R150 PolarHBondContact NE2-NH1 2.95Å; H146-R150 WeakPolarHBondContact O-CB 3.15Å; H146-R150 PolarHBondContact O-N 3.28Å; R150-K152 VanDerWaalsContact C-N 3.34Å; R150-H225 PolarHBondContact NH1-CD2 3.48Å; R150-H225 PolarHBondContact NH1-NE2 2.85Å
151	S	87.5	Confident	91.2	Very high	123 Å²	123	65.5 Å²	65.5	86%	0.86	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-3	176.3	-55.7	0	0	0	0	114.8	Y149	Y149-S151 PolarHBondContact O-N 3.45Å
152	K	90.2	Very high	91.2	Very high	137 Å²	137	65.5 Å²	65.5	60%	0.596	34%	0.339	S	S	*	.			trans	-138	83.4	-174.2	-65.6	178	-177.9	172.7	0	110.1	Y149 R150 D154 V155 Y156	Y149-K152 PolarHBondContact O-N 3.4Å; R150-K152 VanDerWaalsContact C-N 3.34Å; K152-D154 VanDerWaalsContact C-N 3.34Å; K152-D154 PolarHBondContact O-N 3.29Å; K152-V155 HydrophobicContact CB-CB 4.32Å; K152-V155 HydrophobicContact CB-CG2 4.34Å; K152-V155 PolarHBondContact O-N 2.87Å; K152-Y156 WeakPolarHBondContact O-CB 3.47Å; K152-Y156 PolarHBondContact O-N 3.38Å
153	Q	87	Confident	91.2	Very high	77 Å²	77	65.9 Å²	65.9	36%	0.36	34%	0.341	S	S	.	.	H	α-helix	trans	-51.5	-47.5	-170.7	-167.3	68.3	3.3	0	0	113	V155 Y156 L157 N229 H233	Q153-V155 PolarHBondContact O-N 2.95Å; Q153-Y156 WeakPolarHBondContact O-CB 3.48Å; Q153-Y156 PolarHBondContact O-N 3.2Å; Q153-L157 HydrophobicContact CG-CD1 4.1Å; Q153-L157 HydrophobicContact CG-CG 4.26Å; Q153-L157 WeakPolarHBondContact O-CG 3.26Å; Q153-L157 PolarHBondContact O-N 3.02Å; Q153-N229 PolarHBondContact NE2-OD1 2.88Å; Q153-H233 PolarHBondContact NE2-NE2 3.26Å
154	D	88.6	Confident	91.3	Very high	136 Å²	136	65 Å²	65	73%	0.727	34%	0.337	S	S	*	.	H	α-helix	trans	-57.9	-49	-177.9	-47.3	-48.8	0	0	0	112.3	K152 L157 T158	K152-D154 VanDerWaalsContact C-N 3.34Å; K152-D154 PolarHBondContact O-N 3.29Å; D154-L157 PolarHBondContact O-N 2.94Å; D154-T158 PolarHBondContact O-N 3.41Å; D154-T158 PolarHBondContact O-OG1 3.15Å
155	V	92.5	Very high	91.4	Very high	61 Å²	61	62 Å²	62	37%	0.37	33%	0.329	S	S	.	.	H	α-helix	trans	-68.8	-39.5	179.8	-171.4	0	0	0	0	110.9	Y149 K152 Q153 T158 Q159	Y149-V155 HydrophobicContact CD1-CB 4.08Å; Y149-V155 HydrophobicContact CD1-CG1 3.42Å; Y149-V155 VanDerWaalsContact CD1-CG1 3.42Å; Y149-V155 HydrophobicContact CE1-CG1 3.6Å; Y149-V155 HydrophobicContact CG-CG1 4.38Å; K152-V155 HydrophobicContact CB-CB 4.32Å; K152-V155 HydrophobicContact CB-CG2 4.34Å; K152-V155 PolarHBondContact O-N 2.87Å; Q153-V155 PolarHBondContact O-N 2.95Å; V155-T158 PolarHBondContact O-N 2.9Å; V155-Q159 HydrophobicContact CG1-CG 4.37Å; V155-Q159 VanDerWaalsContact O-CG 3.31Å; V155-Q159 WeakPolarHBondContact O-CG 3.49Å; V155-Q159 PolarHBondContact O-N 3.41Å
156	Y	93.9	Very high	91.4	Very high	1 Å²	1	67.9 Å²	67.9	0%	0.004	36%	0.356	C	S	.	.	H	α-helix	trans	-59.7	-45.3	175.4	172.3	-114.7	0	0	0	111.5	I145 H146 K152 Q153 Q159 L160 N229	I145-Y156 HydrophobicContact CG2-CD2 3.88Å; I145-Y156 HydrophobicContact CG2-CE2 4.16Å; H146-Y156 HydrophobicContact CB-CE2 4.13Å; K152-Y156 WeakPolarHBondContact O-CB 3.47Å; K152-Y156 PolarHBondContact O-N 3.38Å; Q153-Y156 WeakPolarHBondContact O-CB 3.48Å; Q153-Y156 PolarHBondContact O-N 3.2Å; Y156-Q159 PolarHBondContact O-N 2.81Å; Y156-L160 HydrophobicContact CD1-CD1 4.26Å; Y156-L160 HydrophobicContact CD2-CG 4.39Å; Y156-L160 HydrophobicContact CE1-CD1 3.72Å; Y156-L160 HydrophobicContact CE1-CG 4.49Å; Y156-L160 HydrophobicContact CE2-CD1 4.08Å; Y156-L160 HydrophobicContact CE2-CD2 4.19Å; Y156-L160 HydrophobicContact CE2-CG 4.08Å; Y156-L160 WeakPolarHBondContact O-CG 3.29Å; Y156-L160 PolarHBondContact O-N 2.95Å; Y156-N229 HydrophobicContact CE1-CB 4.31Å
157	L	92.5	Very high	91.4	Very high	31 Å²	31	67.8 Å²	67.8	16%	0.162	36%	0.356	C	S	.	.	H	α-helix	trans	-66.1	-41.9	177	-64.7	-176.3	0	0	0	112.3	Q153 D154 Q159 L160 E161 H233 L237	Q153-L157 HydrophobicContact CG-CD1 4.1Å; Q153-L157 HydrophobicContact CG-CG 4.26Å; Q153-L157 WeakPolarHBondContact O-CG 3.26Å; Q153-L157 PolarHBondContact O-N 3.02Å; D154-L157 PolarHBondContact O-N 2.94Å; L157-Q159 VanDerWaalsContact C-N 3.34Å; L157-Q159 PolarHBondContact O-N 3.41Å; L157-L160 HydrophobicContact CD2-CD1 4.27Å; L157-L160 PolarHBondContact O-N 3.4Å; L157-E161 WeakPolarHBondContact O-CB 3.25Å; L157-E161 PolarHBondContact O-N 2.85Å; L157-H233 WeakPolarHBondContact CD2-CD2 3.36Å; L157-L237 HydrophobicContact CB-CD2 4.38Å; L157-L237 WeakPolarHBondContact O-CD2 3.24Å
158	T	91.7	Very high	91.7	Very high	73 Å²	73	66.5 Å²	66.5	45%	0.448	35%	0.345	S	S	.	.	H	α-helix	trans	-61.8	-39.7	173.7	-57.6	0	0	0	0	112.2	D154 V155 E161 N162	D154-T158 PolarHBondContact O-N 3.41Å; D154-T158 PolarHBondContact O-OG1 3.15Å; V155-T158 PolarHBondContact O-N 2.9Å; T158-E161 PolarHBondContact O-N 3.34Å; T158-N162 WeakPolarHBondContact O-CB 3.18Å; T158-N162 PolarHBondContact O-N 3.09Å; T158-N162 PolarHBondContact O-ND2 3.06Å
159	Q	93.1	Very high	91.7	Very high	62 Å²	62	65.2 Å²	65.2	29%	0.29	34%	0.344	S	S	.	.	H	α-helix	trans	-72.2	-32.3	176.7	-63.3	-62.9	13.3	0	0	112.7	I145 Y149 V155 Y156 L157 N162 L163	I145-Q159 HydrophobicContact CD1-CB 4.15Å; I145-Q159 HydrophobicContact CG1-CB 4.36Å; I145-Q159 HydrophobicContact CG2-CB 3.75Å; Y149-Q159 HydrophobicContact CD2-CG 4.33Å; Y149-Q159 HydrophobicContact CE2-CG 4.33Å; V155-Q159 HydrophobicContact CG1-CG 4.37Å; V155-Q159 VanDerWaalsContact O-CG 3.31Å; V155-Q159 WeakPolarHBondContact O-CG 3.49Å; V155-Q159 PolarHBondContact O-N 3.41Å; Y156-Q159 PolarHBondContact O-N 2.81Å; L157-Q159 VanDerWaalsContact C-N 3.34Å; L157-Q159 PolarHBondContact O-N 3.41Å; Q159-N162 PolarHBondContact OE1-ND2 3.39Å; Q159-N162 VanDerWaalsContact OE1-ND2 3.1Å; Q159-L163 WeakPolarHBondContact O-CB 3.05Å; Q159-L163 PolarHBondContact O-N 3.03Å
160	L	94.3	Very high	91.9	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-64	-44.7	168.3	-72.1	-176.5	0	0	0	111.7	F142 I145 Y156 L157 N162 L163 V164 I226 N229 L237	F142-L160 HydrophobicContact CD1-CD2 3.58Å; F142-L160 HydrophobicContact CE1-CD2 3.77Å; I145-L160 HydrophobicContact CG2-CD2 4.33Å; Y156-L160 HydrophobicContact CD1-CD1 4.26Å; Y156-L160 HydrophobicContact CD2-CG 4.39Å; Y156-L160 HydrophobicContact CE1-CD1 3.72Å; Y156-L160 HydrophobicContact CE1-CG 4.49Å; Y156-L160 HydrophobicContact CE2-CD1 4.08Å; Y156-L160 HydrophobicContact CE2-CD2 4.19Å; Y156-L160 HydrophobicContact CE2-CG 4.08Å; Y156-L160 WeakPolarHBondContact O-CG 3.29Å; Y156-L160 PolarHBondContact O-N 2.95Å; L157-L160 HydrophobicContact CD2-CD1 4.27Å; L157-L160 PolarHBondContact O-N 3.4Å; L160-N162 PolarHBondContact O-N 3.13Å; L160-L163 PolarHBondContact O-N 3.14Å; L160-V164 VanDerWaalsContact O-CB 3.27Å; L160-V164 WeakPolarHBondContact O-CB 3.35Å; L160-V164 WeakPolarHBondContact O-CG2 3.23Å; L160-V164 PolarHBondContact O-N 2.55Å; L160-I226 HydrophobicContact CD2-CG2 4.4Å; L160-N229 HydrophobicContact CD1-CB 4.28Å; L160-L237 HydrophobicContact CB-CD1 4.42Å; L160-L237 HydrophobicContact CB-CD2 4.18Å; L160-L237 HydrophobicContact CD1-CD1 4.4Å
161	E	93.7	Very high	92.3	Very high	60 Å²	60	59 Å²	59	28%	0.28	33%	0.325	S	S	.	.	H	α-helix	trans	-58.5	-47.3	176.8	-169.4	171.9	-172.2	0	0	110.4	L157 T158 L163 V164 A165 L237	L157-E161 WeakPolarHBondContact O-CB 3.25Å; L157-E161 PolarHBondContact O-N 2.85Å; T158-E161 PolarHBondContact O-N 3.34Å; E161-L163 PolarHBondContact O-N 3.14Å; E161-V164 PolarHBondContact O-N 3.35Å; E161-A165 VanDerWaalsContact O-CB 3.32Å; E161-A165 WeakPolarHBondContact O-CB 3.49Å; E161-A165 PolarHBondContact O-N 2.79Å; E161-L237 HydrophobicContact CB-CD2 3.9Å
162	N	92.4	Very high	92.7	Very high	77 Å²	77	53.3 Å²	53.3	41%	0.412	29%	0.285	S	S	.	.	H	α-helix	trans	-58.6	-42.9	174.9	-70.9	-25.4	0	0	0	113.2	T158 Q159 L160 Q166	T158-N162 WeakPolarHBondContact O-CB 3.18Å; T158-N162 PolarHBondContact O-N 3.09Å; T158-N162 PolarHBondContact O-ND2 3.06Å; Q159-N162 PolarHBondContact OE1-ND2 3.39Å; Q159-N162 VanDerWaalsContact OE1-ND2 3.1Å; L160-N162 PolarHBondContact O-N 3.13Å; N162-Q166 WeakPolarHBondContact O-CG 3.31Å; N162-Q166 PolarHBondContact O-NE2 3.16Å
163	L	93.7	Very high	93	Very high	8 Å²	8	47.6 Å²	47.6	4%	0.042	26%	0.262	C	S	.	.	H	α-helix	trans	-76	-38	-179.1	-177.8	61.1	0	0	0	112.3	T138 L141 F142 I145 Q159 L160 E161 A165 Q166	T138-L163 HydrophobicContact CG2-CD1 3.9Å; T138-L163 HydrophobicContact CG2-CD2 4.43Å; T138-L163 HydrophobicContact CG2-CG 4.18Å; L141-L163 HydrophobicContact CB-CD1 3.96Å; L141-L163 HydrophobicContact CB-CD2 3.71Å; L141-L163 HydrophobicContact CD1-CD1 3.88Å; F142-L163 HydrophobicContact CB-CD2 4.22Å; F142-L163 HydrophobicContact CD1-CD2 3.7Å; F142-L163 HydrophobicContact CD2-CD2 3.67Å; F142-L163 HydrophobicContact CD2-CG 4.4Å; F142-L163 HydrophobicContact CE1-CD2 3.88Å; F142-L163 HydrophobicContact CE1-CG 4.25Å; F142-L163 HydrophobicContact CE2-CD2 3.85Å; F142-L163 HydrophobicContact CE2-CG 4.08Å; F142-L163 HydrophobicContact CG-CD2 3.58Å; F142-L163 HydrophobicContact CZ-CD2 3.94Å; F142-L163 HydrophobicContact CZ-CG 4Å; I145-L163 HydrophobicContact CD1-CB 3.89Å; I145-L163 HydrophobicContact CD1-CD2 3.66Å; I145-L163 HydrophobicContact CD1-CG 4.35Å; Q159-L163 WeakPolarHBondContact O-CB 3.05Å; Q159-L163 PolarHBondContact O-N 3.03Å; L160-L163 PolarHBondContact O-N 3.14Å; E161-L163 PolarHBondContact O-N 3.14Å; L163-A165 VanDerWaalsContact C-N 3.31Å; L163-A165 PolarHBondContact O-N 3.06Å; L163-Q166 PolarHBondContact O-N 3.5Å; L163-Q166 VanDerWaalsContact O-N 3.13Å
164	V	94.3	Very high	93.4	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.9	-39.3	174.6	167.1	0	0	0	0	110.5	F142 L160 E161 Q166 L167 Y172 L230 F238	F142-V164 HydrophobicContact CE1-CG2 3.96Å; F142-V164 HydrophobicContact CZ-CG2 3.78Å; L160-V164 VanDerWaalsContact O-CB 3.27Å; L160-V164 WeakPolarHBondContact O-CB 3.35Å; L160-V164 WeakPolarHBondContact O-CG2 3.23Å; L160-V164 PolarHBondContact O-N 2.55Å; E161-V164 PolarHBondContact O-N 3.35Å; V164-Q166 PolarHBondContact O-N 2.77Å; V164-L167 WeakPolarHBondContact O-CB 3.38Å; V164-L167 PolarHBondContact O-N 2.75Å; V164-Y172 HydrophobicContact CG1-CD2 3.76Å; V164-Y172 HydrophobicContact CG1-CE2 3.77Å; V164-Y172 WeakPolarHBondContact O-CD2 3.45Å; V164-L230 HydrophobicContact CG2-CD2 3.83Å; V164-F238 HydrophobicContact CG1-CD1 3.71Å; V164-F238 HydrophobicContact CG1-CE1 3.35Å; V164-F238 HydrophobicContact CG1-CG 4.45Å; V164-F238 HydrophobicContact CG1-CZ 3.81Å
165	A	92	Very high	93.8	Very high	40 Å²	40	37.6 Å²	37.6	33%	0.331	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-13.5	174.9	0	0	0	0	0	114.5	E161 L163 M240	E161-A165 VanDerWaalsContact O-CB 3.32Å; E161-A165 WeakPolarHBondContact O-CB 3.49Å; E161-A165 PolarHBondContact O-N 2.79Å; L163-A165 VanDerWaalsContact C-N 3.31Å; L163-A165 PolarHBondContact O-N 3.06Å; A165-M240 HydrophobicContact CB-CE 3.96Å; A165-M240 HydrophobicContact CB-SD 4.17Å
166	Q	92.3	Very high	94	Very high	147 Å²	147	37.1 Å²	37.1	69%	0.687	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-1.4	174.7	-73.3	167.9	79.7	0	0	113.6	N162 L163 V164	N162-Q166 WeakPolarHBondContact O-CG 3.31Å; N162-Q166 PolarHBondContact O-NE2 3.16Å; L163-Q166 PolarHBondContact O-N 3.5Å; L163-Q166 VanDerWaalsContact O-N 3.13Å; V164-Q166 PolarHBondContact O-N 2.77Å
167	L	93.7	Very high	94.1	Very high	12 Å²	12	40 Å²	40	6%	0.063	22%	0.216	C	C	.	.	S	Bend	trans	-67.6	150.3	173.2	-72.1	168.8	0	0	0	111.1	T138 V164 L175	T138-L167 HydrophobicContact CG2-CD2 3.89Å; V164-L167 WeakPolarHBondContact O-CB 3.38Å; V164-L167 PolarHBondContact O-N 2.75Å; L167-L175 HydrophobicContact CD1-CD2 3.65Å
168	P	93.8	Very high	94.4	Very high	71 Å²	71	38.5 Å²	38.5	46%	0.461	21%	0.209	S	C	.	.			trans	-55.6	145	169.9	-19.7	30.1	0	0	0	110.9	V170 N171 Y172	P168-V170 VanDerWaalsContact C-N 3.27Å; P168-V170 PolarHBondContact O-N 3.18Å; P168-V170 VanDerWaalsContact O-N 3.15Å; P168-N171 WeakPolarHBondContact CB-OD1 3.07Å; P168-N171 PolarHBondContact O-N 3.14Å; P168-Y172 PolarHBondContact O-N 2.98Å
169	V	92.6	Very high	94.7	Very high	78 Å²	78	35 Å²	35	47%	0.473	19%	0.188	S	C	.	.	H	α-helix	trans	-57.6	-37.8	-167.1	179.6	0	0	0	0	112.8	T173 A242	V169-T173 VanDerWaalsContact O-CB 3.3Å; V169-T173 WeakPolarHBondContact O-CB 3.46Å; V169-T173 PolarHBondContact O-N 3.39Å; V169-T173 PolarHBondContact O-OG1 2.99Å; V169-A242 HydrophobicContact CG1-CB 3.88Å
170	V	93.6	Very high	94.8	Very high	30 Å²	30	34.8 Å²	34.8	18%	0.182	19%	0.187	C	C	.	.	H	α-helix	trans	-70.3	-41.2	177.7	-62.3	0	0	0	0	112.3	L40 E41 I44 P168 T173 L174	L40-V170 HydrophobicContact CB-CG2 4.36Å; L40-V170 HydrophobicContact CD2-CB 4.07Å; L40-V170 HydrophobicContact CD2-CG2 3.96Å; L40-V170 HydrophobicContact CG-CB 4.07Å; L40-V170 HydrophobicContact CG-CG2 3.95Å; E41-V170 HydrophobicContact CG-CG2 4.06Å; E41-V170 WeakPolarHBondContact OE1-CG2 3.48Å; I44-V170 HydrophobicContact CB-CG1 4.25Å; I44-V170 HydrophobicContact CG1-CB 4.29Å; I44-V170 HydrophobicContact CG1-CG1 4.08Å; I44-V170 HydrophobicContact CG2-CG1 3.92Å; P168-V170 VanDerWaalsContact C-N 3.27Å; P168-V170 PolarHBondContact O-N 3.18Å; P168-V170 VanDerWaalsContact O-N 3.15Å; V170-T173 PolarHBondContact O-N 2.97Å; V170-L174 WeakPolarHBondContact O-CB 3.4Å; V170-L174 PolarHBondContact O-N 3.05Å
171	N	95.5	Very high	94.9	Very high	14 Å²	14	35.3 Å²	35.3	8%	0.075	19%	0.189	C	C	.	.	H	α-helix	trans	-64.3	-46.1	174.5	-57.6	65.1	0	0	0	111.3	E41 L133 P168 T173 L175	E41-N171 PolarHBondContact OE1-OD1 3.28Å; L133-N171 HydrophobicContact CD1-CB 4.21Å; L133-N171 PolarHBondContact O-ND2 2.83Å; P168-N171 WeakPolarHBondContact CB-OD1 3.07Å; P168-N171 PolarHBondContact O-N 3.14Å; N171-T173 VanDerWaalsContact C-N 3.32Å; N171-T173 PolarHBondContact O-N 2.91Å; N171-L175 WeakPolarHBondContact O-CB 3.2Å; N171-L175 PolarHBondContact O-N 3.41Å
172	Y	95.8	Very high	95.2	Very high	4 Å²	4	32.4 Å²	32.4	2%	0.016	18%	0.175	C	C	.	.	H	α-helix	trans	-56.2	-47.1	175.1	171.3	-97	0	0	0	111.2	V164 P168 L175 K176 F238 M240 A242	V164-Y172 HydrophobicContact CG1-CD2 3.76Å; V164-Y172 HydrophobicContact CG1-CE2 3.77Å; V164-Y172 WeakPolarHBondContact O-CD2 3.45Å; P168-Y172 PolarHBondContact O-N 2.98Å; Y172-L175 PolarHBondContact O-N 3.44Å; Y172-K176 HydrophobicContact CE1-CD 4.49Å; Y172-K176 VanDerWaalsContact O-CB 3.31Å; Y172-K176 WeakPolarHBondContact O-CB 3.27Å; Y172-K176 PolarHBondContact O-N 2.78Å; Y172-F238 AromaticContact CD2-CD1 3.98Å; Y172-F238 HydrophobicContact CD2-CD1 3.98Å; Y172-F238 HydrophobicContact CD2-CE1 4.3Å; Y172-F238 HydrophobicContact CE2-CB 4.47Å; Y172-F238 AromaticContact CE2-CD1 3.57Å; Y172-F238 HydrophobicContact CE2-CD1 3.57Å; Y172-F238 HydrophobicContact CE2-CE1 4.29Å; Y172-F238 HydrophobicContact CE2-CG 4.41Å; Y172-F238 WeakPolarHBondContact OH-CA 3.38Å; Y172-F238 PolarHBondContact OH-O 3.06Å; Y172-M240 WeakPolarHBondContact CE1-O 3.48Å; Y172-M240 HydrophobicContact CE2-CE 4.41Å; Y172-M240 WeakPolarHBondContact OH-CB 3.28Å; Y172-M240 PolarHBondContact OH-N 2.81Å; Y172-M240 PolarHBondContact OH-O 2.83Å; Y172-A242 HydrophobicContact CD1-CB 4.44Å; Y172-A242 HydrophobicContact CE1-CB 4.45Å
173	T	95.2	Very high	95.4	Very high	18 Å²	18	31.4 Å²	31.4	11%	0.11	17%	0.168	C	C	.	.	H	α-helix	trans	-68	-47.7	-176.9	-56.2	0	0	0	0	111.4	E50 I51 V169 V170 N171 L175 K176 H177	E50-T173 HydrophobicContact CB-CG2 4.13Å; E50-T173 WeakPolarHBondContact O-CG2 3.12Å; I51-T173 HydrophobicContact CG2-CG2 4.19Å; V169-T173 VanDerWaalsContact O-CB 3.3Å; V169-T173 WeakPolarHBondContact O-CB 3.46Å; V169-T173 PolarHBondContact O-N 3.39Å; V169-T173 PolarHBondContact O-OG1 2.99Å; V170-T173 PolarHBondContact O-N 2.97Å; N171-T173 VanDerWaalsContact C-N 3.32Å; N171-T173 PolarHBondContact O-N 2.91Å; T173-L175 PolarHBondContact O-N 2.99Å; T173-K176 WeakPolarHBondContact O-CB 3.38Å; T173-K176 PolarHBondContact O-N 2.94Å; T173-H177 PolarHBondContact O-CD2 3.02Å; T173-H177 PolarHBondContact O-N 2.89Å; T173-H177 VanDerWaalsContact O-N 3.08Å
174	L	96.5	Very high	95.5	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-63.9	-39.2	175.3	178.3	56.3	0	0	0	112.2	L40 I51 I55 Y125 L126 L133 V170 L178	L40-L174 HydrophobicContact CD1-CD2 3.65Å; L40-L174 HydrophobicContact CD2-CB 4.16Å; L40-L174 HydrophobicContact CD2-CD2 3.87Å; L40-L174 HydrophobicContact CG-CD2 4.45Å; I51-L174 HydrophobicContact CB-CD1 4.4Å; I51-L174 HydrophobicContact CG2-CB 4.36Å; I51-L174 HydrophobicContact CG2-CD1 4.22Å; I55-L174 HydrophobicContact CB-CD1 4.39Å; I55-L174 HydrophobicContact CG1-CD1 4.15Å; I55-L174 HydrophobicContact CG2-CD1 3.86Å; Y125-L174 HydrophobicContact CE1-CD2 4.46Å; L126-L174 HydrophobicContact CD2-CD2 4.43Å; L133-L174 HydrophobicContact CD1-CB 4.11Å; L133-L174 HydrophobicContact CD1-CD2 3.95Å; L133-L174 HydrophobicContact CD1-CG 4.05Å; L133-L174 HydrophobicContact CD2-CG 4.32Å; V170-L174 WeakPolarHBondContact O-CB 3.4Å; V170-L174 PolarHBondContact O-N 3.05Å; L174-L178 VanDerWaalsContact O-CB 3.26Å; L174-L178 WeakPolarHBondContact O-CB 3.45Å; L174-L178 PolarHBondContact O-N 3.17Å
175	L	97.2	Very high	95.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.4	-41.2	176.4	-174.9	66.6	0	0	0	111.8	L133 I134 L167 N171 Y172 T173 L178 C179 V207 F238	L133-L175 HydrophobicContact CD2-CB 4.1Å; L133-L175 HydrophobicContact CD2-CD1 3.87Å; L133-L175 HydrophobicContact CG-CB 4.42Å; L133-L175 HydrophobicContact CG-CD1 4.46Å; I134-L175 HydrophobicContact CD1-CD1 4.35Å; I134-L175 HydrophobicContact CD1-CD2 3.85Å; I134-L175 HydrophobicContact CG1-CD2 4.17Å; L167-L175 HydrophobicContact CD1-CD2 3.65Å; N171-L175 WeakPolarHBondContact O-CB 3.2Å; N171-L175 PolarHBondContact O-N 3.41Å; Y172-L175 PolarHBondContact O-N 3.44Å; T173-L175 PolarHBondContact O-N 2.99Å; L175-L178 PolarHBondContact O-N 3.34Å; L175-C179 WeakPolarHBondContact O-CB 3.25Å; L175-C179 PolarHBondContact O-N 3.34Å; L175-C179 PolarHBondContact O-SG 3.02Å; L175-V207 HydrophobicContact CD1-CG1 3.85Å; L175-F238 HydrophobicContact CB-CE1 4.17Å; L175-F238 HydrophobicContact CB-CZ 4.48Å; L175-F238 HydrophobicContact CD2-CE1 3.92Å; L175-F238 HydrophobicContact CD2-CZ 3.8Å; L175-F238 HydrophobicContact CG-CE1 3.88Å; L175-F238 HydrophobicContact CG-CZ 3.73Å
176	K	96.3	Very high	95.9	Very high	51 Å²	51	34.9 Å²	34.9	22%	0.222	17%	0.174	C	C	.	.	H	α-helix	trans	-55.7	-56.5	173.1	176.2	174.5	-177.4	157.3	0	111.3	Y172 T173 L178 C179 Q180 F238	Y172-K176 HydrophobicContact CE1-CD 4.49Å; Y172-K176 VanDerWaalsContact O-CB 3.31Å; Y172-K176 WeakPolarHBondContact O-CB 3.27Å; Y172-K176 PolarHBondContact O-N 2.78Å; T173-K176 WeakPolarHBondContact O-CB 3.38Å; T173-K176 PolarHBondContact O-N 2.94Å; K176-L178 VanDerWaalsContact C-N 3.3Å; K176-L178 PolarHBondContact O-N 2.86Å; K176-C179 PolarHBondContact O-N 3.01Å; K176-Q180 WeakPolarHBondContact O-CB 3.42Å; K176-Q180 WeakPolarHBondContact O-CG 3.37Å; K176-Q180 PolarHBondContact O-N 3.47Å; K176-F238 HydrophobicContact CB-CB 4.06Å; K176-F238 HydrophobicContact CB-CD1 3.55Å; K176-F238 HydrophobicContact CB-CE1 4.18Å; K176-F238 HydrophobicContact CB-CG 3.93Å; K176-F238 HydrophobicContact CD-CB 3.88Å; K176-F238 WeakPolarHBondContact CE-O 3.5Å; K176-F238 HydrophobicContact CG-CB 3.69Å; K176-F238 HydrophobicContact CG-CD1 4.17Å; K176-F238 HydrophobicContact CG-CG 4.06Å; K176-F238 PolarHBondContact NZ-O 3.27Å
177	H	96.4	Very high	96.1	Very high	61 Å²	61	32.4 Å²	32.4	28%	0.282	17%	0.169	S	C	.	.	H	α-helix	trans	-62.3	-37.4	-179.5	-76.3	-74.3	0	0	0	112.2	I51 F59 T173 F181	I51-H177 HydrophobicContact CD1-CB 4.34Å; I51-H177 HydrophobicContact CG2-CB 4.28Å; I51-H177 VanDerWaalsContact CG2-CD2 3.47Å; I51-H177 WeakPolarHBondContact CG2-CD2 3.33Å; F59-H177 HydrophobicContact CE2-CB 4.22Å; T173-H177 PolarHBondContact O-CD2 3.02Å; T173-H177 PolarHBondContact O-N 2.89Å; T173-H177 VanDerWaalsContact O-N 3.08Å; H177-F181 VanDerWaalsContact O-CB 3.24Å; H177-F181 WeakPolarHBondContact O-CB 3.22Å; H177-F181 PolarHBondContact O-N 2.9Å
178	L	97.9	Very high	96.2	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-63.9	-50.1	174.5	-179.9	63.8	0	0	0	111.9	F59 L122 L126 L133 L174 L175 K176 F181 L182 F203 V207	F59-L178 HydrophobicContact CE1-CD1 4.44Å; F59-L178 HydrophobicContact CZ-CD1 4.3Å; L122-L178 HydrophobicContact CD2-CD1 4.16Å; L126-L178 HydrophobicContact CD1-CD1 4.18Å; L126-L178 HydrophobicContact CD1-CD2 3.69Å; L126-L178 HydrophobicContact CD2-CD2 4.31Å; L133-L178 HydrophobicContact CD2-CD2 3.99Å; L174-L178 VanDerWaalsContact O-CB 3.26Å; L174-L178 WeakPolarHBondContact O-CB 3.45Å; L174-L178 PolarHBondContact O-N 3.17Å; L175-L178 PolarHBondContact O-N 3.34Å; K176-L178 VanDerWaalsContact C-N 3.3Å; K176-L178 PolarHBondContact O-N 2.86Å; L178-F181 PolarHBondContact O-N 3.31Å; L178-L182 HydrophobicContact CD1-CD1 3.96Å; L178-L182 HydrophobicContact CD1-CG 4.18Å; L178-L182 HydrophobicContact CG-CD1 4Å; L178-L182 WeakPolarHBondContact O-CB 3.47Å; L178-L182 VanDerWaalsContact O-CG 3.27Å; L178-L182 WeakPolarHBondContact O-CG 3.37Å; L178-L182 PolarHBondContact O-N 3.39Å; L178-F203 HydrophobicContact CD1-CD1 4.39Å; L178-F203 HydrophobicContact CD1-CE1 4.03Å; L178-F203 HydrophobicContact CD2-CD1 4.44Å; L178-V207 HydrophobicContact CD2-CG2 3.78Å
179	C	98	Very high	96.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.4	-43.2	-179.6	-71.3	0	0	0	0	111.8	L175 K176 L182 H183 L230 F238	L175-C179 WeakPolarHBondContact O-CB 3.25Å; L175-C179 PolarHBondContact O-N 3.34Å; L175-C179 PolarHBondContact O-SG 3.02Å; K176-C179 PolarHBondContact O-N 3.01Å; C179-L182 PolarHBondContact O-N 2.87Å; C179-H183 WeakPolarHBondContact O-CB 3.32Å; C179-H183 PolarHBondContact O-N 3.33Å; C179-L230 WeakPolarHBondContact CB-O 3.27Å; C179-F238 HydrophobicContact CB-CE2 4.13Å
180	Q	96	Very high	96.5	Very high	57 Å²	57	37.1 Å²	37.1	27%	0.266	19%	0.186	S	C	.	.	H	α-helix	trans	-65.7	-37.7	175.7	-69.2	-174.2	-51.6	0	0	112.6	K176 H183 R184 D235	K176-Q180 WeakPolarHBondContact O-CB 3.42Å; K176-Q180 WeakPolarHBondContact O-CG 3.37Å; K176-Q180 PolarHBondContact O-N 3.47Å; Q180-H183 PolarHBondContact O-N 2.93Å; Q180-R184 WeakPolarHBondContact O-CG 3.23Å; Q180-R184 PolarHBondContact O-N 2.71Å; Q180-R184 VanDerWaalsContact O-N 3.11Å; Q180-D235 PolarHBondContact NE2-OD1 3.11Å
181	F	97.1	Very high	96.7	Very high	10 Å²	10	40.3 Å²	40.3	4%	0.044	20%	0.199	C	C	.	.	H	α-helix	trans	-63.6	-44.5	172.3	177	-84.8	0	0	0	111.5	F59 L62 L63 F74 H177 L178 R184 V185	F59-F181 HydrophobicContact CB-CD2 3.75Å; F59-F181 HydrophobicContact CB-CE2 3.77Å; F59-F181 HydrophobicContact CD1-CB 4.27Å; F59-F181 AromaticContact CD1-CD1 3.89Å; F59-F181 HydrophobicContact CD1-CD1 3.89Å; F59-F181 AromaticContact CD1-CD2 3.4Å; F59-F181 HydrophobicContact CD1-CD2 3.4Å; F59-F181 HydrophobicContact CD1-CE1 4.09Å; F59-F181 AromaticContact CD1-CE2 3.6Å; F59-F181 HydrophobicContact CD1-CE2 3.6Å; F59-F181 AromaticContact CD1-CG 3.56Å; F59-F181 HydrophobicContact CD1-CG 3.56Å; F59-F181 AromaticContact CD1-CZ 3.96Å; F59-F181 HydrophobicContact CD1-CZ 3.96Å; F59-F181 HydrophobicContact CD2-CB 4.46Å; F59-F181 HydrophobicContact CD2-CD2 4.16Å; F59-F181 HydrophobicContact CD2-CG 4.44Å; F59-F181 HydrophobicContact CE1-CB 4Å; F59-F181 AromaticContact CE1-CD1 3.78Å; F59-F181 HydrophobicContact CE1-CD1 3.78Å; F59-F181 AromaticContact CE1-CD2 3.98Å; F59-F181 HydrophobicContact CE1-CD2 3.98Å; F59-F181 HydrophobicContact CE1-CE1 4.29Å; F59-F181 HydrophobicContact CE1-CE2 4.45Å; F59-F181 AromaticContact CE1-CG 3.63Å; F59-F181 HydrophobicContact CE1-CG 3.63Å; F59-F181 HydrophobicContact CE2-CB 4.21Å; F59-F181 HydrophobicContact CE2-CG 4.5Å; F59-F181 HydrophobicContact CG-CB 4.5Å; F59-F181 AromaticContact CG-CD2 3.51Å; F59-F181 HydrophobicContact CG-CD2 3.51Å; F59-F181 AromaticContact CG-CE2 3.88Å; F59-F181 HydrophobicContact CG-CE2 3.88Å; F59-F181 HydrophobicContact CG-CG 4Å; F59-F181 HydrophobicContact CZ-CB 3.97Å; F59-F181 HydrophobicContact CZ-CG 4.12Å; L62-F181 HydrophobicContact CB-CZ 4.05Å; L62-F181 HydrophobicContact CD1-CE1 4.38Å; L62-F181 HydrophobicContact CD1-CZ 3.89Å; L63-F181 HydrophobicContact CD1-CD2 4.12Å; L63-F181 HydrophobicContact CD1-CE2 3.81Å; L63-F181 HydrophobicContact CG-CE2 4.03Å; F74-F181 AromaticContact CE2-CE1 3.89Å; F74-F181 HydrophobicContact CE2-CE1 3.89Å; F74-F181 AromaticContact CZ-CE1 3.72Å; F74-F181 HydrophobicContact CZ-CE1 3.72Å; F74-F181 HydrophobicContact CZ-CZ 4.41Å; H177-F181 VanDerWaalsContact O-CB 3.24Å; H177-F181 WeakPolarHBondContact O-CB 3.22Å; H177-F181 PolarHBondContact O-N 2.9Å; L178-F181 PolarHBondContact O-N 3.31Å; F181-R184 WeakPolarHBondContact O-CB 3.34Å; F181-R184 PolarHBondContact O-N 3.03Å; F181-V185 HydrophobicContact CD1-CG2 4.11Å; F181-V185 HydrophobicContact CE1-CG2 3.64Å; F181-V185 HydrophobicContact CZ-CG2 4.16Å; F181-V185 WeakPolarHBondContact O-CG2 3.47Å; F181-V185 PolarHBondContact O-N 2.89Å
182	L	98.1	Very high	96.7	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-69.8	-31.5	178.6	-66.2	176.5	0	0	0	112.7	F74 L178 C179 V185 S186 L199 F203 M227 I231	F74-L182 HydrophobicContact CD2-CD2 4.31Å; F74-L182 HydrophobicContact CE2-CD2 4.09Å; L178-L182 HydrophobicContact CD1-CD1 3.96Å; L178-L182 HydrophobicContact CD1-CG 4.18Å; L178-L182 HydrophobicContact CG-CD1 4Å; L178-L182 WeakPolarHBondContact O-CB 3.47Å; L178-L182 VanDerWaalsContact O-CG 3.27Å; L178-L182 WeakPolarHBondContact O-CG 3.37Å; L178-L182 PolarHBondContact O-N 3.39Å; C179-L182 PolarHBondContact O-N 2.87Å; L182-V185 WeakPolarHBondContact O-CB 3.34Å; L182-V185 PolarHBondContact O-N 3.38Å; L182-S186 PolarHBondContact O-N 3.23Å; L182-L199 HydrophobicContact CB-CD1 4.45Å; L182-L199 HydrophobicContact CD2-CD2 4.34Å; L182-L199 WeakPolarHBondContact O-CD1 3.36Å; L182-F203 HydrophobicContact CD1-CB 4.25Å; L182-F203 HydrophobicContact CD1-CD1 3.92Å; L182-F203 HydrophobicContact CD1-CD2 3.63Å; L182-F203 HydrophobicContact CD1-CE1 4.15Å; L182-F203 HydrophobicContact CD1-CE2 3.88Å; L182-F203 HydrophobicContact CD1-CG 3.64Å; L182-F203 HydrophobicContact CD1-CZ 4.13Å; L182-F203 HydrophobicContact CD2-CD2 3.97Å; L182-F203 HydrophobicContact CD2-CE1 4.41Å; L182-F203 HydrophobicContact CD2-CE2 3.4Å; L182-F203 VanDerWaalsContact CD2-CE2 3.4Å; L182-F203 HydrophobicContact CD2-CZ 3.66Å; L182-F203 HydrophobicContact CG-CD2 4.48Å; L182-F203 HydrophobicContact CG-CE2 4.31Å; L182-F203 HydrophobicContact CG-CZ 4.49Å; L182-M227 HydrophobicContact CD1-CE 4.35Å; L182-I231 HydrophobicContact CB-CD1 4.03Å; L182-I231 HydrophobicContact CB-CG1 4.04Å; L182-I231 HydrophobicContact CB-CG2 4.08Å; L182-I231 HydrophobicContact CD1-CD1 3.86Å; L182-I231 HydrophobicContact CD1-CG1 4.28Å
183	H	97.2	Very high	96.8	Very high	56 Å²	56	44.6 Å²	44.6	26%	0.259	22%	0.217	S	C	.	.	H	α-helix	trans	-60.2	-49.4	170.6	-169.2	100.4	0	0	0	110	C179 Q180 V185 S186 V187 I231 E232	C179-H183 WeakPolarHBondContact O-CB 3.32Å; C179-H183 PolarHBondContact O-N 3.33Å; Q180-H183 PolarHBondContact O-N 2.93Å; H183-V185 VanDerWaalsContact C-N 3.28Å; H183-V185 PolarHBondContact O-N 2.92Å; H183-S186 WeakPolarHBondContact O-CB 3.32Å; H183-S186 PolarHBondContact O-N 3.32Å; H183-S186 PolarHBondContact O-OG 2.91Å; H183-V187 PolarHBondContact O-N 2.94Å; H183-V187 VanDerWaalsContact O-N 3.14Å; H183-I231 HydrophobicContact CB-CG2 4.31Å; H183-I231 PolarHBondContact ND1-O 2.78Å; H183-E232 PolarHBondContact CE1-O 2.81Å
184	R	96.4	Very high	96.9	Very high	108 Å²	108	43.8 Å²	43.8	41%	0.408	21%	0.212	S	C	.	.	H	α-helix	trans	-57.4	-36.9	173.8	-69	172.6	178.5	-170.5	-2	112.7	Q180 F181 V187 Y188 F285	Q180-R184 WeakPolarHBondContact O-CG 3.23Å; Q180-R184 PolarHBondContact O-N 2.71Å; Q180-R184 VanDerWaalsContact O-N 3.11Å; F181-R184 WeakPolarHBondContact O-CB 3.34Å; F181-R184 PolarHBondContact O-N 3.03Å; R184-V187 PolarHBondContact O-N 3.09Å; R184-Y188 WeakPolarHBondContact O-CD2 3.42Å; R184-F285 VanDerWaalsContact NH1-CB 3.31Å; R184-F285 VanDerWaalsContact NH1-CD2 3.33Å; R184-F285 VanDerWaalsContact NH1-CG 3.34Å
185	V	97.3	Very high	96.9	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-63.7	-41.5	172.8	175.3	0	0	0	0	111.5	L68 I73 F74 F181 L182 H183 V187 Y188 N192 L199	L68-V185 HydrophobicContact CD2-CB 4.47Å; L68-V185 HydrophobicContact CD2-CG2 3.65Å; I73-V185 HydrophobicContact CG2-CG1 3.66Å; F74-V185 HydrophobicContact CE2-CG2 4.16Å; F181-V185 HydrophobicContact CD1-CG2 4.11Å; F181-V185 HydrophobicContact CE1-CG2 3.64Å; F181-V185 HydrophobicContact CZ-CG2 4.16Å; F181-V185 WeakPolarHBondContact O-CG2 3.47Å; F181-V185 PolarHBondContact O-N 2.89Å; L182-V185 WeakPolarHBondContact O-CB 3.34Å; L182-V185 PolarHBondContact O-N 3.38Å; H183-V185 VanDerWaalsContact C-N 3.28Å; H183-V185 PolarHBondContact O-N 2.92Å; V185-V187 VanDerWaalsContact C-N 3.32Å; V185-V187 PolarHBondContact O-N 2.93Å; V185-Y188 PolarHBondContact O-N 2.77Å; V185-Y188 VanDerWaalsContact O-N 3.17Å; V185-N192 PolarHBondContact O-ND2 3.41Å; V185-L199 HydrophobicContact CB-CD1 4.22Å; V185-L199 HydrophobicContact CG1-CD1 4.08Å; V185-L199 HydrophobicContact CG1-CD2 4.18Å
186	S	97	Very high	97	Very high	11 Å²	11	45.9 Å²	45.9	8%	0.077	22%	0.224	C	C	.	.	H	α-helix	trans	-66.4	-29.2	179.6	76.7	0	0	0	0	113.7	L182 H183 Y188 Q189	L182-S186 PolarHBondContact O-N 3.23Å; H183-S186 WeakPolarHBondContact O-CB 3.32Å; H183-S186 PolarHBondContact O-N 3.32Å; H183-S186 PolarHBondContact O-OG 2.91Å; S186-Y188 PolarHBondContact O-N 3.15Å; S186-Q189 WeakPolarHBondContact O-CB 3.44Å; S186-Q189 PolarHBondContact O-N 2.9Å
187	V	96.1	Very high	97	Very high	96 Å²	96	49.4 Å²	49.4	58%	0.582	24%	0.241	S	C	*	.	H	α-helix	trans	-58.9	-30.5	173.6	175.5	0	0	0	0	111.8	H183 R184 V185 Q189	H183-V187 PolarHBondContact O-N 2.94Å; H183-V187 VanDerWaalsContact O-N 3.14Å; R184-V187 PolarHBondContact O-N 3.09Å; V185-V187 VanDerWaalsContact C-N 3.32Å; V185-V187 PolarHBondContact O-N 2.93Å; V187-Q189 VanDerWaalsContact C-N 3.33Å; V187-Q189 PolarHBondContact O-N 3.26Å
188	Y	96.7	Very high	97	Very high	79 Å²	79	48.1 Å²	48.1	31%	0.31	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	16.1	176.6	-69.4	-98.2	0	0	0	113.7	L68 Q69 R184 V185 S186 S190 E191 N192	L68-Y188 HydrophobicContact CB-CD1 4.37Å; L68-Y188 HydrophobicContact CB-CD2 3.88Å; L68-Y188 HydrophobicContact CB-CE2 4.23Å; L68-Y188 HydrophobicContact CB-CG 3.95Å; L68-Y188 HydrophobicContact CD1-CD2 3.72Å; L68-Y188 HydrophobicContact CD1-CE2 3.41Å; L68-Y188 VanDerWaalsContact CD1-CE2 3.41Å; L68-Y188 HydrophobicContact CG-CD2 4.39Å; L68-Y188 HydrophobicContact CG-CE2 4.47Å; L68-Y188 VanDerWaalsContact O-CB 3.26Å; L68-Y188 WeakPolarHBondContact O-CB 3.48Å; Q69-Y188 HydrophobicContact CG-CD1 4.21Å; R184-Y188 WeakPolarHBondContact O-CD2 3.42Å; V185-Y188 PolarHBondContact O-N 2.77Å; V185-Y188 VanDerWaalsContact O-N 3.17Å; S186-Y188 PolarHBondContact O-N 3.15Å; Y188-S190 PolarHBondContact O-N 2.88Å; Y188-E191 PolarHBondContact O-N 3.19Å; Y188-N192 PolarHBondContact O-N 2.96Å; Y188-N192 PolarHBondContact O-ND2 2.94Å; Y188-N192 PolarHBondContact O-OD1 3.3Å
189	Q	96.7	Very high	97	Very high	92 Å²	92	48.1 Å²	48.1	43%	0.43	24%	0.239	S	C	.	.	H	α-helix	trans	-51.5	-31.8	177.6	175.8	-178.3	-18.8	0	0	113.5	S186 V187 E191 N192 K193 S195	S186-Q189 WeakPolarHBondContact O-CB 3.44Å; S186-Q189 PolarHBondContact O-N 2.9Å; V187-Q189 VanDerWaalsContact C-N 3.33Å; V187-Q189 PolarHBondContact O-N 3.26Å; Q189-E191 VanDerWaalsContact C-N 3.26Å; Q189-E191 PolarHBondContact O-N 3.09Å; Q189-N192 VanDerWaalsContact CA-OD1 3.32Å; Q189-N192 WeakPolarHBondContact CA-OD1 3.49Å; Q189-K193 VanDerWaalsContact O-CA 3.28Å; Q189-K193 WeakPolarHBondContact O-CA 3.39Å; Q189-K193 PolarHBondContact O-N 2.83Å; Q189-S195 VanDerWaalsContact CD-CB 3.41Å; Q189-S195 VanDerWaalsContact OE1-CA 3.24Å; Q189-S195 VanDerWaalsContact OE1-CB 3.25Å
190	S	96.5	Very high	97	Very high	89 Å²	89	48.1 Å²	48.1	62%	0.622	24%	0.239	S	C	*	.	H	α-helix	trans	-56.5	-38.3	175.3	53.1	0	0	0	0	112.7	Y188 K193	Y188-S190 PolarHBondContact O-N 2.88Å; S190-K193 PolarHBondContact O-NZ 2.8Å
191	E	96.3	Very high	97	Very high	96 Å²	96	50.1 Å²	50.1	45%	0.449	25%	0.25	S	S	.	.	H	α-helix	trans	-92	-58.8	176.1	-65.6	-178	-106.4	0	0	110.8	Q69 Y188 Q189 K193	Q69-E191 HydrophobicContact CB-CB 4.49Å; Q69-E191 VanDerWaalsContact CG-OE2 3.26Å; Q69-E191 WeakPolarHBondContact CG-OE2 3.33Å; Y188-E191 PolarHBondContact O-N 3.19Å; Q189-E191 VanDerWaalsContact C-N 3.26Å; Q189-E191 PolarHBondContact O-N 3.09Å; E191-K193 WeakPolarHBondContact O-CD 3.28Å; E191-K193 WeakPolarHBondContact O-CE 3.2Å; E191-K193 PolarHBondContact O-N 2.75Å; E191-K193 PolarHBondContact O-NZ 3.41Å
192	N	96.9	Very high	97	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-80.7	-10.8	-167.3	72.7	29.2	0	0	0	115.3	L68 S70 G72 I73 V185 Y188 Q189 M194	L68-N192 VanDerWaalsContact O-CB 3.26Å; L68-N192 WeakPolarHBondContact O-CB 3.28Å; L68-N192 PolarHBondContact O-ND2 2.87Å; S70-N192 WeakPolarHBondContact O-CB 3.33Å; G72-N192 PolarHBondContact N-O 3.03Å; I73-N192 HydrophobicContact CG2-CB 4.17Å; V185-N192 PolarHBondContact O-ND2 3.41Å; Y188-N192 PolarHBondContact O-N 2.96Å; Y188-N192 PolarHBondContact O-ND2 2.94Å; Y188-N192 PolarHBondContact O-OD1 3.3Å; Q189-N192 VanDerWaalsContact CA-OD1 3.32Å; Q189-N192 WeakPolarHBondContact CA-OD1 3.49Å; N192-M194 PolarHBondContact O-N 2.83Å; N192-M194 WeakPolarHBondContact OD1-CA 3.33Å; N192-M194 WeakPolarHBondContact OD1-CB 3.46Å; N192-M194 PolarHBondContact OD1-N 3.31Å
193	K	97.3	Very high	97	Very high	109 Å²	109	50.8 Å²	50.8	47%	0.474	26%	0.255	S	S	.	.			trans	62.3	18.4	-179.9	-37.9	-54.2	175.5	-166.7	0	115.6	E71 Q189 S190 E191	E71-K193 HydrophobicContact CG-CG 4.02Å; Q189-K193 VanDerWaalsContact O-CA 3.28Å; Q189-K193 WeakPolarHBondContact O-CA 3.39Å; Q189-K193 PolarHBondContact O-N 2.83Å; S190-K193 PolarHBondContact O-NZ 2.8Å; E191-K193 WeakPolarHBondContact O-CD 3.28Å; E191-K193 WeakPolarHBondContact O-CE 3.2Å; E191-K193 PolarHBondContact O-N 2.75Å; E191-K193 PolarHBondContact O-NZ 3.41Å
194	M	97.1	Very high	96.9	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.243	C	C	.	.			trans	-106.4	95.2	-179.2	-67.3	-59.9	-59.2	0	0	111.1	I73 R75 N192 L199 V202	I73-M194 HydrophobicContact CG2-CB 4.38Å; I73-M194 HydrophobicContact CG2-CG 3.9Å; I73-M194 WeakPolarHBondContact O-CE 3.49Å; I73-M194 VanDerWaalsContact O-CG 3.3Å; I73-M194 WeakPolarHBondContact O-CG 3.49Å; R75-M194 HydrophobicContact CB-CE 3.79Å; R75-M194 HydrophobicContact CB-SD 3.51Å; R75-M194 VanDerWaalsContact CB-SD 3.51Å; R75-M194 HydrophobicContact CG-SD 4.39Å; N192-M194 PolarHBondContact O-N 2.83Å; N192-M194 WeakPolarHBondContact OD1-CA 3.33Å; N192-M194 WeakPolarHBondContact OD1-CB 3.46Å; N192-M194 PolarHBondContact OD1-N 3.31Å; M194-L199 HydrophobicContact CB-CD2 4.12Å; M194-L199 HydrophobicContact CB-CG 4.29Å; M194-L199 HydrophobicContact CE-CD2 3.77Å; M194-L199 HydrophobicContact CE-CG 4.29Å; M194-V202 HydrophobicContact CE-CG2 4.27Å
195	S	97.5	Very high	96.7	Very high	13 Å²	13	45.4 Å²	45.4	9%	0.091	24%	0.239	C	C	.	.			trans	-72.9	167.8	174	74	0	0	0	0	113.1	Q189 E197 S198 L199	Q189-S195 VanDerWaalsContact CD-CB 3.41Å; Q189-S195 VanDerWaalsContact OE1-CA 3.24Å; Q189-S195 VanDerWaalsContact OE1-CB 3.25Å; S195-E197 VanDerWaalsContact C-N 3.29Å; S195-E197 WeakPolarHBondContact CB-OE2 3.42Å; S195-E197 PolarHBondContact O-N 2.96Å; S195-E197 PolarHBondContact OG-OE2 3.04Å; S195-S198 CarbonylContact O-C 3.42Å; S195-S198 WeakPolarHBondContact O-CA 3.31Å; S195-S198 WeakPolarHBondContact O-CB 3.42Å; S195-S198 PolarHBondContact O-N 3.31Å; S195-S198 WeakPolarHBondContact OG-CB 3.13Å; S195-S198 PolarHBondContact OG-N 2.83Å; S195-S198 VanDerWaalsContact OG-N 3.14Å; S195-S198 PolarHBondContact OG-OG 3.25Å; S195-L199 WeakPolarHBondContact O-CG 3.07Å; S195-L199 PolarHBondContact O-N 3.33Å
196	I	97.5	Very high	96.6	Very high	33 Å²	33	46.3 Å²	46.3	17%	0.169	24%	0.244	C	C	.	.	H	α-helix	trans	-55.6	-43.7	175.4	-64.2	177	0	0	0	111.2	S198 L199 G200 G228 I231 E232	I196-S198 VanDerWaalsContact C-N 3.35Å; I196-S198 PolarHBondContact O-N 2.85Å; I196-L199 PolarHBondContact O-N 3.21Å; I196-G200 PolarHBondContact O-N 3.22Å; I196-G228 VanDerWaalsContact CG2-O 3.25Å; I196-G228 WeakPolarHBondContact CG2-O 3.48Å; I196-I231 HydrophobicContact CG2-CB 4.32Å; I196-I231 HydrophobicContact CG2-CG2 4.33Å; I196-E232 HydrophobicContact CD1-CB 4.02Å; I196-E232 HydrophobicContact CD1-CG 3.94Å; I196-E232 HydrophobicContact CG2-CB 4.17Å
197	E	96.8	Very high	96.6	Very high	126 Å²	126	45.8 Å²	45.8	59%	0.589	24%	0.24	S	C	*	.	H	α-helix	trans	-67.9	-36.7	176.9	-41.1	86.8	159.1	0	0	111.4	S195 L199 G200 I201	S195-E197 VanDerWaalsContact C-N 3.29Å; S195-E197 WeakPolarHBondContact CB-OE2 3.42Å; S195-E197 PolarHBondContact O-N 2.96Å; S195-E197 PolarHBondContact OG-OE2 3.04Å; E197-L199 VanDerWaalsContact C-N 3.33Å; E197-G200 PolarHBondContact O-N 3.43Å; E197-I201 WeakPolarHBondContact O-CD1 3.01Å; E197-I201 VanDerWaalsContact O-CG1 3.25Å; E197-I201 WeakPolarHBondContact O-CG1 3.4Å; E197-I201 PolarHBondContact O-N 2.88Å
198	S	97.1	Very high	96.5	Very high	34 Å²	34	41.6 Å²	41.6	24%	0.238	21%	0.214	C	C	.	.	H	α-helix	trans	-64.7	-38.2	175.7	-57.3	0	0	0	0	111.8	S195 I196 V202	S195-S198 CarbonylContact O-C 3.42Å; S195-S198 WeakPolarHBondContact O-CA 3.31Å; S195-S198 WeakPolarHBondContact O-CB 3.42Å; S195-S198 PolarHBondContact O-N 3.31Å; S195-S198 WeakPolarHBondContact OG-CB 3.13Å; S195-S198 PolarHBondContact OG-N 2.83Å; S195-S198 VanDerWaalsContact OG-N 3.14Å; S195-S198 PolarHBondContact OG-OG 3.25Å; I196-S198 VanDerWaalsContact C-N 3.35Å; I196-S198 PolarHBondContact O-N 2.85Å; S198-V202 VanDerWaalsContact O-CG2 3.32Å; S198-V202 WeakPolarHBondContact O-CG2 3.45Å; S198-V202 PolarHBondContact O-N 2.7Å
199	L	98.2	Very high	96.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-72.4	-40.7	174.2	-66.3	170.4	0	0	0	111.1	F74 L182 V185 M194 S195 I196 E197 I201 V202 F203 I231	F74-L199 HydrophobicContact CD2-CD2 4.25Å; L182-L199 HydrophobicContact CB-CD1 4.45Å; L182-L199 HydrophobicContact CD2-CD2 4.34Å; L182-L199 WeakPolarHBondContact O-CD1 3.36Å; V185-L199 HydrophobicContact CB-CD1 4.22Å; V185-L199 HydrophobicContact CG1-CD1 4.08Å; V185-L199 HydrophobicContact CG1-CD2 4.18Å; M194-L199 HydrophobicContact CB-CD2 4.12Å; M194-L199 HydrophobicContact CB-CG 4.29Å; M194-L199 HydrophobicContact CE-CD2 3.77Å; M194-L199 HydrophobicContact CE-CG 4.29Å; S195-L199 WeakPolarHBondContact O-CG 3.07Å; S195-L199 PolarHBondContact O-N 3.33Å; I196-L199 PolarHBondContact O-N 3.21Å; E197-L199 VanDerWaalsContact C-N 3.33Å; L199-I201 VanDerWaalsContact C-N 3.34Å; L199-I201 PolarHBondContact O-N 3.1Å; L199-V202 PolarHBondContact O-N 3.47Å; L199-F203 PolarHBondContact O-N 3.47Å; L199-I231 HydrophobicContact CB-CD1 4.03Å
200	G	97.4	Very high	95.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-56.8	-43.7	173.8	0	0	0	0	0	113	I196 E197 V202 G204 N224	I196-G200 PolarHBondContact O-N 3.22Å; E197-G200 PolarHBondContact O-N 3.43Å; G200-V202 VanDerWaalsContact C-N 3.32Å; G200-V202 PolarHBondContact O-N 3.45Å; G200-G204 PolarHBondContact O-N 2.95Å; G200-N224 WeakPolarHBondContact CA-O 3.46Å
201	I	96.1	Very high	93.9	Very high	100 Å²	100	37.3 Å²	37.3	51%	0.513	18%	0.183	S	C	.	.	H	α-helix	trans	-62.6	-35.4	173.6	-68.4	162.1	0	0	0	112.4	E197 L199 P205 N224	E197-I201 WeakPolarHBondContact O-CD1 3.01Å; E197-I201 VanDerWaalsContact O-CG1 3.25Å; E197-I201 WeakPolarHBondContact O-CG1 3.4Å; E197-I201 PolarHBondContact O-N 2.88Å; L199-I201 VanDerWaalsContact C-N 3.34Å; L199-I201 PolarHBondContact O-N 3.1Å; I201-P205 WeakPolarHBondContact O-CD 3.01Å; I201-N224 HydrophobicContact CG1-CB 4.09Å
202	V	96.9	Very high	92.2	Very high	24 Å²	24	38.5 Å²	38.5	15%	0.145	20%	0.199	C	C	.	.	H	α-helix	trans	-81.3	-35.9	-178.6	171.7	0	0	0	0	112.3	F74 R75 K123 M194 S198 L199 G200 N206	F74-V202 HydrophobicContact CB-CG1 3.89Å; R75-V202 HydrophobicContact CB-CG2 4.43Å; K123-V202 HydrophobicContact CD-CG1 3.76Å; M194-V202 HydrophobicContact CE-CG2 4.27Å; S198-V202 VanDerWaalsContact O-CG2 3.32Å; S198-V202 WeakPolarHBondContact O-CG2 3.45Å; S198-V202 PolarHBondContact O-N 2.7Å; L199-V202 PolarHBondContact O-N 3.47Å; G200-V202 VanDerWaalsContact C-N 3.32Å; G200-V202 PolarHBondContact O-N 3.45Å; V202-N206 PolarHBondContact O-ND2 3.3Å
203	F	97.6	Very high	90.5	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-95.9	-28.3	-174.7	-81.1	-88.6	0	0	0	114.7	F74 L122 K123 L126 L178 L182 L199 N206 V207 M227	F74-F203 HydrophobicContact CB-CE2 3.85Å; F74-F203 HydrophobicContact CB-CZ 4.34Å; F74-F203 AromaticContact CD1-CE2 3.87Å; F74-F203 HydrophobicContact CD1-CE2 3.87Å; F74-F203 AromaticContact CD1-CZ 3.5Å; F74-F203 HydrophobicContact CD1-CZ 3.5Å; F74-F203 HydrophobicContact CD2-CE2 4.01Å; F74-F203 HydrophobicContact CD2-CZ 4.26Å; F74-F203 HydrophobicContact CE1-CE2 4.48Å; F74-F203 AromaticContact CE1-CZ 3.81Å; F74-F203 HydrophobicContact CE1-CZ 3.81Å; F74-F203 AromaticContact CG-CE2 3.62Å; F74-F203 HydrophobicContact CG-CE2 3.62Å; F74-F203 AromaticContact CG-CZ 3.77Å; F74-F203 HydrophobicContact CG-CZ 3.77Å; F74-F203 HydrophobicContact CZ-CZ 4.31Å; L122-F203 HydrophobicContact CD2-CE1 4.15Å; L122-F203 HydrophobicContact CD2-CZ 4.15Å; L122-F203 HydrophobicContact CG-CE1 4.48Å; K123-F203 HydrophobicContact CG-CE1 4.36Å; K123-F203 HydrophobicContact CG-CZ 4.32Å; L126-F203 HydrophobicContact CD1-CD1 4.09Å; L126-F203 HydrophobicContact CD1-CE1 3.95Å; L178-F203 HydrophobicContact CD1-CD1 4.39Å; L178-F203 HydrophobicContact CD1-CE1 4.03Å; L178-F203 HydrophobicContact CD2-CD1 4.44Å; L182-F203 HydrophobicContact CD1-CB 4.25Å; L182-F203 HydrophobicContact CD1-CD1 3.92Å; L182-F203 HydrophobicContact CD1-CD2 3.63Å; L182-F203 HydrophobicContact CD1-CE1 4.15Å; L182-F203 HydrophobicContact CD1-CE2 3.88Å; L182-F203 HydrophobicContact CD1-CG 3.64Å; L182-F203 HydrophobicContact CD1-CZ 4.13Å; L182-F203 HydrophobicContact CD2-CD2 3.97Å; L182-F203 HydrophobicContact CD2-CE1 4.41Å; L182-F203 HydrophobicContact CD2-CE2 3.4Å; L182-F203 VanDerWaalsContact CD2-CE2 3.4Å; L182-F203 HydrophobicContact CD2-CZ 3.66Å; L182-F203 HydrophobicContact CG-CD2 4.48Å; L182-F203 HydrophobicContact CG-CE2 4.31Å; L182-F203 HydrophobicContact CG-CZ 4.49Å; L199-F203 PolarHBondContact O-N 3.47Å; F203-N206 CarbonylContact O-C 3.58Å; F203-N206 WeakPolarHBondContact O-CA 3.16Å; F203-N206 PolarHBondContact O-N 3.13Å; F203-V207 HydrophobicContact CB-CG2 4.38Å; F203-V207 PolarHBondContact O-N 3.25Å; F203-M227 HydrophobicContact CB-CE 4.22Å; F203-M227 HydrophobicContact CB-CG 4.06Å; F203-M227 HydrophobicContact CB-SD 4.19Å
204	G	94.9	Very high	88.6	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-47.8	-49	176.8	0	0	0	0	0	114.1	G200 N206 F208	G200-G204 PolarHBondContact O-N 2.95Å; G204-N206 PolarHBondContact O-N 2.83Å; G204-F208 PolarHBondContact O-N 3.3Å
205	P	92.8	Very high	86.8	Confident	51 Å²	51	48.6 Å²	48.6	33%	0.331	25%	0.252	S	S	.	.	H	α-helix	trans	-70.8	-6.8	176.4	-17.4	29.5	0	0	0	116.4	I201	I201-P205 WeakPolarHBondContact O-CD 3.01Å
206	N	95.1	Very high	85.1	Confident	20 Å²	20	48.5 Å²	48.5	11%	0.107	25%	0.254	C	S	.	.	H	α-helix	trans	-114.8	-11	-179.4	-56.9	-85.9	0	0	0	112.5	K123 L126 R127 V202 F203 G204	K123-N206 PolarHBondContact O-OD1 3.32Å; L126-N206 CarbonylContact C-O 3.59Å; L126-N206 HydrophobicContact CB-CB 4.47Å; L126-N206 WeakPolarHBondContact CB-O 3.18Å; R127-N206 HydrophobicContact CB-CB 4.39Å; V202-N206 PolarHBondContact O-ND2 3.3Å; F203-N206 CarbonylContact O-C 3.58Å; F203-N206 WeakPolarHBondContact O-CA 3.16Å; F203-N206 PolarHBondContact O-N 3.13Å; G204-N206 PolarHBondContact O-N 2.83Å
207	V	96.6	Very high	83.8	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-102.4	-45	178.5	170.1	0	0	0	0	111.6	L133 I134 L175 L178 F203 M227	L133-V207 HydrophobicContact CB-CG1 4.3Å; L133-V207 HydrophobicContact CD2-CG1 4.31Å; L133-V207 PolarHBondContact N-O 3.46Å; L133-V207 VanDerWaalsContact N-O 3.15Å; I134-V207 HydrophobicContact CD1-CG1 3.76Å; I134-V207 HydrophobicContact CG1-CG1 3.96Å; I134-V207 PolarHBondContact N-O 3.32Å; L175-V207 HydrophobicContact CD1-CG1 3.85Å; L178-V207 HydrophobicContact CD2-CG2 3.78Å; F203-V207 HydrophobicContact CB-CG2 4.38Å; F203-V207 PolarHBondContact O-N 3.25Å; V207-M227 HydrophobicContact CB-SD 3.95Å; V207-M227 HydrophobicContact CG1-SD 4.04Å; V207-M227 HydrophobicContact CG2-CE 4.24Å; V207-M227 HydrophobicContact CG2-SD 3.89Å
208	F	93.9	Very high	82.8	Confident	7 Å²	7	61.1 Å²	61.1	3%	0.031	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-93.9	144.2	-176.6	-65.4	-99.6	0	0	0	111.9	I134 T139 F142 G204 Y210 I223 I226 M227 L230	I134-F208 HydrophobicContact CB-CD1 4.08Å; I134-F208 HydrophobicContact CB-CE1 4.43Å; I134-F208 HydrophobicContact CD1-CD1 3.94Å; I134-F208 HydrophobicContact CD1-CD2 4.45Å; I134-F208 HydrophobicContact CD1-CE1 3.49Å; I134-F208 VanDerWaalsContact CD1-CE1 3.49Å; I134-F208 HydrophobicContact CD1-CE2 4.04Å; I134-F208 HydrophobicContact CD1-CG 4.42Å; I134-F208 HydrophobicContact CD1-CZ 3.55Å; I134-F208 HydrophobicContact CG2-CD1 3.9Å; I134-F208 HydrophobicContact CG2-CE1 4.13Å; T139-F208 HydrophobicContact CG2-CB 4.03Å; T139-F208 HydrophobicContact CG2-CD1 3.92Å; T139-F208 HydrophobicContact CG2-CG 4.45Å; F142-F208 HydrophobicContact CB-CE1 4.12Å; F142-F208 AromaticContact CD2-CE1 3.81Å; F142-F208 HydrophobicContact CD2-CE1 3.81Å; F142-F208 HydrophobicContact CE2-CE1 4.39Å; F142-F208 AromaticContact CG-CE1 3.91Å; F142-F208 HydrophobicContact CG-CE1 3.91Å; G204-F208 PolarHBondContact O-N 3.3Å; F208-Y210 WeakPolarHBondContact O-CE2 3.5Å; F208-I223 HydrophobicContact CB-CG2 3.88Å; F208-I223 HydrophobicContact CD1-CD1 3.99Å; F208-I223 HydrophobicContact CD1-CG2 4.33Å; F208-I223 HydrophobicContact CD2-CG2 3.38Å; F208-I223 HydrophobicContact CE1-CD1 4.39Å; F208-I223 HydrophobicContact CE2-CG2 3.92Å; F208-I223 HydrophobicContact CG-CD1 4.22Å; F208-I223 HydrophobicContact CG-CG2 3.62Å; F208-I226 HydrophobicContact CE1-CG2 4.3Å; F208-I226 HydrophobicContact CZ-CB 4.48Å; F208-I226 HydrophobicContact CZ-CG2 3.82Å; F208-M227 HydrophobicContact CE2-CB 4.13Å; F208-M227 HydrophobicContact CE2-SD 3.87Å; F208-L230 HydrophobicContact CE2-CD1 4.46Å; F208-L230 HydrophobicContact CZ-CD1 3.91Å
209	R	89.8	Confident	82.1	Confident	98 Å²	98	62.2 Å²	62.2	37%	0.37	30%	0.297	S	S	.	.			trans	-104.8	145.4	178.9	-168.9	62.5	171.2	-111	-18	111.7	L129 P130 E131 I134 E136 T139	L129-R209 PolarHBondContact O-NH1 3.25Å; P130-R209 PolarHBondContact O-NH1 2.93Å; P130-R209 PolarHBondContact O-NH2 3.24Å; E131-R209 WeakPolarHBondContact O-CB 3.31Å; E131-R209 WeakPolarHBondContact O-CG 3.44Å; I134-R209 PolarHBondContact O-N 3.44Å; E136-R209 HydrophobicContact CB-CB 4.37Å; E136-R209 HydrophobicContact CB-CG 4.22Å; T139-R209 WeakPolarHBondContact CB-O 3.4Å; T139-R209 WeakPolarHBondContact CG2-O 3.46Å; T139-R209 PolarHBondContact OG1-N 3.25Å; T139-R209 PolarHBondContact OG1-O 3.03Å
210	Y	81.3	Confident	81.5	Confident	48 Å²	48	64.2 Å²	64.2	19%	0.188	31%	0.306	C	S	.	.			trans	-130.6	139.5	-175.4	-49.3	-104.7	0	0	0	111.1	F208 Q220 I223	F208-Y210 WeakPolarHBondContact O-CE2 3.5Å; Y210-Q220 PolarHBondContact OH-NE2 2.81Å; Y210-I223 HydrophobicContact CE1-CG1 3.84Å; Y210-I223 WeakPolarHBondContact OH-CG2 3.44Å
211	T	66.1	Low	81.2	Confident	25 Å²	25	70.3 Å²	70.3	15%	0.153	34%	0.339	C	S	.	.			trans	-66.8	161.3	161.5	49.8	0	0	0	0	111	E136 E213 N214	E136-T211 HydrophobicContact CG-CG2 3.75Å; E136-T211 WeakPolarHBondContact OE1-CG2 3.46Å; E136-T211 WeakPolarHBondContact OE2-CA 3.28Å; E136-T211 PolarHBondContact OE2-N 3.01Å; T211-E213 PolarHBondContact O-N 3.11Å; T211-E213 PolarHBondContact OG1-N 3.46Å; T211-N214 VanDerWaalsContact OG1-CB 3.27Å; T211-N214 WeakPolarHBondContact OG1-CB 3.3Å; T211-N214 PolarHBondContact OG1-N 2.93Å; T211-N214 PolarHBondContact OG1-ND2 2.7Å
212	P	60.7	Low	81.1	Confident	121 Å²	121	67.1 Å²	67.1	79%	0.786	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-32.1	159.3	-21.2	33.8	0	0	0	112.6	L215	P212-L215 PolarHBondContact O-N 3.18Å
213	E	59.7	Low	80.9	Confident	165 Å²	165	66 Å²	66	77%	0.771	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-42.2	-172	-56.2	-172.7	161.8	0	0	113.1	T211 L215	T211-E213 PolarHBondContact O-N 3.11Å; T211-E213 PolarHBondContact OG1-N 3.46Å; E213-L215 PolarHBondContact O-N 3.27Å; E213-L215 VanDerWaalsContact O-N 3.13Å
214	N	58.2	Low	80.8	Confident	67 Å²	67	66.9 Å²	66.9	36%	0.358	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-0.5	176.6	-64.4	-7.5	0	0	0	112.3	T211 G216	T211-N214 VanDerWaalsContact OG1-CB 3.27Å; T211-N214 WeakPolarHBondContact OG1-CB 3.3Å; T211-N214 PolarHBondContact OG1-N 2.93Å; T211-N214 PolarHBondContact OG1-ND2 2.7Å; N214-G216 PolarHBondContact O-N 3.45Å
215	L	59.6	Low	80.7	Confident	88 Å²	88	70.1 Å²	70.1	46%	0.461	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.1	54.4	171.1	-71.9	171.4	0	0	0	112	P212 E213 Y217 R218	P212-L215 PolarHBondContact O-N 3.18Å; E213-L215 PolarHBondContact O-N 3.27Å; E213-L215 VanDerWaalsContact O-N 3.13Å; L215-Y217 CarbonylContact O-C 3.58Å; L215-Y217 PolarHBondContact O-N 3.03Å; L215-R218 HydrophobicContact CB-CG 4.26Å; L215-R218 PolarHBondContact O-N 3.46Å
216	G	62.2	Low	80.9	Confident	12 Å²	12	67.7 Å²	67.7	12%	0.124	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.8	-20.9	-163.6	0	0	0	0	0	117.7	N214 R218 E219 Q220	N214-G216 PolarHBondContact O-N 3.45Å; G216-R218 VanDerWaalsContact C-N 3.25Å; G216-R218 PolarHBondContact O-N 3.01Å; G216-E219 PolarHBondContact O-N 3.19Å; G216-Q220 WeakPolarHBondContact O-CA 3.27Å; G216-Q220 WeakPolarHBondContact O-CB 3.28Å; G216-Q220 PolarHBondContact O-N 3.25Å
217	Y	69.4	Low	81	Confident	224 Å²	224	66.8 Å²	66.8	88%	0.878	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-30.8	166.9	-142.4	-83.3	0	0	0	114.8	L215	L215-Y217 CarbonylContact O-C 3.58Å; L215-Y217 PolarHBondContact O-N 3.03Å
218	R	75.2	Confident	81	Confident	199 Å²	199	67 Å²	67	75%	0.751	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-42.7	175.2	-71.7	-176.1	171.5	-175.9	-1	111.5	L215 G216	L215-R218 HydrophobicContact CB-CG 4.26Å; L215-R218 PolarHBondContact O-N 3.46Å; G216-R218 VanDerWaalsContact C-N 3.25Å; G216-R218 PolarHBondContact O-N 3.01Å
219	E	81.8	Confident	81.1	Confident	58 Å²	58	66.9 Å²	66.9	27%	0.271	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-6.3	-171.8	-59.4	-176.9	133.3	0	0	112.7	L143 G216 N221 S222 I223	L143-E219 HydrophobicContact CD1-CB 4.29Å; L143-E219 VanDerWaalsContact CD1-OE2 3.27Å; L143-E219 WeakPolarHBondContact CD1-OE2 3.1Å; L143-E219 HydrophobicContact CD2-CB 3.95Å; G216-E219 PolarHBondContact O-N 3.19Å; E219-N221 PolarHBondContact O-N 3Å; E219-N221 VanDerWaalsContact O-N 3.09Å; E219-S222 WeakPolarHBondContact O-CA 3.48Å; E219-S222 VanDerWaalsContact O-CB 3.29Å; E219-S222 WeakPolarHBondContact O-CB 3.49Å; E219-S222 PolarHBondContact O-N 2.78Å; E219-I223 PolarHBondContact O-N 3.36Å
220	Q	87	Confident	81.4	Confident	41 Å²	41	62.2 Å²	62.2	19%	0.192	30%	0.302	C	S	.	.	H	α-helix	trans	-50.8	-39.1	-177.3	-168	63.8	84.7	0	0	113	Y210 G216 I223 N224	Y210-Q220 PolarHBondContact OH-NE2 2.81Å; G216-Q220 WeakPolarHBondContact O-CA 3.27Å; G216-Q220 WeakPolarHBondContact O-CB 3.28Å; G216-Q220 PolarHBondContact O-N 3.25Å; Q220-I223 PolarHBondContact O-N 3.02Å; Q220-N224 PolarHBondContact NE2-OD1 2.93Å; Q220-N224 VanDerWaalsContact O-CB 3.29Å; Q220-N224 WeakPolarHBondContact O-CB 3.31Å; Q220-N224 PolarHBondContact O-N 3.45Å; Q220-N224 PolarHBondContact O-ND2 3.15Å; Q220-N224 PolarHBondContact O-OD1 2.69Å; Q220-N224 VanDerWaalsContact O-OD1 3.09Å
221	N	91.4	Very high	82.2	Confident	128 Å²	128	60 Å²	60	68%	0.684	29%	0.293	S	S	*	.	H	α-helix	trans	-66.3	-36.8	177.9	-69	-27.7	0	0	0	112.5	E219 H225	E219-N221 PolarHBondContact O-N 3Å; E219-N221 VanDerWaalsContact O-N 3.09Å; N221-H225 WeakPolarHBondContact O-CB 3.46Å; N221-H225 PolarHBondContact O-N 2.87Å
222	S	92.6	Very high	83.6	Confident	34 Å²	34	63.4 Å²	63.4	24%	0.238	31%	0.308	C	S	.	.	H	α-helix	trans	-67.2	-50	173.7	-58.5	0	0	0	0	110.4	H146 E219 N224 H225 I226	H146-S222 VanDerWaalsContact CE1-CB 3.45Å; H146-S222 WeakPolarHBondContact CE1-CB 3.5Å; H146-S222 PolarHBondContact CE1-OG 3.17Å; E219-S222 WeakPolarHBondContact O-CA 3.48Å; E219-S222 VanDerWaalsContact O-CB 3.29Å; E219-S222 WeakPolarHBondContact O-CB 3.49Å; E219-S222 PolarHBondContact O-N 2.78Å; S222-N224 PolarHBondContact O-N 3.44Å; S222-H225 PolarHBondContact O-N 3.06Å; S222-H225 VanDerWaalsContact O-N 3.1Å; S222-I226 WeakPolarHBondContact O-CD1 3.49Å; S222-I226 VanDerWaalsContact O-CG1 3.28Å; S222-I226 WeakPolarHBondContact O-CG1 3.26Å; S222-I226 PolarHBondContact O-N 2.85Å
223	I	93.2	Very high	85.2	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59.7	-43.8	178.1	-62.6	-60.6	0	0	0	112.1	T139 L143 F208 Y210 E219 Q220 H225 I226 M227	T139-I223 HydrophobicContact CG2-CD1 3.79Å; L143-I223 HydrophobicContact CD1-CD1 4Å; L143-I223 HydrophobicContact CD2-CD1 3.66Å; L143-I223 HydrophobicContact CD2-CG1 4.06Å; L143-I223 HydrophobicContact CG-CD1 3.68Å; L143-I223 HydrophobicContact CG-CG1 4.5Å; F208-I223 HydrophobicContact CB-CG2 3.88Å; F208-I223 HydrophobicContact CD1-CD1 3.99Å; F208-I223 HydrophobicContact CD1-CG2 4.33Å; F208-I223 HydrophobicContact CD2-CG2 3.38Å; F208-I223 HydrophobicContact CE1-CD1 4.39Å; F208-I223 HydrophobicContact CE2-CG2 3.92Å; F208-I223 HydrophobicContact CG-CD1 4.22Å; F208-I223 HydrophobicContact CG-CG2 3.62Å; Y210-I223 HydrophobicContact CE1-CG1 3.84Å; Y210-I223 WeakPolarHBondContact OH-CG2 3.44Å; E219-I223 PolarHBondContact O-N 3.36Å; Q220-I223 PolarHBondContact O-N 3.02Å; I223-H225 PolarHBondContact O-N 2.86Å; I223-I226 HydrophobicContact CD1-CD1 4.15Å; I223-I226 PolarHBondContact O-N 2.72Å; I223-M227 WeakPolarHBondContact O-CB 3.4Å; I223-M227 PolarHBondContact O-N 3.37Å
224	N	94.7	Very high	86.8	Confident	18 Å²	18	51.6 Å²	51.6	10%	0.096	24%	0.242	C	C	.	.	H	α-helix	trans	-60.2	-35	177.7	-67.2	-6.5	0	0	0	111.8	G200 I201 Q220 S222 G228	G200-N224 WeakPolarHBondContact CA-O 3.46Å; I201-N224 HydrophobicContact CG1-CB 4.09Å; Q220-N224 PolarHBondContact NE2-OD1 2.93Å; Q220-N224 VanDerWaalsContact O-CB 3.29Å; Q220-N224 WeakPolarHBondContact O-CB 3.31Å; Q220-N224 PolarHBondContact O-N 3.45Å; Q220-N224 PolarHBondContact O-ND2 3.15Å; Q220-N224 PolarHBondContact O-OD1 2.69Å; Q220-N224 VanDerWaalsContact O-OD1 3.09Å; S222-N224 PolarHBondContact O-N 3.44Å; N224-G228 PolarHBondContact O-N 2.95Å; N224-G228 VanDerWaalsContact O-N 3.09Å
225	H	94.5	Very high	88.4	Confident	69 Å²	69	53.3 Å²	53.3	32%	0.319	25%	0.251	S	S	.	.	H	α-helix	trans	-78.4	-38.7	176.9	-176.3	83.4	0	0	0	112.9	H146 R150 N221 S222 I223 G228 N229	H146-H225 AromaticContact CD2-CD2 3.97Å; H146-H225 AromaticContact NE2-CD2 3.63Å; R150-H225 PolarHBondContact NH1-CD2 3.48Å; R150-H225 PolarHBondContact NH1-NE2 2.85Å; N221-H225 WeakPolarHBondContact O-CB 3.46Å; N221-H225 PolarHBondContact O-N 2.87Å; S222-H225 PolarHBondContact O-N 3.06Å; S222-H225 VanDerWaalsContact O-N 3.1Å; I223-H225 PolarHBondContact O-N 2.86Å; H225-G228 WeakPolarHBondContact O-CA 3.5Å; H225-G228 PolarHBondContact O-N 3.44Å; H225-G228 VanDerWaalsContact O-N 3.16Å; H225-N229 PolarHBondContact CD2-ND2 3.36Å; H225-N229 PolarHBondContact NE2-ND2 2.71Å; H225-N229 PolarHBondContact O-N 3.38Å; H225-N229 PolarHBondContact O-ND2 2.85Å
226	I	95.3	Very high	89.8	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59.4	-49.1	172	-64.3	156	0	0	0	109.2	F142 L143 H146 L160 F208 S222 I223 G228 N229 L230	F142-I226 HydrophobicContact CB-CD1 4.36Å; F142-I226 HydrophobicContact CB-CG2 4.43Å; F142-I226 HydrophobicContact CD1-CG2 3.88Å; F142-I226 HydrophobicContact CG-CG2 4.42Å; L143-I226 HydrophobicContact CD2-CD1 4.29Å; H146-I226 HydrophobicContact CB-CD1 3.69Å; H146-I226 HydrophobicContact CB-CG1 3.89Å; L160-I226 HydrophobicContact CD2-CG2 4.4Å; F208-I226 HydrophobicContact CE1-CG2 4.3Å; F208-I226 HydrophobicContact CZ-CB 4.48Å; F208-I226 HydrophobicContact CZ-CG2 3.82Å; S222-I226 WeakPolarHBondContact O-CD1 3.49Å; S222-I226 VanDerWaalsContact O-CG1 3.28Å; S222-I226 WeakPolarHBondContact O-CG1 3.26Å; S222-I226 PolarHBondContact O-N 2.85Å; I223-I226 HydrophobicContact CD1-CD1 4.15Å; I223-I226 PolarHBondContact O-N 2.72Å; I226-G228 VanDerWaalsContact C-N 3.26Å; I226-G228 PolarHBondContact O-N 3.29Å; I226-N229 PolarHBondContact O-N 2.85Å; I226-N229 VanDerWaalsContact O-N 3.1Å; I226-L230 HydrophobicContact CG2-CD1 4.37Å; I226-L230 WeakPolarHBondContact O-CG 3.47Å; I226-L230 PolarHBondContact O-N 3.37Å
227	M	96.9	Very high	91.3	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-56.2	-39.4	173.8	-169.9	73.8	-136	0	0	112.1	L182 F203 V207 F208 I223 L230 I231	L182-M227 HydrophobicContact CD1-CE 4.35Å; F203-M227 HydrophobicContact CB-CE 4.22Å; F203-M227 HydrophobicContact CB-CG 4.06Å; F203-M227 HydrophobicContact CB-SD 4.19Å; V207-M227 HydrophobicContact CB-SD 3.95Å; V207-M227 HydrophobicContact CG1-SD 4.04Å; V207-M227 HydrophobicContact CG2-CE 4.24Å; V207-M227 HydrophobicContact CG2-SD 3.89Å; F208-M227 HydrophobicContact CE2-CB 4.13Å; F208-M227 HydrophobicContact CE2-SD 3.87Å; I223-M227 WeakPolarHBondContact O-CB 3.4Å; I223-M227 PolarHBondContact O-N 3.37Å; M227-L230 PolarHBondContact O-N 2.93Å; M227-I231 HydrophobicContact CE-CD1 3.9Å; M227-I231 HydrophobicContact CE-CG1 3.91Å; M227-I231 HydrophobicContact CG-CD1 4.21Å; M227-I231 WeakPolarHBondContact O-CD1 3.46Å; M227-I231 VanDerWaalsContact O-CG1 3.31Å; M227-I231 WeakPolarHBondContact O-CG1 3.38Å; M227-I231 PolarHBondContact O-N 3.08Å; M227-I231 VanDerWaalsContact O-N 3.15Å
228	G	96.8	Very high	92.3	Very high	5 Å²	5	39.9 Å²	39.9	5%	0.052	20%	0.195	C	C	.	.	H	α-helix	trans	-58.5	-50.4	172.8	0	0	0	0	0	112.7	I196 N224 H225 I226 L230 I231 E232	I196-G228 VanDerWaalsContact CG2-O 3.25Å; I196-G228 WeakPolarHBondContact CG2-O 3.48Å; N224-G228 PolarHBondContact O-N 2.95Å; N224-G228 VanDerWaalsContact O-N 3.09Å; H225-G228 WeakPolarHBondContact O-CA 3.5Å; H225-G228 PolarHBondContact O-N 3.44Å; H225-G228 VanDerWaalsContact O-N 3.16Å; I226-G228 VanDerWaalsContact C-N 3.26Å; I226-G228 PolarHBondContact O-N 3.29Å; G228-L230 VanDerWaalsContact C-N 3.33Å; G228-L230 PolarHBondContact O-N 2.64Å; G228-I231 PolarHBondContact O-N 3.33Å; G228-I231 VanDerWaalsContact O-N 3.13Å; G228-E232 WeakPolarHBondContact O-CB 3.44Å; G228-E232 PolarHBondContact O-N 2.68Å
229	N	95.9	Very high	92.6	Very high	5 Å²	5	38.1 Å²	38.1	3%	0.027	19%	0.188	C	C	.	.	H	α-helix	trans	-63.7	-36.7	178.2	-74.8	-104.7	0	0	0	112.2	Q153 Y156 L160 H225 I226 I231 E232 H233	Q153-N229 PolarHBondContact NE2-OD1 2.88Å; Y156-N229 HydrophobicContact CE1-CB 4.31Å; L160-N229 HydrophobicContact CD1-CB 4.28Å; H225-N229 PolarHBondContact CD2-ND2 3.36Å; H225-N229 PolarHBondContact NE2-ND2 2.71Å; H225-N229 PolarHBondContact O-N 3.38Å; H225-N229 PolarHBondContact O-ND2 2.85Å; I226-N229 PolarHBondContact O-N 2.85Å; I226-N229 VanDerWaalsContact O-N 3.1Å; N229-I231 VanDerWaalsContact C-N 3.26Å; N229-I231 PolarHBondContact O-N 2.88Å; N229-E232 PolarHBondContact O-N 3.16Å; N229-H233 WeakPolarHBondContact O-CB 3.48Å; N229-H233 PolarHBondContact O-N 3.24Å
230	L	96.9	Very high	91.7	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.7	-30.5	175.2	-67.8	177.9	0	0	0	112.8	I134 V164 C179 F208 I226 M227 G228 L237	I134-L230 HydrophobicContact CD1-CD1 4.42Å; V164-L230 HydrophobicContact CG2-CD2 3.83Å; C179-L230 WeakPolarHBondContact CB-O 3.27Å; F208-L230 HydrophobicContact CE2-CD1 4.46Å; F208-L230 HydrophobicContact CZ-CD1 3.91Å; I226-L230 HydrophobicContact CG2-CD1 4.37Å; I226-L230 WeakPolarHBondContact O-CG 3.47Å; I226-L230 PolarHBondContact O-N 3.37Å; M227-L230 PolarHBondContact O-N 2.93Å; G228-L230 VanDerWaalsContact C-N 3.33Å; G228-L230 PolarHBondContact O-N 2.64Å; L230-L237 HydrophobicContact CD2-CD1 3.93Å
231	I	97.5	Very high	90	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-81.4	-44	174.7	-65.2	164.5	0	0	0	110.8	L182 H183 I196 L199 M227 G228 N229 H233	L182-I231 HydrophobicContact CB-CD1 4.03Å; L182-I231 HydrophobicContact CB-CG1 4.04Å; L182-I231 HydrophobicContact CB-CG2 4.08Å; L182-I231 HydrophobicContact CD1-CD1 3.86Å; L182-I231 HydrophobicContact CD1-CG1 4.28Å; H183-I231 HydrophobicContact CB-CG2 4.31Å; H183-I231 PolarHBondContact ND1-O 2.78Å; I196-I231 HydrophobicContact CG2-CB 4.32Å; I196-I231 HydrophobicContact CG2-CG2 4.33Å; L199-I231 HydrophobicContact CB-CD1 4.03Å; M227-I231 HydrophobicContact CE-CD1 3.9Å; M227-I231 HydrophobicContact CE-CG1 3.91Å; M227-I231 HydrophobicContact CG-CD1 4.21Å; M227-I231 WeakPolarHBondContact O-CD1 3.46Å; M227-I231 VanDerWaalsContact O-CG1 3.31Å; M227-I231 WeakPolarHBondContact O-CG1 3.38Å; M227-I231 PolarHBondContact O-N 3.08Å; M227-I231 VanDerWaalsContact O-N 3.15Å; G228-I231 PolarHBondContact O-N 3.33Å; G228-I231 VanDerWaalsContact O-N 3.13Å; N229-I231 VanDerWaalsContact C-N 3.26Å; N229-I231 PolarHBondContact O-N 2.88Å; I231-H233 PolarHBondContact O-N 3.03Å
232	E	95.9	Very high	87.7	Confident	97 Å²	97	39.6 Å²	39.6	45%	0.453	20%	0.2	S	C	.	.	H	α-helix	trans	-62.1	-42.3	-179.4	-168.1	171.1	169.2	0	0	112.4	H183 I196 G228 N229	H183-E232 PolarHBondContact CE1-O 2.81Å; I196-E232 HydrophobicContact CD1-CB 4.02Å; I196-E232 HydrophobicContact CD1-CG 3.94Å; I196-E232 HydrophobicContact CG2-CB 4.17Å; G228-E232 WeakPolarHBondContact O-CB 3.44Å; G228-E232 PolarHBondContact O-N 2.68Å; N229-E232 PolarHBondContact O-N 3.16Å
233	H	94.4	Very high	84.9	Confident	38 Å²	38	42.7 Å²	42.7	18%	0.176	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	27.6	-172.5	-58.4	-49.9	0	0	0	112.8	Q153 L157 N229 I231 D235 S236 L237	Q153-H233 PolarHBondContact NE2-NE2 3.26Å; L157-H233 WeakPolarHBondContact CD2-CD2 3.36Å; N229-H233 WeakPolarHBondContact O-CB 3.48Å; N229-H233 PolarHBondContact O-N 3.24Å; I231-H233 PolarHBondContact O-N 3.03Å; H233-D235 VanDerWaalsContact C-N 3.27Å; H233-D235 PolarHBondContact O-N 2.81Å; H233-S236 WeakPolarHBondContact CB-OG 3.43Å; H233-S236 PolarHBondContact O-N 3.46Å; H233-S236 VanDerWaalsContact O-N 3.1Å; H233-S236 PolarHBondContact O-OG 2.9Å; H233-L237 HydrophobicContact CB-CD1 3.86Å; H233-L237 HydrophobicContact CB-CG 3.93Å; H233-L237 WeakPolarHBondContact O-CG 3.3Å; H233-L237 PolarHBondContact O-N 3.28Å
234	S	93.9	Very high	82	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.007	25%	0.25	C	S	.	.	H	α-helix	trans	-54.7	-40.2	-174.5	63.2	0	0	0	0	113.4	S236 F238	S234-S236 VanDerWaalsContact C-N 3.31Å; S234-S236 PolarHBondContact O-N 3.31Å; S234-F238 WeakPolarHBondContact O-CB 3.35Å; S234-F238 WeakPolarHBondContact O-CD2 3.46Å; S234-F238 PolarHBondContact O-N 2.81Å
235	D	90.2	Very high	78.8	Confident	102 Å²	102	52.8 Å²	52.8	55%	0.545	29%	0.29	S	S	.	.	H	α-helix	trans	-83.5	-10.5	-174.6	-60.1	-16.2	0	0	0	113	Q180 H233	Q180-D235 PolarHBondContact NE2-OD1 3.11Å; H233-D235 VanDerWaalsContact C-N 3.27Å; H233-D235 PolarHBondContact O-N 2.81Å
236	S	90.7	Very high	75.5	Confident	33 Å²	33	56.9 Å²	56.9	23%	0.231	31%	0.309	C	S	.	.	H	α-helix	trans	-98.7	-36.3	170.5	46.1	0	0	0	0	113.6	H233 S234 R239	H233-S236 WeakPolarHBondContact CB-OG 3.43Å; H233-S236 PolarHBondContact O-N 3.46Å; H233-S236 VanDerWaalsContact O-N 3.1Å; H233-S236 PolarHBondContact O-OG 2.9Å; S234-S236 VanDerWaalsContact C-N 3.31Å; S234-S236 PolarHBondContact O-N 3.31Å; S236-R239 WeakPolarHBondContact O-CD 3.47Å; S236-R239 VanDerWaalsContact O-CG 3.28Å; S236-R239 WeakPolarHBondContact O-CG 3.4Å
237	L	92.3	Very high	72.2	Confident	5 Å²	5	64 Å²	64	3%	0.026	35%	0.347	C	S	.	.	H	α-helix	trans	-83.3	-22.7	-176.3	-63.2	177.2	0	0	0	113.5	L157 L160 E161 L230 H233	L157-L237 HydrophobicContact CB-CD2 4.38Å; L157-L237 WeakPolarHBondContact O-CD2 3.24Å; L160-L237 HydrophobicContact CB-CD1 4.42Å; L160-L237 HydrophobicContact CB-CD2 4.18Å; L160-L237 HydrophobicContact CD1-CD1 4.4Å; E161-L237 HydrophobicContact CB-CD2 3.9Å; L230-L237 HydrophobicContact CD2-CD1 3.93Å; H233-L237 HydrophobicContact CB-CD1 3.86Å; H233-L237 HydrophobicContact CB-CG 3.93Å; H233-L237 WeakPolarHBondContact O-CG 3.3Å; H233-L237 PolarHBondContact O-N 3.28Å
238	F	91.3	Very high	69	Low	4 Å²	4	71.1 Å²	71.1	2%	0.018	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	38	-178.4	-61.9	-93	0	0	0	112.6	V164 Y172 L175 K176 C179 S234	V164-F238 HydrophobicContact CG1-CD1 3.71Å; V164-F238 HydrophobicContact CG1-CE1 3.35Å; V164-F238 HydrophobicContact CG1-CG 4.45Å; V164-F238 HydrophobicContact CG1-CZ 3.81Å; Y172-F238 AromaticContact CD2-CD1 3.98Å; Y172-F238 HydrophobicContact CD2-CD1 3.98Å; Y172-F238 HydrophobicContact CD2-CE1 4.3Å; Y172-F238 HydrophobicContact CE2-CB 4.47Å; Y172-F238 AromaticContact CE2-CD1 3.57Å; Y172-F238 HydrophobicContact CE2-CD1 3.57Å; Y172-F238 HydrophobicContact CE2-CE1 4.29Å; Y172-F238 HydrophobicContact CE2-CG 4.41Å; Y172-F238 WeakPolarHBondContact OH-CA 3.38Å; Y172-F238 PolarHBondContact OH-O 3.06Å; L175-F238 HydrophobicContact CB-CE1 4.17Å; L175-F238 HydrophobicContact CB-CZ 4.48Å; L175-F238 HydrophobicContact CD2-CE1 3.92Å; L175-F238 HydrophobicContact CD2-CZ 3.8Å; L175-F238 HydrophobicContact CG-CE1 3.88Å; L175-F238 HydrophobicContact CG-CZ 3.73Å; K176-F238 HydrophobicContact CB-CB 4.06Å; K176-F238 HydrophobicContact CB-CD1 3.55Å; K176-F238 HydrophobicContact CB-CE1 4.18Å; K176-F238 HydrophobicContact CB-CG 3.93Å; K176-F238 HydrophobicContact CD-CB 3.88Å; K176-F238 WeakPolarHBondContact CE-O 3.5Å; K176-F238 HydrophobicContact CG-CB 3.69Å; K176-F238 HydrophobicContact CG-CD1 4.17Å; K176-F238 HydrophobicContact CG-CG 4.06Å; K176-F238 PolarHBondContact NZ-O 3.27Å; C179-F238 HydrophobicContact CB-CE2 4.13Å; S234-F238 WeakPolarHBondContact O-CB 3.35Å; S234-F238 WeakPolarHBondContact O-CD2 3.46Å; S234-F238 PolarHBondContact O-N 2.81Å
239	R	80.4	Confident	65.5	Low	163 Å²	163	76.9 Å²	76.9	62%	0.615	42%	0.424	S	S	*	.			trans	-70.9	-27	179.2	-79	173.8	175.4	163.6	-1.6	114.3	S236 I241	S236-R239 WeakPolarHBondContact O-CD 3.47Å; S236-R239 VanDerWaalsContact O-CG 3.28Å; S236-R239 WeakPolarHBondContact O-CG 3.4Å; R239-I241 PolarHBondContact O-N 3.17Å
240	M	63.9	Low	62.3	Low	82 Å²	82	82.6 Å²	82.6	40%	0.404	46%	0.46	S	S	.	.	S	Bend	trans	-61.8	124.8	178.5	-173.5	171.4	68.3	0	0	109.6	A165 Y172 A242	A165-M240 HydrophobicContact CB-CE 3.96Å; A165-M240 HydrophobicContact CB-SD 4.17Å; Y172-M240 WeakPolarHBondContact CE1-O 3.48Å; Y172-M240 HydrophobicContact CE2-CE 4.41Å; Y172-M240 WeakPolarHBondContact OH-CB 3.28Å; Y172-M240 PolarHBondContact OH-N 2.81Å; Y172-M240 PolarHBondContact OH-O 2.83Å; M240-A242 PolarHBondContact O-N 3.4Å
241	I	52.4	Low	59	Low	147 Å²	147	91 Å²	91	75%	0.754	50%	0.504	S	S	*	.			trans	-74.4	115	166.1	-58.8	175.2	0	0	0	105.4	R239	R239-I241 PolarHBondContact O-N 3.17Å
242	A	41.4	Very low	55.8	Low	28 Å²	28	97.8 Å²	97.8	23%	0.231	54%	0.54	C	S	.	.			trans	-56.9	136.2	173.2	0	0	0	0	0	109.3	V169 Y172 M240 S244	V169-A242 HydrophobicContact CG1-CB 3.88Å; Y172-A242 HydrophobicContact CD1-CB 4.44Å; Y172-A242 HydrophobicContact CE1-CB 4.45Å; M240-A242 PolarHBondContact O-N 3.4Å; A242-S244 PolarHBondContact O-N 2.97Å
243	P	33.6	Very low	52.6	Low	100 Å²	100	100 Å²	100	65%	0.649	56%	0.555	S	S	*	*			trans	-59	109.8	170.2	-22	33.5	0	0	0	109	C245	P243-C245 PolarHBondContact O-N 2.98Å
244	S	34.2	Very low	49.4	Very low	93 Å²	93	105.2 Å²	105.2	65%	0.65	58%	0.584	S	S	*	*			trans	-57.8	129.2	176	50.8	0	0	0	0	109.2	A242 E246	A242-S244 PolarHBondContact O-N 2.97Å; S244-E246 PolarHBondContact O-N 3.29Å
245	C	26.9	Very low	46.5	Very low	137 Å²	137	113.7 Å²	113.7	93%	0.926	63%	0.628	S	S	*	*	S	Bend	trans	-75	62	-173.9	56.8	0	0	0	0	113.2	P243	P243-C245 PolarHBondContact O-N 2.98Å
246	E	25.9	Very low	43.5	Very low	154 Å²	154	114.7 Å²	114.7	72%	0.72	64%	0.643	S	S	*	*			trans	-117.6	138.1	166.9	-63	-172.3	154.9	0	0	108.4	S244	S244-E246 PolarHBondContact O-N 3.29Å
247	N	25.3	Very low	40.6	Very low	151 Å²	151	116.4 Å²	116.4	81%	0.807	67%	0.667	S	S	*	*			trans	82.5	50.9	176.9	-42.3	-68.9	0	0	0	118.8
248	V	28.8	Very low	37.5	Very low	149 Å²	149	123.2 Å²	123.2	90%	0.903	70%	0.703	S	S	*	*			trans	-131.3	75	149	-167.5	0	0	0	0	111.1
249	T	24.6	Very low	34.4	Very low	125 Å²	125	130.5 Å²	130.5	77%	0.767	74%	0.742	S	S	*	*			trans	-121.6	143.7	155.3	35.6	0	0	0	0	108.9
250	T	27.1	Very low	31.7	Very low	125 Å²	125	128.5 Å²	128.5	77%	0.767	75%	0.751	S	S	*	*			trans	55.4	80.8	174.1	60.5	0	0	0	0	116.7
251	L	29.6	Very low	29.9	Very low	177 Å²	177	128.2 Å²	128.2	93%	0.927	76%	0.763	S	S	*	*				-134	138.2	128.5	-83.4	-174.1	0	0	0	108.9
252	N	29.5	Very low	28.7	Very low	142 Å²	142	129.4 Å²	129.4	76%	0.759	77%	0.765	S	S	*	*			trans	-79.5	166.6	-155.5	-64.3	-15	0	0	0	115.1
253	D	27.8	Very low	28.1	Very low	143 Å²	143	135.8 Å²	135.8	77%	0.765	79%	0.793	S	S	*	*			trans	-42.1	172.2	154.3	-54.1	-83.5	0	0	0	114.9
254	N	27.2	Very low	27.8	Very low	149 Å²	149	138.7 Å²	138.7	80%	0.797	80%	0.798	S	S	*	*			trans	87.7	80.5	176.2	-49.2	-80.1	0	0	0	115.3
255	L	32.8	Very low	27.4	Very low	179 Å²	179	142.5 Å²	142.5	94%	0.937	81%	0.805	S	S	*	*				-166.4	115.2	120.7	-103.3	159.3	0	0	0	111.1
256	S	27.1	Very low	27.4	Very low	122 Å²	122	142.4 Å²	142.4	85%	0.853	79%	0.794	S	S	*	*			trans	-85.6	136.8	170.5	51.1	0	0	0	0	110.4
257	G	29.8	Very low	27.4	Very low	70 Å²	70	140.2 Å²	140.2	72%	0.722	79%	0.793	S	S	*	*			trans	171.6	92.8	177.7	0	0	0	0	0	116
258	N	28.1	Very low	27.7	Very low	148 Å²	148	142.1 Å²	142.1	79%	0.791	80%	0.795	S	S	*	*			trans	-22.2	149	166.2	-54.2	-27.8	0	0	0	118.7
259	N	26.1	Very low	27.5	Very low	156 Å²	156	142.5 Å²	142.5	83%	0.834	79%	0.792	S	S	*	*			trans	76.7	155.4	173.8	-40.4	-60.4	0	0	0	113.8
260	C	24.6	Very low	27.6	Very low	121 Å²	121	144.1 Å²	144.1	82%	0.818	80%	0.795	S	S	*	*			cis	-145.1	162.1	10.9	-163.6	0	0	0	0	111.6
261	A	25.3	Very low	27.6	Very low	77 Å²	77	144.1 Å²	144.1	64%	0.636	80%	0.796	S	S	*	*			trans	-72.8	168.2	159.4	0	0	0	0	0	110.9
262	Q	26.6	Very low	27.5	Very low	171 Å²	171	140.8 Å²	140.8	80%	0.799	79%	0.787	S	S	*	*			trans	71.8	90.3	171.2	-53	175.4	-37.3	0	0	117.9
263	I	29	Very low	27.5	Very low	163 Å²	163	140.8 Å²	140.8	84%	0.836	79%	0.792	S	S	*	*			trans	-138.4	101.2	132.8	-71.9	100.1	0	0	0	105
264	H	27.2	Very low	27.4	Very low	161 Å²	161	142.1 Å²	142.1	75%	0.745	79%	0.794	S	S	*	*				64.6	129.4	74.5	-101.5	-93.4	0	0	0	116.7
265	H	26.4	Very low	27.3	Very low	173 Å²	173	139.5 Å²	139.5	80%	0.801	79%	0.793	S	S	*	*			trans	-42.1	138.4	-178.9	-74.8	-95.1	0	0	0	116.2
266	I	27.1	Very low	27.1	Very low	135 Å²	135	137.5 Å²	137.5	69%	0.692	79%	0.787	S	S	*	*			trans	-136.9	113.8	146.7	-51.7	-179.9	0	0	0	108.6	F268	I266-F268 HydrophobicContact CG2-CD2 3.65Å; I266-F268 HydrophobicContact CG2-CE2 3.56Å
267	P	26.2	Very low	27.1	Very low	108 Å²	108	141.8 Å²	141.8	70%	0.701	79%	0.785	S	S	*	*			trans	-87.6	145.9	167.9	34.6	-31.4	0	0	0	110.7
268	F	30	Very low	27	Very low	191 Å²	191	143.8 Å²	143.8	84%	0.838	79%	0.788	S	S	*	*			trans	-137.6	133.8	167.9	-97.1	-76.2	0	0	0	112.1	I266	I266-F268 HydrophobicContact CG2-CD2 3.65Å; I266-F268 HydrophobicContact CG2-CE2 3.56Å
269	N	25.9	Very low	27.1	Very low	157 Å²	157	143.4 Å²	143.4	84%	0.84	78%	0.779	S	S	*	*			trans	-79.4	160.2	177.7	-75.5	-13.4	0	0	0	111.9	T271	N269-T271 PolarHBondContact O-N 3.21Å
270	D	26.3	Very low	27.3	Very low	158 Å²	158	144 Å²	144	85%	0.845	77%	0.774	S	S	*	*			trans	-51.9	131.8	162.2	-66.3	-71.6	0	0	0	112.6
271	T	27.2	Very low	27.4	Very low	126 Å²	126	146.8 Å²	146.8	77%	0.773	77%	0.769	S	S	*	*				-175.4	125.2	120.5	-73.7	0	0	0	0	109.9	N269	N269-T271 PolarHBondContact O-N 3.21Å
272	S	26.7	Very low	27.5	Very low	106 Å²	106	151.1 Å²	151.1	74%	0.741	78%	0.776	S	S	*	*			trans	54.2	119.3	166.3	65.5	0	0	0	0	119.5
273	V	29.6	Very low	27.5	Very low	142 Å²	142	147.8 Å²	147.8	86%	0.861	76%	0.764	S	S	*	*				-160	152.8	106.2	141.1	0	0	0	0	108.6
274	Q	25.2	Very low	27.5	Very low	172 Å²	172	145.7 Å²	145.7	80%	0.804	75%	0.753	S	S	*	*			trans	-101.6	166.2	-176.5	-67.5	177.7	-27.5	0	0	112.4
275	A	25.8	Very low	27.6	Very low	94 Å²	94	142.4 Å²	142.4	78%	0.777	74%	0.737	S	S	*	*			trans	67.3	94.3	160.2	0	0	0	0	0	118.6
276	V	28	Very low	27.6	Very low	136 Å²	136	137 Å²	137	82%	0.824	73%	0.728	S	S	*	*				-135.6	132.9	96.4	-179.3	0	0	0	0	107.6
277	R	27.1	Very low	27.7	Very low	212 Å²	212	140.6 Å²	140.6	80%	0.8	73%	0.734	S	S	*	*			trans	-143.6	74.7	-178.9	-151	176.3	-167.3	177.1	3.1	111.1
278	S	29.5	Very low	27.7	Very low	113 Å²	113	142.1 Å²	142.1	79%	0.79	74%	0.736	S	S	*	*			trans	-77.4	138.9	175.8	-61.9	0	0	0	0	110.7
279	K	30	Very low	27.4	Very low	140 Å²	140	140 Å²	140	61%	0.609	74%	0.739	S	S	*	*			trans	-96.2	136.4	-172.3	-58.6	176.4	179.6	178.6	0	112	C393	K279-C393 PolarHBondContact NZ-SG 3.03Å
280	K	28.7	Very low	27.7	Very low	167 Å²	167	137.4 Å²	137.4	73%	0.726	73%	0.733	S	S	*	*			trans	-163.9	153.6	151.2	-123.2	169	177.3	-170.9	0	111.6
281	Y	27.8	Very low	27.9	Very low	180 Å²	180	136.8 Å²	136.8	71%	0.706	73%	0.73	S	S	*	*			trans	63.3	51.9	168.9	-51.4	-61.7	0	0	0	119.3
282	E	26.5	Very low	27.9	Very low	168 Å²	168	134.9 Å²	134.9	79%	0.785	72%	0.722	S	S	*	*			trans	-102.1	87.9	143.1	-77.2	-171.6	149.2	0	0	109.2
283	N	26.2	Very low	27.9	Very low	101 Å²	101	137.2 Å²	137.2	54%	0.54	73%	0.725	S	S	.	*			trans	-161.8	74.5	164.2	-127.9	11.4	0	0	0	111.4	E401	N283-E401 PolarHBondContact ND2-OE1 3.4Å
284	I	30	Very low	27.8	Very low	120 Å²	120	135.1 Å²	135.1	62%	0.615	72%	0.717	S	S	*	*	S	Bend	trans	-174.1	132	158.8	-97.1	148.8	0	0	0	106.7
285	F	29.2	Very low	27.9	Very low	92 Å²	92	133.9 Å²	133.9	40%	0.404	72%	0.716	S	S	.	*	S	Bend	trans	68.2	74.5	-174	-47.8	-53.7	0	0	0	117.8	N60 L63 R184	N60-F285 VanDerWaalsContact OD1-CZ 3.26Å; N60-F285 WeakPolarHBondContact OD1-CZ 3.13Å; L63-F285 HydrophobicContact CB-CE1 4.15Å; L63-F285 HydrophobicContact CD1-CD1 4.1Å; L63-F285 HydrophobicContact CD1-CE1 3.36Å; L63-F285 HydrophobicContact CD1-CE2 3.93Å; L63-F285 HydrophobicContact CD1-CZ 3.25Å; L63-F285 HydrophobicContact CG-CE1 4.26Å; L63-F285 HydrophobicContact CG-CZ 4.47Å; R184-F285 VanDerWaalsContact NH1-CB 3.31Å; R184-F285 VanDerWaalsContact NH1-CD2 3.33Å; R184-F285 VanDerWaalsContact NH1-CG 3.34Å
286	G	25.4	Very low	28	Very low	59 Å²	59	135.2 Å²	135.2	61%	0.608	71%	0.714	S	S	*	*			trans	-157.7	100.2	160.2	0	0	0	0	0	113.7
287	Y	29.8	Very low	28	Very low	210 Å²	210	137.9 Å²	137.9	82%	0.824	71%	0.714	S	S	*	*			trans	-149.4	96.9	157.5	-80.2	-56	0	0	0	112.3
288	N	26.7	Very low	28.1	Very low	141 Å²	141	132.6 Å²	132.6	75%	0.754	71%	0.71	S	S	*	*			trans	48.1	113.5	137.8	-51.8	-5.6	0	0	0	120.2
289	T	24.2	Very low	28	Very low	146 Å²	146	135 Å²	135	90%	0.896	71%	0.708	S	S	*	*			trans	-111.9	111	157.2	49.6	0	0	0	0	110.7
290	S	31.1	Very low	27.9	Very low	103 Å²	103	134.3 Å²	134.3	72%	0.72	71%	0.711	S	S	*	*			trans	-170.7	137	173.3	56.4	0	0	0	0	109.7
291	D	30.1	Very low	28	Very low	145 Å²	145	132.4 Å²	132.4	78%	0.775	71%	0.709	S	S	*	*			cis	-156.7	166.5	-15.8	-143.5	-40.9	0	0	0	110.8
292	S	27.1	Very low	28	Very low	86 Å²	86	131.7 Å²	131.7	60%	0.601	71%	0.712	S	S	*	*			trans	-8.2	134.6	161.9	-61.2	0	0	0	0	122.6
293	L	27.4	Very low	28.2	Very low	154 Å²	154	130.4 Å²	130.4	81%	0.806	71%	0.711	S	S	*	*			trans	71	129.6	139.5	-89.7	77.1	0	0	0	122.4
294	S	27	Very low	28.5	Very low	98 Å²	98	132.9 Å²	132.9	69%	0.685	72%	0.724	S	S	*	*			trans	39.7	142.9	141.2	67.3	0	0	0	0	121.5
295	N	28.1	Very low	28.8	Very low	147 Å²	147	132.1 Å²	132.1	79%	0.786	73%	0.725	S	S	*	*			cis	-164.1	-176	39.8	-145.3	-2.3	0	0	0	114.7
296	V	28.8	Very low	29	Very low	121 Å²	121	134.3 Å²	134.3	73%	0.733	74%	0.741	S	S	*	*			trans	-29	147.2	177.5	176.9	0	0	0	0	119.4
297	K	26.4	Very low	29.3	Very low	193 Å²	193	136.8 Å²	136.8	84%	0.839	74%	0.744	S	S	*	*			trans	-27.8	153.2	160.6	-50	169.9	-178.6	174	0	114.5
298	S	28.9	Very low	29.5	Very low	100 Å²	100	133.1 Å²	133.1	70%	0.699	74%	0.738	S	S	*	*				-176.3	154	51.7	54.8	0	0	0	0	115.2
299	H	29.5	Very low	29.7	Very low	163 Å²	163	132.4 Å²	132.4	76%	0.755	74%	0.735	S	S	*	*			trans	55.5	113.6	146.8	-79.7	-61	0	0	0	121.8
300	N	27	Very low	30	Very low	127 Å²	127	131.7 Å²	131.7	68%	0.679	73%	0.725	S	S	*	*				85.5	136.9	121.6	-77.6	34	0	0	0	122.2
301	N	30.4	Very low	29.9	Very low	126 Å²	126	131.8 Å²	131.8	67%	0.674	72%	0.721	S	S	*	*			trans	66.8	114.1	158.7	-59	25.9	0	0	0	114.8
302	E	27.6	Very low	30	Very low	166 Å²	166	132.5 Å²	132.5	78%	0.776	72%	0.72	S	S	*	*				85.1	140.3	62.8	-75.9	179.7	149.9	0	0	112.9
303	D	31.3	Very low	30.2	Very low	141 Å²	141	132.7 Å²	132.7	75%	0.754	72%	0.721	S	S	*	*			trans	73.9	101.6	163.7	-52.8	-17.3	0	0	0	120.7
304	D	32.8	Very low	30.3	Very low	152 Å²	152	131.4 Å²	131.4	81%	0.813	72%	0.72	S	S	*	*				99.9	142.6	113.1	-97	-11.2	0	0	0	125.2
305	V	35.2	Very low	30.6	Very low	105 Å²	105	134 Å²	134	64%	0.636	73%	0.731	S	S	*	*			trans	73.7	112.1	150.5	173.2	0	0	0	0	120.7
306	D	33.4	Very low	30.6	Very low	138 Å²	138	136.2 Å²	136.2	74%	0.738	73%	0.734	S	S	*	*				34	157.8	126.2	-41.9	-33.9	0	0	0	121.4
307	T	33.1	Very low	30.9	Very low	110 Å²	110	137.1 Å²	137.1	68%	0.675	74%	0.74	S	S	*	*			cis	-160.6	161	25.7	-18.1	0	0	0	0	111.2
308	D	33.4	Very low	31	Very low	133 Å²	133	135.2 Å²	135.2	71%	0.711	73%	0.734	S	S	*	*			trans	42	148.5	134.7	-76.8	18.8	0	0	0	122.5
309	N	30.1	Very low	31.3	Very low	126 Å²	126	137.1 Å²	137.1	67%	0.674	74%	0.741	S	S	*	*			cis	-169.1	162	23.4	-133.8	-38.9	0	0	0	115.5
310	L	30.3	Very low	31.4	Very low	131 Å²	131	133.8 Å²	133.8	69%	0.686	73%	0.729	S	S	*	*			trans	67.7	102.5	134.5	-151.4	65.1	0	0	0	124.4
311	T	30.6	Very low	31.7	Very low	105 Å²	105	134.8 Å²	134.8	64%	0.644	73%	0.729	S	S	*	*				33.2	163.3	128.8	75.8	0	0	0	0	122.7
312	Q	31.5	Very low	31.5	Very low	161 Å²	161	134 Å²	134	75%	0.752	73%	0.729	S	S	*	*			cis	-176.6	166.7	47.8	-145.7	166.1	96.4	0	0	114.7
313	S	30.4	Very low	31.7	Very low	89 Å²	89	133 Å²	133	62%	0.622	73%	0.728	S	S	*	*			trans	66.2	120.5	158.2	-55.4	0	0	0	0	119.3
314	T	30.4	Very low	31.5	Very low	127 Å²	127	132.8 Å²	132.8	78%	0.779	73%	0.732	S	S	*	*			cis	95.7	124.8	26.6	68.9	0	0	0	0	117
315	T	33.7	Very low	31.3	Very low	152 Å²	152	133.3 Å²	133.3	93%	0.933	73%	0.73	S	S	*	*			trans	-166.1	163.3	135.7	9.3	0	0	0	0	111.2
316	K	28.4	Very low	31	Very low	194 Å²	194	136.5 Å²	136.5	84%	0.843	74%	0.741	S	S	*	*			trans	-111.8	168.3	-169	-57.6	179.7	178.1	-176.8	0	113
317	V	33.8	Very low	30.6	Very low	141 Å²	141	135 Å²	135	86%	0.855	74%	0.737	S	S	*	*				-171.4	143	124.4	141.7	0	0	0	0	110.6
318	E	29.2	Very low	30.3	Very low	153 Å²	153	136.7 Å²	136.7	72%	0.715	74%	0.742	S	S	*	*			trans	-119.7	161.4	175.5	-66.2	176	121.8	0	0	110.9
319	T	35.3	Very low	30	Very low	139 Å²	139	136.9 Å²	136.9	85%	0.853	75%	0.749	S	S	*	*			trans	-165.5	170.8	144.6	4.5	0	0	0	0	112.2
320	N	30.8	Very low	29.8	Very low	93 Å²	93	136.7 Å²	136.7	50%	0.497	76%	0.756	S	S	.	*			trans	-120.9	165	-150.8	-64.3	-54.6	0	0	0	116.5
321	H	33	Very low	29.8	Very low	148 Å²	148	138.2 Å²	138.2	69%	0.685	76%	0.764	S	S	*	*			trans	16.6	151.7	150.9	-48.1	-54	0	0	0	121
322	T	26.2	Very low	29.6	Very low	110 Å²	110	139 Å²	139	68%	0.675	77%	0.769	S	S	*	*			cis	-166.3	172.1	44.7	-34.5	0	0	0	0	113.1	Q427	T322-Q427 PolarHBondContact OG1-NE2 3.14Å
323	L	32.2	Very low	29.5	Very low	144 Å²	144	138.9 Å²	138.9	75%	0.754	77%	0.773	S	S	*	*			trans	-76.3	151.9	-179.5	-173.7	79.6	0	0	0	115.6
324	T	27.4	Very low	29.3	Very low	137 Å²	137	142.7 Å²	142.7	84%	0.84	78%	0.781	S	S	*	*			trans	-158.7	165	145.5	6.3	0	0	0	0	114.1
325	H	28.1	Very low	29.3	Very low	163 Å²	163	144.3 Å²	144.3	76%	0.755	78%	0.783	S	S	*	*			trans	-87.3	165.3	-174.7	-58.6	-110.5	0	0	0	114.4
326	I	28.9	Very low	29	Very low	172 Å²	172	140 Å²	140	88%	0.882	77%	0.769	S	S	*	*				-158.6	152.3	126.3	-102.9	154.2	0	0	0	110
327	T	25.7	Very low	29	Very low	107 Å²	107	136.8 Å²	136.8	66%	0.656	76%	0.761	S	S	*	*			trans	-111.5	163.5	-177.8	47.3	0	0	0	0	112.1
328	N	27	Very low	28.8	Very low	145 Å²	145	139.3 Å²	139.3	78%	0.775	76%	0.76	S	S	*	*			trans	47.7	115.4	156.6	-58.7	-3.2	0	0	0	119
329	T	27.4	Very low	28.9	Very low	138 Å²	138	135.8 Å²	135.8	85%	0.847	76%	0.757	S	S	*	*				-164.6	144.8	108.8	21.3	0	0	0	0	110.9
330	C	25.6	Very low	28.6	Very low	122 Å²	122	134 Å²	134	82%	0.824	75%	0.75	S	S	*	*			trans	-79	139.5	147.7	-67.1	0	0	0	0	106.9
331	D	29.3	Very low	28.7	Very low	162 Å²	162	135.7 Å²	135.7	87%	0.866	76%	0.764	S	S	*	*			trans	-151.2	148.3	141.1	-121.8	-33.5	0	0	0	112.1
332	V	26.7	Very low	28.4	Very low	122 Å²	122	135 Å²	135	74%	0.739	77%	0.77	S	S	*	*			trans	-88.8	140.7	179.4	170.5	0	0	0	0	108.7
333	L	29.4	Very low	28.9	Very low	159 Å²	159	135.7 Å²	135.7	83%	0.832	78%	0.777	S	S	*	*			trans	-158.8	142.1	139.6	-109	169.8	0	0	0	112.1
334	Q	27.9	Very low	28.7	Very low	168 Å²	168	133.3 Å²	133.3	79%	0.785	78%	0.778	S	S	*	*			trans	-86.9	-167.7	171.5	-65	-178	-18.5	0	0	110.5
335	I	29.4	Very low	28.9	Very low	162 Å²	162	130.5 Å²	130.5	83%	0.831	77%	0.768	S	S	*	*			trans	83.8	122.2	174.5	-46.3	155.4	0	0	0	112.9
336	G	27.6	Very low	29.1	Very low	61 Å²	61	129.8 Å²	129.8	63%	0.629	78%	0.776	S	S	*	*			cis	160.1	155.5	-11.9	0	0	0	0	0	114.5
337	N	29.2	Very low	29	Very low	127 Å²	127	126.1 Å²	126.1	68%	0.679	77%	0.771	S	S	*	*			trans	66	114.5	162	-73.1	-62.5	0	0	0	120.9
338	K	28.5	Very low	29.5	Very low	194 Å²	194	127.9 Å²	127.9	84%	0.843	78%	0.782	S	S	*	*				71.5	153.4	129.3	-59.4	167.8	-177.7	163	0	117
339	A	31.1	Very low	29.7	Very low	79 Å²	79	127.2 Å²	127.2	65%	0.653	78%	0.784	S	S	*	*			cis	-148.2	171.8	9.4	0	0	0	0	0	112.7
340	S	28.5	Very low	30	Very low	100 Å²	100	130.4 Å²	130.4	70%	0.699	79%	0.786	S	S	*	*			trans	29.4	140.2	138	64.4	0	0	0	0	121.2
341	T	32.9	Very low	30.5	Very low	129 Å²	129	129.1 Å²	129.1	79%	0.791	78%	0.784	S	S	*	*			cis	-171.4	153.1	5.3	11.5	0	0	0	0	109.3
342	T	28.3	Very low	30.7	Very low	133 Å²	133	129.2 Å²	129.2	82%	0.816	78%	0.784	S	S	*	*			trans	-105.1	155.9	152	52.2	0	0	0	0	109.6
343	P	36	Very low	31	Very low	126 Å²	126	133.4 Å²	133.4	82%	0.818	79%	0.793	S	S	*	*				-142.7	-177.8	106.7	39.1	-25.3	0	0	0	114.6
344	A	28.1	Very low	31.3	Very low	94 Å²	94	129.7 Å²	129.7	78%	0.777	79%	0.785	S	S	*	*			trans	-62.9	175.9	174.9	0	0	0	0	0	112.8
345	A	31.2	Very low	31.6	Very low	77 Å²	77	128.5 Å²	128.5	64%	0.636	79%	0.788	S	S	*	*			cis	-170	176.2	33.3	0	0	0	0	0	115.1
346	T	31.7	Very low	32.3	Very low	148 Å²	148	126.1 Å²	126.1	91%	0.908	78%	0.784	S	S	*	*			trans	66.2	141.8	153.5	41.9	0	0	0	0	120.3
347	A	28.8	Very low	32.5	Very low	96 Å²	96	131.3 Å²	131.3	79%	0.793	79%	0.792	S	S	*	*			trans	-110.7	161.6	177.8	0	0	0	0	0	112.3
348	T	35.5	Very low	32.8	Very low	144 Å²	144	132.5 Å²	132.5	88%	0.883	80%	0.797	S	S	*	*			trans	-129.8	165	171.6	45.9	0	0	0	0	111
349	T	31.6	Very low	33	Very low	131 Å²	131	127.2 Å²	127.2	80%	0.804	79%	0.789	S	S	*	*			trans	-139.4	171	-156	-24.7	0	0	0	0	113.3
350	K	33	Very low	33.3	Very low	204 Å²	204	132.2 Å²	132.2	89%	0.887	80%	0.796	S	S	*	*			trans	92.1	152.7	170.3	-52.6	170.3	179.6	175.8	0	114.6
351	A	35.6	Very low	33.5	Very low	95 Å²	95	133 Å²	133	79%	0.785	80%	0.797	S	S	*	*			cis	-151.5	177.6	3.5	0	0	0	0	0	113.6
352	N	33.1	Very low	33.6	Very low	165 Å²	165	133 Å²	133	88%	0.882	79%	0.792	S	S	*	*			trans	-110.3	163.2	-172.5	-64.9	-22	0	0	0	115.9
353	K	34.5	Very low	33.8	Very low	210 Å²	210	132.6 Å²	132.6	91%	0.913	79%	0.785	S	S	*	*			trans	-165	165.5	157.4	-97.5	-176.4	176.5	180	0	110.4
354	A	34.6	Very low	33.6	Very low	80 Å²	80	133.2 Å²	133.2	66%	0.661	78%	0.78	S	S	*	*			cis	-175.6	131.5	-38.6	0	0	0	0	0	113.5
355	V	34.3	Very low	33.8	Very low	143 Å²	143	134.1 Å²	134.1	87%	0.867	78%	0.776	S	S	*	*			trans	78.9	149.9	138.1	173.3	0	0	0	0	120.6
356	P	44.4	Very low	33.7	Very low	112 Å²	112	137.3 Å²	137.3	73%	0.727	78%	0.782	S	S	*	*			trans	-138	-165.4	-151.9	44.5	-24.6	0	0	0	118.6
357	E	32.3	Very low	33.7	Very low	171 Å²	171	136.8 Å²	136.8	80%	0.799	78%	0.779	S	S	*	*			trans	109.5	126.5	143.5	-152.9	-176.9	159	0	0	122.3
358	L	34.3	Very low	33.7	Very low	152 Å²	152	138.6 Å²	138.6	80%	0.796	78%	0.78	S	S	*	*			trans	158.3	126	142.8	-105	67.9	0	0	0	108.4
359	A	34.5	Very low	33.3	Very low	82 Å²	82	138.4 Å²	138.4	68%	0.678	77%	0.774	S	S	*	*				76.4	133.1	59.7	0	0	0	0	0	113.5
360	K	36.8	Very low	33.4	Very low	185 Å²	185	138.6 Å²	138.6	80%	0.804	77%	0.77	S	S	*	*			cis	-153	164.2	15.7	-65.2	-178.8	177.5	-179.9	0	113.1
361	T	31.8	Very low	33.3	Very low	115 Å²	115	137.5 Å²	137.5	71%	0.706	77%	0.767	S	S	*	*			trans	40	134.2	144.9	56.4	0	0	0	0	120.4
362	N	35.1	Very low	32.8	Very low	131 Å²	131	140.8 Å²	140.8	70%	0.701	77%	0.765	S	S	*	*			cis	-167.3	-166.6	3	-115.5	29.7	0	0	0	105.8
363	D	33.3	Very low	32.4	Very low	124 Å²	124	141.4 Å²	141.4	66%	0.663	76%	0.759	S	S	*	*			cis	-166.2	170.5	2.8	-119.9	-31.5	0	0	0	106.3
364	I	32.2	Very low	32	Very low	138 Å²	138	143.4 Å²	143.4	71%	0.708	76%	0.761	S	S	*	*			cis	-161.6	169.7	-8.4	-159.2	170	0	0	0	108.7
365	V	32.7	Very low	31.6	Very low	114 Å²	114	149.1 Å²	149.1	69%	0.691	77%	0.771	S	S	*	*			trans	71.9	125.1	166.8	170.4	0	0	0	0	119.3
366	D	27.6	Very low	31.3	Very low	143 Å²	143	146.9 Å²	146.9	77%	0.765	76%	0.762	S	S	*	*			trans	69.3	133.2	157.9	-71.6	-11	0	0	0	125.5
367	T	32.7	Very low	30.9	Very low	138 Å²	138	143.7 Å²	143.7	85%	0.847	74%	0.742	S	S	*	*			trans	59.7	106.3	166.2	47.8	0	0	0	0	118.7
368	T	27.7	Very low	31.2	Very low	133 Å²	133	139.9 Å²	139.9	82%	0.816	73%	0.734	S	S	*	*			trans	-122.3	129.6	170.3	50.2	0	0	0	0	111
369	D	28.7	Very low	31.3	Very low	141 Å²	141	136.7 Å²	136.7	75%	0.754	72%	0.724	S	S	*	*				-164.1	124.7	123.5	-119.6	2.2	0	0	0	115
370	N	31.8	Very low	31.4	Very low	135 Å²	135	137.1 Å²	137.1	72%	0.722	72%	0.715	S	S	*	*			trans	55.3	76.5	146	-57.9	-44	0	0	0	121.1
371	H	31.9	Very low	31.9	Very low	180 Å²	180	132.9 Å²	132.9	83%	0.833	70%	0.7	S	S	*	*			trans	-53.9	127.8	140.8	-140	-91.4	0	0	0	110.4
372	F	24.5	Very low	32.8	Very low	165 Å²	165	131.4 Å²	131.4	72%	0.724	69%	0.687	S	S	*	*			trans	177.7	138.7	132.9	-116.7	-118.7	0	0	0	115.2
373	K	24.8	Very low	33.4	Very low	178 Å²	178	128.5 Å²	128.5	77%	0.774	68%	0.677	S	S	*	*			trans	35.1	106.1	157.8	-69	177.1	-177.1	168	0	118.6
374	R	27.2	Very low	34.2	Very low	252 Å²	252	126 Å²	126	95%	0.951	67%	0.666	S	S	*	*			trans	-139.2	142.2	131.9	-119.2	164.4	-108.1	-154.1	-2.7	109.7
375	K	25.8	Very low	35.2	Very low	199 Å²	199	127.5 Å²	127.5	87%	0.865	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-72.2	130.1	176.1	-59.8	174.5	-178.6	178.4	0	107.1	S377	K375-S377 PolarHBondContact O-N 3.48Å
376	S	27.7	Very low	36.5	Very low	96 Å²	96	125.8 Å²	125.8	67%	0.671	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-59.3	125.8	159.9	37.9	0	0	0	0	107.6
377	S	36.1	Very low	37.7	Very low	46 Å²	46	123.2 Å²	123.2	32%	0.322	63%	0.634	S	S	.	*	P	Polyproline II helix	trans	-79.4	155.3	176.1	76.9	0	0	0	0	109.4	K375 C379 D380	K375-S377 PolarHBondContact O-N 3.48Å; S377-C379 PolarHBondContact O-N 3.11Å; S377-C379 WeakPolarHBondContact OG-CB 3.47Å; S377-C379 PolarHBondContact OG-N 3.29Å; S377-D380 WeakPolarHBondContact CA-OD2 3.32Å; S377-D380 VanDerWaalsContact CB-OD2 3.3Å; S377-D380 WeakPolarHBondContact CB-OD2 3.26Å; S377-D380 PolarHBondContact N-OD2 2.97Å; S377-D380 PolarHBondContact O-N 3.27Å; S377-D380 PolarHBondContact OG-N 2.79Å; S377-D380 PolarHBondContact OG-OD2 2.87Å
378	S	37.3	Very low	39	Very low	90 Å²	90	121.9 Å²	121.9	63%	0.629	62%	0.62	S	S	*	*	H	α-helix	trans	-59.8	-25.7	169.4	39	0	0	0	0	111.8	I382	S378-I382 WeakPolarHBondContact O-CB 3.44Å; S378-I382 WeakPolarHBondContact O-CD1 3.42Å; S378-I382 WeakPolarHBondContact O-CG1 3.3Å; S378-I382 PolarHBondContact O-N 3.37Å
379	C	36.7	Very low	40.3	Very low	85 Å²	85	117.9 Å²	117.9	57%	0.574	60%	0.601	S	S	*	*	H	α-helix	trans	-65.9	-35.7	175.4	-63.2	0	0	0	0	113.2	S377 I382 S383	S377-C379 PolarHBondContact O-N 3.11Å; S377-C379 WeakPolarHBondContact OG-CB 3.47Å; S377-C379 PolarHBondContact OG-N 3.29Å; C379-I382 PolarHBondContact O-N 3.42Å; C379-S383 VanDerWaalsContact O-CB 3.27Å; C379-S383 WeakPolarHBondContact O-CB 3.37Å; C379-S383 PolarHBondContact O-N 3.49Å
380	D	38.2	Very low	41.8	Very low	92 Å²	92	114.4 Å²	114.4	49%	0.492	58%	0.582	S	S	.	*	H	α-helix	trans	-67.7	-40.1	-179.2	-52.5	-56.5	0	0	0	111.3	S377 T384	S377-D380 WeakPolarHBondContact CA-OD2 3.32Å; S377-D380 VanDerWaalsContact CB-OD2 3.3Å; S377-D380 WeakPolarHBondContact CB-OD2 3.26Å; S377-D380 PolarHBondContact N-OD2 2.97Å; S377-D380 PolarHBondContact O-N 3.27Å; S377-D380 PolarHBondContact OG-N 2.79Å; S377-D380 PolarHBondContact OG-OD2 2.87Å; D380-T384 PolarHBondContact O-N 2.94Å; D380-T384 VanDerWaalsContact O-N 3.15Å; D380-T384 PolarHBondContact O-OG1 3.39Å
381	I	45.4	Very low	42.9	Very low	96 Å²	96	115.2 Å²	115.2	49%	0.492	57%	0.574	S	S	.	*	H	α-helix	trans	-72.1	-40.1	176.2	-57.8	176.1	0	0	0	110.6	T384 Y385	I381-T384 PolarHBondContact O-OG1 3.49Å; I381-T384 VanDerWaalsContact O-OG1 3.11Å; I381-Y385 HydrophobicContact CG2-CD2 4.47Å; I381-Y385 WeakPolarHBondContact O-CB 3.25Å; I381-Y385 PolarHBondContact O-N 3.2Å
382	I	52.4	Low	44	Very low	84 Å²	84	110 Å²	110	43%	0.431	56%	0.558	S	S	.	*	H	α-helix	trans	-65.2	-38.8	174.9	-72	165.8	0	0	0	111.1	S378 C379 Y385 L386	S378-I382 WeakPolarHBondContact O-CB 3.44Å; S378-I382 WeakPolarHBondContact O-CD1 3.42Å; S378-I382 WeakPolarHBondContact O-CG1 3.3Å; S378-I382 PolarHBondContact O-N 3.37Å; C379-I382 PolarHBondContact O-N 3.42Å; I382-Y385 PolarHBondContact O-N 2.76Å; I382-L386 HydrophobicContact CG2-CD1 4.26Å; I382-L386 WeakPolarHBondContact O-CB 3.43Å; I382-L386 PolarHBondContact O-N 3.35Å
383	S	47.2	Very low	45.3	Very low	70 Å²	70	103.4 Å²	103.4	49%	0.49	53%	0.533	S	S	.	.	H	α-helix	trans	-64.9	-45.6	178.7	-168.2	0	0	0	0	111.7	C379 L386 E387	C379-S383 VanDerWaalsContact O-CB 3.27Å; C379-S383 WeakPolarHBondContact O-CB 3.37Å; C379-S383 PolarHBondContact O-N 3.49Å; S383-L386 PolarHBondContact O-N 2.98Å; S383-E387 PolarHBondContact O-N 3.3Å
384	T	49.7	Very low	46.8	Very low	71 Å²	71	98.7 Å²	98.7	44%	0.436	52%	0.515	S	S	.	.	H	α-helix	trans	-67.7	-37.4	176.5	42.7	0	0	0	0	112.3	D380 I381 E387 I388	D380-T384 PolarHBondContact O-N 2.94Å; D380-T384 VanDerWaalsContact O-N 3.15Å; D380-T384 PolarHBondContact O-OG1 3.39Å; I381-T384 PolarHBondContact O-OG1 3.49Å; I381-T384 VanDerWaalsContact O-OG1 3.11Å; T384-E387 PolarHBondContact O-N 2.72Å; T384-I388 WeakPolarHBondContact O-CD1 3.4Å; T384-I388 VanDerWaalsContact O-CG1 3.29Å; T384-I388 WeakPolarHBondContact O-CG1 3.37Å; T384-I388 PolarHBondContact O-N 3.07Å
385	Y	52.6	Low	47.7	Very low	170 Å²	170	93.6 Å²	93.6	67%	0.667	50%	0.502	S	S	*	.	H	α-helix	trans	-64.3	-37	170.1	-108.8	-92.1	0	0	0	112.9	I381 I382 A389	I381-Y385 HydrophobicContact CG2-CD2 4.47Å; I381-Y385 WeakPolarHBondContact O-CB 3.25Å; I381-Y385 PolarHBondContact O-N 3.2Å; I382-Y385 PolarHBondContact O-N 2.76Å; Y385-A389 VanDerWaalsContact O-CB 3.24Å; Y385-A389 WeakPolarHBondContact O-CB 3.43Å; Y385-A389 PolarHBondContact O-N 3.24Å
386	L	60.7	Low	48.7	Very low	77 Å²	77	89.7 Å²	89.7	40%	0.403	49%	0.487	S	S	.	.	H	α-helix	trans	-65.2	-46.9	173.7	-114.8	74.8	0	0	0	111.3	I382 S383 I388 A389 I390	I382-L386 HydrophobicContact CG2-CD1 4.26Å; I382-L386 WeakPolarHBondContact O-CB 3.43Å; I382-L386 PolarHBondContact O-N 3.35Å; S383-L386 PolarHBondContact O-N 2.98Å; L386-I388 VanDerWaalsContact C-N 3.31Å; L386-I388 PolarHBondContact O-N 3.19Å; L386-A389 PolarHBondContact O-N 3.23Å; L386-I390 HydrophobicContact CB-CD1 4.44Å; L386-I390 VanDerWaalsContact O-CB 3.28Å; L386-I390 WeakPolarHBondContact O-CB 3.17Å; L386-I390 WeakPolarHBondContact O-CD1 3.37Å; L386-I390 WeakPolarHBondContact O-CG1 3.41Å; L386-I390 PolarHBondContact O-N 2.78Å
387	E	53.3	Low	49.6	Very low	89 Å²	89	90.1 Å²	90.1	42%	0.416	48%	0.478	S	S	.	.	H	α-helix	trans	-56.3	-43.7	175.6	-94	-161.1	99.1	0	0	112.2	S383 T384 I390 R391	S383-E387 PolarHBondContact O-N 3.3Å; T384-E387 PolarHBondContact O-N 2.72Å; E387-I390 PolarHBondContact O-N 2.97Å; E387-R391 WeakPolarHBondContact O-CB 3.43Å; E387-R391 WeakPolarHBondContact O-CG 3.18Å; E387-R391 PolarHBondContact O-N 2.67Å; E387-R391 IonicContact OE1-CZ 3.3Å; E387-R391 IonicContact OE1-NH1 3.06Å; E387-R391 PolarHBondContact OE1-NH1 2.63Å; E387-R391 IonicContact OE1-NH2 2.64Å; E387-R391 PolarHBondContact OE1-NH2 2.78Å
388	I	58.3	Low	49.9	Very low	110 Å²	110	91.1 Å²	91.1	56%	0.564	48%	0.479	S	S	*	.	H	α-helix	trans	-67.7	-44	178.5	-67.1	165.1	0	0	0	110.5	T384 L386 I390 R391 S392	T384-I388 WeakPolarHBondContact O-CD1 3.4Å; T384-I388 VanDerWaalsContact O-CG1 3.29Å; T384-I388 WeakPolarHBondContact O-CG1 3.37Å; T384-I388 PolarHBondContact O-N 3.07Å; L386-I388 VanDerWaalsContact C-N 3.31Å; L386-I388 PolarHBondContact O-N 3.19Å; I388-I390 VanDerWaalsContact C-N 3.32Å; I388-I390 PolarHBondContact O-N 2.79Å; I388-R391 PolarHBondContact O-N 2.95Å; I388-S392 VanDerWaalsContact O-CB 3.28Å; I388-S392 WeakPolarHBondContact O-CB 3.39Å; I388-S392 PolarHBondContact O-N 3.2Å
389	A	56.1	Low	49.9	Very low	49 Å²	49	93.6 Å²	93.6	41%	0.405	48%	0.479	S	S	.	.	H	α-helix	trans	-68.8	-27.8	177.9	0	0	0	0	0	113.5	Y385 L386 C393	Y385-A389 VanDerWaalsContact O-CB 3.24Å; Y385-A389 WeakPolarHBondContact O-CB 3.43Å; Y385-A389 PolarHBondContact O-N 3.24Å; L386-A389 PolarHBondContact O-N 3.23Å; A389-C393 WeakPolarHBondContact O-CB 3.45Å; A389-C393 PolarHBondContact O-N 3.2Å
390	I	60.4	Low	49.9	Very low	69 Å²	69	94.8 Å²	94.8	35%	0.354	48%	0.476	S	S	.	.	H	α-helix	trans	-76.9	-51.4	173.3	-71.1	164.9	0	0	0	109.5	L386 E387 I388 S392 C393 I394	L386-I390 HydrophobicContact CB-CD1 4.44Å; L386-I390 VanDerWaalsContact O-CB 3.28Å; L386-I390 WeakPolarHBondContact O-CB 3.17Å; L386-I390 WeakPolarHBondContact O-CD1 3.37Å; L386-I390 WeakPolarHBondContact O-CG1 3.41Å; L386-I390 PolarHBondContact O-N 2.78Å; E387-I390 PolarHBondContact O-N 2.97Å; I388-I390 VanDerWaalsContact C-N 3.32Å; I388-I390 PolarHBondContact O-N 2.79Å; I390-S392 VanDerWaalsContact C-N 3.34Å; I390-S392 PolarHBondContact O-N 3.34Å; I390-C393 PolarHBondContact O-N 2.99Å; I390-I394 HydrophobicContact CG2-CD1 3.59Å; I390-I394 HydrophobicContact CG2-CG1 4.3Å; I390-I394 WeakPolarHBondContact O-CB 3.28Å; I390-I394 WeakPolarHBondContact O-CG1 3.36Å; I390-I394 PolarHBondContact O-N 3.31Å
391	R	54.8	Low	49.8	Very low	151 Å²	151	93.9 Å²	93.9	57%	0.57	47%	0.469	S	S	*	.	H	α-helix	trans	-54.8	-47.5	175.9	-80.4	-169.9	175.7	89.3	5	112.1	E387 I388 I394 Q395	E387-R391 WeakPolarHBondContact O-CB 3.43Å; E387-R391 WeakPolarHBondContact O-CG 3.18Å; E387-R391 PolarHBondContact O-N 2.67Å; E387-R391 IonicContact OE1-CZ 3.3Å; E387-R391 IonicContact OE1-NH1 3.06Å; E387-R391 PolarHBondContact OE1-NH1 2.63Å; E387-R391 IonicContact OE1-NH2 2.64Å; E387-R391 PolarHBondContact OE1-NH2 2.78Å; I388-R391 PolarHBondContact O-N 2.95Å; R391-I394 PolarHBondContact O-N 2.73Å; R391-Q395 VanDerWaalsContact O-CB 3.26Å; R391-Q395 WeakPolarHBondContact O-CB 3.45Å; R391-Q395 PolarHBondContact O-N 3.18Å
392	S	55	Low	49.2	Very low	71 Å²	71	98.7 Å²	98.7	50%	0.497	48%	0.481	S	S	.	.	H	α-helix	trans	-63.9	-41.9	178.9	-164.7	0	0	0	0	112	I388 I390 Q395 E396	I388-S392 VanDerWaalsContact O-CB 3.28Å; I388-S392 WeakPolarHBondContact O-CB 3.39Å; I388-S392 PolarHBondContact O-N 3.2Å; I390-S392 VanDerWaalsContact C-N 3.34Å; I390-S392 PolarHBondContact O-N 3.34Å; S392-Q395 PolarHBondContact O-N 3.26Å; S392-E396 WeakPolarHBondContact O-CB 3.39Å; S392-E396 PolarHBondContact O-N 3.2Å
393	C	50.8	Low	48.4	Very low	27 Å²	27	99.4 Å²	99.4	18%	0.182	49%	0.485	C	S	.	.	H	α-helix	trans	-71.2	-33.2	178.8	-170.4	0	0	0	0	113.1	K279 A389 I390 H397	K279-C393 PolarHBondContact NZ-SG 3.03Å; A389-C393 WeakPolarHBondContact O-CB 3.45Å; A389-C393 PolarHBondContact O-N 3.2Å; I390-C393 PolarHBondContact O-N 2.99Å; C393-H397 WeakPolarHBondContact O-CB 3.49Å; C393-H397 PolarHBondContact O-N 3.01Å
394	I	57.4	Low	47.7	Very low	79 Å²	79	98.6 Å²	98.6	41%	0.405	48%	0.48	S	S	.	.	H	α-helix	trans	-67.4	-41.8	169.7	-70.8	170.7	0	0	0	110.1	I390 R391 E396 H397 L398	I390-I394 HydrophobicContact CG2-CD1 3.59Å; I390-I394 HydrophobicContact CG2-CG1 4.3Å; I390-I394 WeakPolarHBondContact O-CB 3.28Å; I390-I394 WeakPolarHBondContact O-CG1 3.36Å; I390-I394 PolarHBondContact O-N 3.31Å; R391-I394 PolarHBondContact O-N 2.73Å; I394-E396 VanDerWaalsContact C-N 3.32Å; I394-E396 PolarHBondContact O-N 3.27Å; I394-H397 PolarHBondContact O-N 2.89Å; I394-L398 HydrophobicContact CG2-CD1 3.72Å; I394-L398 HydrophobicContact CG2-CG 4.24Å; I394-L398 VanDerWaalsContact O-CB 3.31Å; I394-L398 WeakPolarHBondContact O-CB 3.27Å; I394-L398 VanDerWaalsContact O-CG 3.26Å; I394-L398 WeakPolarHBondContact O-CG 3.38Å; I394-L398 PolarHBondContact O-N 2.87Å
395	Q	45.3	Very low	46.7	Very low	144 Å²	144	102 Å²	102	67%	0.673	50%	0.495	S	S	*	.	H	α-helix	trans	-67	-34.7	178.4	-167.9	167.4	1.3	0	0	111.9	R391 S392 F399	R391-Q395 VanDerWaalsContact O-CB 3.26Å; R391-Q395 WeakPolarHBondContact O-CB 3.45Å; R391-Q395 PolarHBondContact O-N 3.18Å; S392-Q395 PolarHBondContact O-N 3.26Å; Q395-F399 WeakPolarHBondContact O-CB 3.47Å; Q395-F399 PolarHBondContact O-N 2.79Å; Q395-F399 VanDerWaalsContact O-N 3.09Å
396	E	48.4	Very low	45.7	Very low	118 Å²	118	101.6 Å²	101.6	55%	0.551	50%	0.497	S	S	*	.	H	α-helix	trans	-71.1	-41.6	171.4	-170.5	169.7	-145.6	0	0	112.1	S392 I394 F399 Q400	S392-E396 WeakPolarHBondContact O-CB 3.39Å; S392-E396 PolarHBondContact O-N 3.2Å; I394-E396 VanDerWaalsContact C-N 3.32Å; I394-E396 PolarHBondContact O-N 3.27Å; E396-F399 WeakPolarHBondContact O-CB 3.36Å; E396-F399 PolarHBondContact O-N 2.81Å; E396-Q400 WeakPolarHBondContact O-CG 2.92Å; E396-Q400 PolarHBondContact O-N 2.78Å
397	H	45.4	Very low	44.1	Very low	104 Å²	104	106.6 Å²	106.6	48%	0.481	52%	0.516	S	S	.	.	H	α-helix	trans	-65.2	-42.1	173.2	-100.8	-56.3	0	0	0	112.6	C393 I394 F399 Q400 E401	C393-H397 WeakPolarHBondContact O-CB 3.49Å; C393-H397 PolarHBondContact O-N 3.01Å; I394-H397 PolarHBondContact O-N 2.89Å; H397-F399 PolarHBondContact O-N 2.96Å; H397-Q400 CarbonylContact O-C 3.5Å; H397-Q400 PolarHBondContact O-N 3.38Å; H397-Q400 VanDerWaalsContact O-N 3.13Å; H397-E401 WeakPolarHBondContact O-CB 3.23Å; H397-E401 WeakPolarHBondContact O-CG 3.38Å; H397-E401 PolarHBondContact O-N 3.04Å
398	L	42.7	Very low	42.9	Very low	67 Å²	67	107.6 Å²	107.6	35%	0.351	53%	0.528	S	S	.	.	H	α-helix	trans	-66	-24.3	174.2	-73.6	169.1	0	0	0	112.7	I394 R402	I394-L398 HydrophobicContact CG2-CD1 3.72Å; I394-L398 HydrophobicContact CG2-CG 4.24Å; I394-L398 VanDerWaalsContact O-CB 3.31Å; I394-L398 WeakPolarHBondContact O-CB 3.27Å; I394-L398 VanDerWaalsContact O-CG 3.26Å; I394-L398 WeakPolarHBondContact O-CG 3.38Å; I394-L398 PolarHBondContact O-N 2.87Å; L398-R402 VanDerWaalsContact O-CB 3.31Å; L398-R402 WeakPolarHBondContact O-CB 3.39Å; L398-R402 PolarHBondContact O-N 3.15Å
399	F	37.7	Very low	41.5	Very low	143 Å²	143	110 Å²	110	63%	0.627	53%	0.531	S	S	*	.	H	α-helix	trans	-78.8	-37.2	171.4	-169.2	-100.7	0	0	0	111.5	Q395 E396 H397 L403	Q395-F399 WeakPolarHBondContact O-CB 3.47Å; Q395-F399 PolarHBondContact O-N 2.79Å; Q395-F399 VanDerWaalsContact O-N 3.09Å; E396-F399 WeakPolarHBondContact O-CB 3.36Å; E396-F399 PolarHBondContact O-N 2.81Å; H397-F399 PolarHBondContact O-N 2.96Å; F399-L403 HydrophobicContact CD1-CD1 3.91Å; F399-L403 HydrophobicContact CE1-CD1 3.72Å; F399-L403 HydrophobicContact CZ-CD1 4.42Å; F399-L403 WeakPolarHBondContact O-CG 3.45Å; F399-L403 PolarHBondContact O-N 3.44Å
400	Q	36.6	Very low	40	Very low	109 Å²	109	115.4 Å²	115.4	51%	0.509	55%	0.553	S	S	.	*	H	α-helix	trans	-71	-40.4	173	-70.9	-171.9	27.3	0	0	112.9	E396 H397 R402 L403 S404	E396-Q400 WeakPolarHBondContact O-CG 2.92Å; E396-Q400 PolarHBondContact O-N 2.78Å; H397-Q400 CarbonylContact O-C 3.5Å; H397-Q400 PolarHBondContact O-N 3.38Å; H397-Q400 VanDerWaalsContact O-N 3.13Å; Q400-R402 VanDerWaalsContact C-N 3.31Å; Q400-R402 PolarHBondContact O-N 3.34Å; Q400-L403 CarbonylContact O-C 3.46Å; Q400-L403 WeakPolarHBondContact O-CA 3.36Å; Q400-L403 WeakPolarHBondContact O-CB 3.49Å; Q400-L403 PolarHBondContact O-N 2.79Å; Q400-S404 PolarHBondContact O-N 3.08Å; Q400-S404 PolarHBondContact O-OG 3.3Å
401	E	36.4	Very low	38.5	Very low	73 Å²	73	118.5 Å²	118.5	34%	0.341	58%	0.575	S	S	.	*	H	α-helix	trans	-58	-45.6	173.9	-78	177.4	159.1	0	0	110.3	N283 H397 L403 S404 D405	N283-E401 PolarHBondContact ND2-OE1 3.4Å; H397-E401 WeakPolarHBondContact O-CB 3.23Å; H397-E401 WeakPolarHBondContact O-CG 3.38Å; H397-E401 PolarHBondContact O-N 3.04Å; E401-L403 PolarHBondContact O-N 3.47Å; E401-S404 WeakPolarHBondContact CA-OG 3.44Å; E401-S404 PolarHBondContact O-N 2.9Å; E401-S404 VanDerWaalsContact O-N 3.14Å; E401-S404 PolarHBondContact O-OG 2.94Å; E401-S404 VanDerWaalsContact O-OG 3.13Å; E401-D405 PolarHBondContact O-N 3.22Å
402	R	32.4	Very low	37.2	Very low	197 Å²	197	118.6 Å²	118.6	74%	0.743	59%	0.585	S	S	*	*	H	α-helix	trans	-67.9	-3.3	175.2	-152.6	177.6	-61.1	-170.6	-0	114.2	L398 Q400	L398-R402 VanDerWaalsContact O-CB 3.31Å; L398-R402 WeakPolarHBondContact O-CB 3.39Å; L398-R402 PolarHBondContact O-N 3.15Å; Q400-R402 VanDerWaalsContact C-N 3.31Å; Q400-R402 PolarHBondContact O-N 3.34Å
403	L	36.4	Very low	35.9	Very low	99 Å²	99	120 Å²	120	52%	0.518	59%	0.587	S	S	.	*	H	α-helix	trans	-111.6	-27.5	170.9	-72.1	168.2	0	0	0	112.9	F399 Q400 E401	F399-L403 HydrophobicContact CD1-CD1 3.91Å; F399-L403 HydrophobicContact CE1-CD1 3.72Å; F399-L403 HydrophobicContact CZ-CD1 4.42Å; F399-L403 WeakPolarHBondContact O-CG 3.45Å; F399-L403 PolarHBondContact O-N 3.44Å; Q400-L403 CarbonylContact O-C 3.46Å; Q400-L403 WeakPolarHBondContact O-CA 3.36Å; Q400-L403 WeakPolarHBondContact O-CB 3.49Å; Q400-L403 PolarHBondContact O-N 2.79Å; E401-L403 PolarHBondContact O-N 3.47Å
404	S	30.8	Very low	34.8	Very low	54 Å²	54	125 Å²	125	38%	0.378	62%	0.617	S	S	.	*	H	α-helix	trans	-78.9	-29.5	175.9	59.4	0	0	0	0	112.9	Q400 E401 F406 K407	Q400-S404 PolarHBondContact O-N 3.08Å; Q400-S404 PolarHBondContact O-OG 3.3Å; E401-S404 WeakPolarHBondContact CA-OG 3.44Å; E401-S404 PolarHBondContact O-N 2.9Å; E401-S404 VanDerWaalsContact O-N 3.14Å; E401-S404 PolarHBondContact O-OG 2.94Å; E401-S404 VanDerWaalsContact O-OG 3.13Å; S404-F406 PolarHBondContact O-N 3.18Å; S404-K407 PolarHBondContact O-N 3Å
405	D	30	Very low	33.4	Very low	142 Å²	142	127.9 Å²	127.9	76%	0.759	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	-6.7	170.4	-81.6	-10.6	0	0	0	113.7	E401	E401-D405 PolarHBondContact O-N 3.22Å
406	F	31.4	Very low	32.5	Very low	162 Å²	162	128.4 Å²	128.4	71%	0.711	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118	3.1	174.2	-120.2	-93.6	0	0	0	114.8	S404 T454	S404-F406 PolarHBondContact O-N 3.18Å; F406-T454 HydrophobicContact CE1-CG2 4.24Å; F406-T454 HydrophobicContact CZ-CG2 4.09Å
407	K	27.1	Very low	31.4	Very low	182 Å²	182	130 Å²	130	79%	0.791	66%	0.657	S	S	*	*			trans	-147.9	60.1	-173.1	-71.6	-167.2	176.2	-177.4	0	115.1	S404	S404-K407 PolarHBondContact O-N 3Å
408	V	28.6	Very low	30.5	Very low	110 Å²	110	133.9 Å²	133.9	67%	0.667	67%	0.673	S	S	*	*			trans	-135.2	82.8	165.6	-173.4	0	0	0	0	110.7
409	Y	27.3	Very low	29.7	Very low	160 Å²	160	137 Å²	137	63%	0.627	69%	0.691	S	S	*	*	S	Bend	trans	177	49.8	147.8	-97.3	-58.4	0	0	0	112.7	Y479	Y409-Y479 PolarHBondContact OH-OH 3.1Å
410	D	26.3	Very low	29.2	Very low	162 Å²	162	138.9 Å²	138.9	87%	0.866	70%	0.701	S	S	*	*			trans	-140.7	47.8	179.1	-94.2	-40.5	0	0	0	111.8
411	T	27.7	Very low	28.7	Very low	135 Å²	135	139.3 Å²	139.3	83%	0.828	72%	0.716	S	S	*	*			trans	-156.1	51.4	-173.9	-29.6	0	0	0	0	115.7
412	I	28.5	Very low	28.1	Very low	152 Å²	152	140.9 Å²	140.9	78%	0.779	74%	0.736	S	S	*	*	S	Bend	trans	-130.6	-33.3	171	-65.3	-175.8	0	0	0	113.8
413	D	26.6	Very low	27.9	Very low	101 Å²	101	139.8 Å²	139.8	54%	0.54	74%	0.742	S	S	.	*	S	Bend	trans	-103.5	40.3	-172.4	-78.9	-67.9	0	0	0	115	R465	D413-R465 IonicContact OD1-CZ 3.99Å; D413-R465 IonicContact OD1-NH2 3.56Å; D413-R465 PolarHBondContact OD1-NH2 3.06Å
414	T	27.4	Very low	27.4	Very low	131 Å²	131	138 Å²	138	80%	0.804	75%	0.748	S	S	*	*	S	Bend	trans	-146.4	26.3	177.6	-19.9	0	0	0	0	117.5
415	V	27.9	Very low	27.1	Very low	140 Å²	140	142.7 Å²	142.7	85%	0.848	77%	0.768	S	S	*	*			trans	-132.7	65.5	170.7	-163.7	0	0	0	0	112.1
416	N	27.9	Very low	26.9	Very low	155 Å²	155	142 Å²	142	83%	0.829	76%	0.764	S	S	*	*	S	Bend	trans	-151.3	134.2	158.8	-96	-53.3	0	0	0	107.6
417	N	24.9	Very low	26.9	Very low	151 Å²	151	139.4 Å²	139.4	81%	0.807	75%	0.754	S	S	*	*	S	Bend	trans	64.1	96.1	-164.2	-51.9	-48.5	0	0	0	114.8
418	F	26	Very low	26.8	Very low	186 Å²	186	138.8 Å²	138.8	82%	0.816	76%	0.757	S	S	*	*				-171.5	128.5	120.5	-103.9	-67.4	0	0	0	109.7
419	N	26.4	Very low	26.8	Very low	134 Å²	134	137.9 Å²	137.9	72%	0.717	76%	0.756	S	S	*	*			trans	61.2	118.7	158.7	-58.1	-14.1	0	0	0	116.2
420	Q	26	Very low	27	Very low	182 Å²	182	139.2 Å²	139.2	85%	0.85	77%	0.765	S	S	*	*			cis	52.7	147.8	38.1	-70.4	-166.5	-4.8	0	0	114.9
421	S	26.3	Very low	27.1	Very low	117 Å²	117	136.8 Å²	136.8	82%	0.818	76%	0.761	S	S	*	*			trans	60	111.4	-174.7	49.3	0	0	0	0	117.4
422	S	24.6	Very low	27.3	Very low	107 Å²	107	136.5 Å²	136.5	75%	0.748	75%	0.754	S	S	*	*			trans	-60.8	178.3	169.1	-39.7	0	0	0	0	114.9
423	I	26.9	Very low	27.3	Very low	173 Å²	173	139.5 Å²	139.5	89%	0.887	76%	0.757	S	S	*	*			trans	81	133.5	171.7	-46.8	152.2	0	0	0	113.1
424	G	26	Very low	27.5	Very low	62 Å²	62	138.7 Å²	138.7	64%	0.639	76%	0.759	S	S	*	*			cis	159.5	157.5	-9.6	0	0	0	0	0	113.6
425	I	26.3	Very low	27.5	Very low	153 Å²	153	139.3 Å²	139.3	79%	0.785	76%	0.758	S	S	*	*			trans	76.8	106.9	158.8	-55	176.8	0	0	0	119.4
426	N	25.9	Very low	27.6	Very low	128 Å²	128	138.5 Å²	138.5	68%	0.684	75%	0.753	S	S	*	*			trans	49.3	125	135.7	-56.3	-10	0	0	0	125.2
427	Q	29.6	Very low	27.6	Very low	107 Å²	107	138.5 Å²	138.5	50%	0.5	75%	0.753	S	S	.	*				39.7	135.8	125.3	-52.2	-175.6	11.1	0	0	122.3	T322	T322-Q427 PolarHBondContact OG1-NE2 3.14Å
428	I	26.5	Very low	27.9	Very low	168 Å²	168	137.5 Å²	137.5	86%	0.862	75%	0.752	S	S	*	*				-171.2	169.7	112.1	-96.2	160.8	0	0	0	111.1
429	S	27.1	Very low	28	Very low	92 Å²	92	134.6 Å²	134.6	64%	0.643	75%	0.752	S	S	*	*			trans	-100.9	178.8	-148.9	-51	0	0	0	0	118.3
430	K	32.5	Very low	28.1	Very low	188 Å²	188	137.5 Å²	137.5	82%	0.817	76%	0.758	S	S	*	*			trans	-66.7	155.7	-177	-49.1	164.7	-174.1	162	0	115.8
431	S	27.7	Very low	28	Very low	110 Å²	110	135 Å²	135	77%	0.769	76%	0.755	S	S	*	*			trans	-172.7	143.7	156.3	-162.1	0	0	0	0	108.5
432	D	32.5	Very low	27.9	Very low	130 Å²	130	136 Å²	136	70%	0.695	75%	0.751	S	S	*	*			cis	-159.7	-166.6	-16	-118.2	-69.4	0	0	0	112
433	Y	29.1	Very low	27.9	Very low	215 Å²	215	136.3 Å²	136.3	84%	0.843	75%	0.753	S	S	*	*			trans	-95.2	165.7	-178.6	-81.1	-108.2	0	0	0	112.6
434	S	29.6	Very low	27.8	Very low	83 Å²	83	134.4 Å²	134.4	58%	0.58	75%	0.75	S	S	*	*			cis	-167.2	-173.3	0.7	35.9	0	0	0	0	112.7
435	D	27.4	Very low	27.8	Very low	145 Å²	145	136.9 Å²	136.9	78%	0.775	76%	0.757	S	S	*	*			trans	90.6	161.1	147.1	-61.4	-52.1	0	0	0	123.5
436	V	29.6	Very low	27.7	Very low	123 Å²	123	139.4 Å²	139.4	75%	0.745	77%	0.766	S	S	*	*			trans	113.1	94.2	152.3	-171.4	0	0	0	0	119.2
437	N	29.1	Very low	27.6	Very low	155 Å²	155	137.2 Å²	137.2	83%	0.829	77%	0.765	S	S	*	*			trans	61.8	147	138.3	-66.2	-19.1	0	0	0	124.8
438	V	30.2	Very low	27.4	Very low	130 Å²	130	139.7 Å²	139.7	79%	0.788	78%	0.782	S	S	*	*			trans	-102.7	156.4	171.1	-155.3	0	0	0	0	109.3
439	P	29.1	Very low	27.3	Very low	124 Å²	124	140.1 Å²	140.1	81%	0.805	79%	0.785	S	S	*	*				-142.7	165.3	110.7	36.8	-23.2	0	0	0	114.8
440	K	28.2	Very low	27.3	Very low	195 Å²	195	145.1 Å²	145.1	85%	0.848	80%	0.795	S	S	*	*			trans	-76.6	144.3	177.7	-58.6	170.5	-178.7	172.3	0	111.5
441	T	24.6	Very low	26.9	Very low	129 Å²	129	143.4 Å²	143.4	79%	0.791	80%	0.795	S	S	*	*			trans	-172.3	136.4	137.1	11	0	0	0	0	115
442	N	23.8	Very low	26.8	Very low	138 Å²	138	143.2 Å²	143.2	74%	0.738	79%	0.794	S	S	*	*			trans	39.2	100	142.4	-60.4	1.8	0	0	0	121.9
443	S	24.5	Very low	26.5	Very low	114 Å²	114	144.5 Å²	144.5	80%	0.797	80%	0.795	S	S	*	*				47	95.3	123.9	64.8	0	0	0	0	120.2
444	V	25.2	Very low	26.5	Very low	134 Å²	134	137.7 Å²	137.7	81%	0.812	78%	0.776	S	S	*	*			trans	-136.5	124.9	151.5	180	0	0	0	0	110.8
445	S	24.7	Very low	26.5	Very low	114 Å²	114	141.2 Å²	141.2	80%	0.797	79%	0.789	S	S	*	*			trans	36	132.9	155	-54.7	0	0	0	0	122.9	A447	S445-A447 PolarHBondContact O-N 2.96Å
446	Q	25.8	Very low	27	Very low	206 Å²	206	138.2 Å²	138.2	96%	0.963	77%	0.767	S	S	*	*			trans	-64.4	106.1	170.9	-62.3	163.5	-17	0	0	113
447	A	23.9	Very low	27.6	Very low	81 Å²	81	135 Å²	135	67%	0.669	75%	0.749	S	S	*	*			trans	-161.1	157.3	157.9	0	0	0	0	0	111.8	S445	S445-A447 PolarHBondContact O-N 2.96Å
448	N	24	Very low	28.6	Very low	159 Å²	159	136 Å²	136	85%	0.85	75%	0.746	S	S	*	*			trans	54	69.9	155.5	-57.6	-16.8	0	0	0	118.8
449	L	25.7	Very low	29.6	Very low	177 Å²	177	132 Å²	132	93%	0.927	72%	0.72	S	S	*	*			trans	-151.3	62.2	154	-112.5	159.7	0	0	0	112.1
450	K	26	Very low	30.5	Very low	198 Å²	198	128.3 Å²	128.3	86%	0.861	70%	0.696	S	S	*	*			trans	-140.3	81.6	167.5	-76.1	-172.8	176.9	-178.4	0	108.7
451	N	24.4	Very low	31.2	Very low	151 Å²	151	121.8 Å²	121.8	81%	0.807	68%	0.675	S	S	*	*			trans	-153.4	87	176.1	-98.1	-22.5	0	0	0	111.4
452	S	25.1	Very low	32.1	Very low	107 Å²	107	121.4 Å²	121.4	75%	0.748	67%	0.672	S	S	*	*			trans	-152.1	52.4	163.1	49.3	0	0	0	0	108.2	T454	S452-T454 PolarHBondContact O-N 2.97Å
453	E	27.3	Very low	32.9	Very low	156 Å²	156	120.2 Å²	120.2	73%	0.729	67%	0.67	S	S	*	*			trans	-66.7	123	-173.1	-64.7	-153.6	110.2	0	0	111.7	N455	E453-N455 PolarHBondContact O-N 3.41Å; E453-N455 VanDerWaalsContact O-N 3.11Å
454	T	28.1	Very low	34	Very low	72 Å²	72	120 Å²	120	44%	0.442	66%	0.661	S	S	.	*			trans	-69.1	104.4	173.4	31.5	0	0	0	0	110.1	F406 S452 Y456	F406-T454 HydrophobicContact CE1-CG2 4.24Å; F406-T454 HydrophobicContact CZ-CG2 4.09Å; S452-T454 PolarHBondContact O-N 2.97Å; T454-Y456 PolarHBondContact O-N 3.12Å
455	N	30.1	Very low	35.1	Very low	158 Å²	158	121 Å²	121	85%	0.845	65%	0.649	S	S	*	*			trans	-56.7	129.1	171.8	-91.9	-42.1	0	0	0	110.2	E453	E453-N455 PolarHBondContact O-N 3.41Å; E453-N455 VanDerWaalsContact O-N 3.11Å
456	Y	37.9	Very low	36.2	Very low	81 Å²	81	121.2 Å²	121.2	32%	0.318	65%	0.649	S	S	.	*			trans	-84.7	136.7	165.7	-61.8	-67.3	0	0	0	108.9	T454 K458 K513	T454-Y456 PolarHBondContact O-N 3.12Å; Y456-K458 PolarHBondContact O-N 3.5Å; Y456-K513 HydrophobicContact CE2-CB 4.5Å; Y456-K513 HydrophobicContact CE2-CD 3.73Å; Y456-K513 HydrophobicContact CE2-CG 4.07Å; Y456-K513 WeakPolarHBondContact OH-CD 3.24Å; Y456-K513 PolarHBondContact OH-NZ 3.3Å
457	P	41.9	Very low	37.6	Very low	56 Å²	56	118.7 Å²	118.7	36%	0.364	64%	0.642	S	S	.	*			trans	-61.7	113.1	174.8	25.7	-33.1	0	0	0	108.8
458	K	49.8	Very low	39.3	Very low	177 Å²	177	116.9 Å²	116.9	77%	0.77	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-66.6	141.5	174.6	-73.5	179.8	177.8	174.6	0	109.2	Y456 P460	Y456-K458 PolarHBondContact O-N 3.5Å; K458-P460 WeakPolarHBondContact O-CD 3.36Å
459	L	51.2	Low	41.7	Very low	44 Å²	44	112.4 Å²	112.4	23%	0.23	60%	0.599	C	S	.	*	P	Polyproline II helix	trans	-58.2	118.8	169	-167.4	74.5	0	0	0	109.1	Y480 E523 V524	L459-Y480 HydrophobicContact CD1-CD1 4.24Å; L459-Y480 HydrophobicContact CD1-CD2 3.45Å; L459-Y480 VanDerWaalsContact CD1-CD2 3.45Å; L459-Y480 HydrophobicContact CD1-CE1 4.46Å; L459-Y480 HydrophobicContact CD1-CE2 3.69Å; L459-Y480 HydrophobicContact CD1-CG 3.76Å; L459-E523 HydrophobicContact CD2-CB 4.21Å; L459-V524 HydrophobicContact CD1-CG2 3.73Å; L459-V524 HydrophobicContact CD2-CG2 3.9Å
460	P	48.1	Very low	43.8	Very low	47 Å²	47	108 Å²	108	31%	0.305	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-63.2	148.4	176.1	-26.2	39.6	0	0	0	110.7	K458 Y480	K458-P460 WeakPolarHBondContact O-CD 3.36Å; P460-Y480 WeakPolarHBondContact CD-OH 3.43Å
461	S	42.5	Very low	45.6	Very low	58 Å²	58	103 Å²	103	41%	0.406	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-71.8	148.5	-168.1	78.1	0	0	0	0	111.1	T463 D464	S461-T463 WeakPolarHBondContact CB-OG1 3.38Å; S461-T463 PolarHBondContact O-N 2.66Å; S461-T463 PolarHBondContact OG-OG1 3.46Å; S461-D464 WeakPolarHBondContact CA-OD2 3.43Å; S461-D464 WeakPolarHBondContact CB-OD2 3.43Å; S461-D464 PolarHBondContact N-OD2 3.37Å; S461-D464 PolarHBondContact O-N 3Å; S461-D464 PolarHBondContact OG-OD1 3.05Å; S461-D464 PolarHBondContact OG-OD2 3.03Å
462	T	43.4	Very low	47.7	Very low	121 Å²	121	101.1 Å²	101.1	74%	0.742	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	35.4	176.4	56.3	0	0	0	0	112.6	T527	T462-T527 HydrophobicContact CG2-CG2 3.86Å
463	T	41.4	Very low	49.9	Very low	113 Å²	113	98.4 Å²	98.4	69%	0.693	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138	-12	-175.7	25.9	0	0	0	0	112.9	S461 R465	S461-T463 WeakPolarHBondContact CB-OG1 3.38Å; S461-T463 PolarHBondContact O-N 2.66Å; S461-T463 PolarHBondContact OG-OG1 3.46Å; T463-R465 PolarHBondContact O-N 2.88Å
464	D	46.8	Very low	52	Low	111 Å²	111	91.8 Å²	91.8	59%	0.594	49%	0.491	S	S	*	.	S	Bend	trans	-79.4	-15.3	-169.4	-65.9	-49	0	0	0	115.3	S461	S461-D464 WeakPolarHBondContact CA-OD2 3.43Å; S461-D464 WeakPolarHBondContact CB-OD2 3.43Å; S461-D464 PolarHBondContact N-OD2 3.37Å; S461-D464 PolarHBondContact O-N 3Å; S461-D464 PolarHBondContact OG-OD1 3.05Å; S461-D464 PolarHBondContact OG-OD2 3.03Å
465	R	48.2	Very low	53.8	Low	153 Å²	153	91.2 Å²	91.2	58%	0.577	49%	0.486	S	S	*	.			trans	-143.8	102.5	175.2	-64.6	-170.7	-174	-149.1	7.1	111.5	D413 T463 N467	D413-R465 IonicContact OD1-CZ 3.99Å; D413-R465 IonicContact OD1-NH2 3.56Å; D413-R465 PolarHBondContact OD1-NH2 3.06Å; T463-R465 PolarHBondContact O-N 2.88Å; R465-N467 PolarHBondContact O-N 2.88Å; R465-N467 VanDerWaalsContact O-N 3.1Å
466	P	49.5	Very low	56	Low	120 Å²	120	87.6 Å²	87.6	78%	0.779	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	1.5	-171.4	28.8	-36	0	0	0	115.9
467	N	53.5	Low	57.8	Low	153 Å²	153	84.1 Å²	84.1	82%	0.818	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.9	20	-174.9	-67.8	-44.9	0	0	0	113.6	R465	R465-N467 PolarHBondContact O-N 2.88Å; R465-N467 VanDerWaalsContact O-N 3.1Å
468	E	61.3	Low	59.3	Low	42 Å²	42	83.1 Å²	83.1	20%	0.196	44%	0.444	C	S	.	.			trans	-72	126	176.5	-166.4	-179.6	143.7	0	0	110	Q472 I473 R476	E468-Q472 HydrophobicContact CG-CB 3.88Å; E468-I473 HydrophobicContact CB-CD1 4.15Å; E468-I473 HydrophobicContact CB-CG1 3.88Å; E468-I473 HydrophobicContact CG-CG1 3.71Å; E468-I473 WeakPolarHBondContact O-CD1 3.26Å; E468-I473 WeakPolarHBondContact OE1-CA 3.35Å; E468-I473 PolarHBondContact OE1-N 3.48Å; E468-R476 IonicContact OE2-NH1 2.83Å; E468-R476 PolarHBondContact OE2-NH1 3.27Å
469	P	73.7	Confident	60.5	Low	66 Å²	66	79.6 Å²	79.6	43%	0.429	43%	0.427	S	S	.	.			trans	-69	145	-177.8	27.4	-34.5	0	0	0	111.5	D471 Q472 I473	P469-D471 PolarHBondContact O-N 3.19Å; P469-Q472 HydrophobicContact CG-CB 4.14Å; P469-Q472 HydrophobicContact CG-CG 3.82Å; P469-Q472 PolarHBondContact O-N 2.96Å; P469-I473 PolarHBondContact O-N 3.26Å
470	N	69	Low	61.7	Low	84 Å²	84	79.2 Å²	79.2	45%	0.449	42%	0.423	S	S	.	.	H	α-helix	trans	-49.4	-36.5	-173.1	-76.8	-47.8	0	0	0	114.3	I473 L474 I531	N470-I473 PolarHBondContact O-N 2.9Å; N470-L474 WeakPolarHBondContact O-CB 3.38Å; N470-L474 PolarHBondContact O-N 3.08Å; N470-I531 HydrophobicContact CB-CG2 3.97Å
471	D	64.7	Low	63.2	Low	94 Å²	94	78.2 Å²	78.2	50%	0.503	42%	0.415	S	S	.	.	H	α-helix	trans	-69.6	-31.7	178.7	-69.2	-51.4	0	0	0	114	P469 N475	P469-D471 PolarHBondContact O-N 3.19Å; D471-N475 WeakPolarHBondContact O-CB 3.33Å; D471-N475 PolarHBondContact O-N 2.8Å; D471-N475 PolarHBondContact O-ND2 3.39Å
472	Q	68.4	Low	64.6	Low	111 Å²	111	79.5 Å²	79.5	52%	0.519	42%	0.416	S	S	.	.	H	α-helix	trans	-71.1	-46.5	174	-71.9	178.3	11.1	0	0	110.1	E468 P469 L474 N475 R476	E468-Q472 HydrophobicContact CG-CB 3.88Å; P469-Q472 HydrophobicContact CG-CB 4.14Å; P469-Q472 HydrophobicContact CG-CG 3.82Å; P469-Q472 PolarHBondContact O-N 2.96Å; Q472-L474 VanDerWaalsContact C-N 3.27Å; Q472-L474 PolarHBondContact O-N 3.46Å; Q472-N475 WeakPolarHBondContact O-CB 3.41Å; Q472-N475 PolarHBondContact O-N 2.85Å; Q472-R476 WeakPolarHBondContact O-CB 3.45Å; Q472-R476 PolarHBondContact O-N 2.97Å
473	I	71.1	Confident	66.2	Low	49 Å²	49	77.1 Å²	77.1	25%	0.251	39%	0.394	S	S	.	.	H	α-helix	trans	-60.3	-40.1	175.5	-50.6	173.4	0	0	0	110.4	E468 P469 N470 S477 I531	E468-I473 HydrophobicContact CB-CD1 4.15Å; E468-I473 HydrophobicContact CB-CG1 3.88Å; E468-I473 HydrophobicContact CG-CG1 3.71Å; E468-I473 WeakPolarHBondContact O-CD1 3.26Å; E468-I473 WeakPolarHBondContact OE1-CA 3.35Å; E468-I473 PolarHBondContact OE1-N 3.48Å; P469-I473 PolarHBondContact O-N 3.26Å; N470-I473 PolarHBondContact O-N 2.9Å; I473-S477 VanDerWaalsContact O-CB 3.25Å; I473-S477 WeakPolarHBondContact O-CB 3.15Å; I473-S477 PolarHBondContact O-N 3.47Å; I473-S477 PolarHBondContact O-OG 2.69Å; I473-I531 HydrophobicContact CB-CD1 3.97Å; I473-I531 HydrophobicContact CG2-CD1 3.57Å
474	L	71.5	Confident	68	Low	17 Å²	17	71.9 Å²	71.9	9%	0.089	36%	0.362	C	S	.	.	H	α-helix	trans	-70.4	-37.2	179.3	-171.8	61.6	0	0	0	112.5	I28 N470 Q472 A478 M528	I28-L474 HydrophobicContact CD1-CB 4.5Å; I28-L474 HydrophobicContact CD1-CD2 3.7Å; I28-L474 HydrophobicContact CD1-CG 3.99Å; I28-L474 HydrophobicContact CG1-CD2 3.77Å; I28-L474 HydrophobicContact CG1-CG 4.43Å; N470-L474 WeakPolarHBondContact O-CB 3.38Å; N470-L474 PolarHBondContact O-N 3.08Å; Q472-L474 VanDerWaalsContact C-N 3.27Å; Q472-L474 PolarHBondContact O-N 3.46Å; L474-A478 WeakPolarHBondContact O-CB 3.27Å; L474-A478 PolarHBondContact O-N 3.27Å; L474-M528 HydrophobicContact CD1-CB 4.4Å; L474-M528 HydrophobicContact CD1-CE 3.59Å; L474-M528 HydrophobicContact CD1-CG 4.03Å; L474-M528 HydrophobicContact CG-CE 4.45Å
475	N	66.7	Low	69.6	Low	61 Å²	61	70 Å²	70	33%	0.326	35%	0.348	S	S	.	.	H	α-helix	trans	-63.4	-49.7	171	-79.2	-21	0	0	0	111.8	R30 D471 Q472 S477 A478 Y479	R30-N475 VanDerWaalsContact CZ-OD1 3.22Å; R30-N475 PolarHBondContact NH1-OD1 3.27Å; R30-N475 VanDerWaalsContact NH2-CG 3.34Å; R30-N475 PolarHBondContact NH2-ND2 2.7Å; R30-N475 VanDerWaalsContact NH2-ND2 3.12Å; R30-N475 PolarHBondContact NH2-OD1 2.78Å; D471-N475 WeakPolarHBondContact O-CB 3.33Å; D471-N475 PolarHBondContact O-N 2.8Å; D471-N475 PolarHBondContact O-ND2 3.39Å; Q472-N475 WeakPolarHBondContact O-CB 3.41Å; Q472-N475 PolarHBondContact O-N 2.85Å; N475-S477 VanDerWaalsContact C-N 3.3Å; N475-S477 PolarHBondContact O-N 3.44Å; N475-A478 WeakPolarHBondContact O-CB 3.23Å; N475-A478 PolarHBondContact O-N 3.19Å; N475-A478 VanDerWaalsContact O-N 3.1Å; N475-Y479 PolarHBondContact O-N 3.44Å
476	R	75.2	Confident	70.6	Confident	81 Å²	81	65.3 Å²	65.3	31%	0.306	34%	0.339	S	S	.	.	H	α-helix	trans	-58.5	-43.1	177.7	-171.8	179	-168.8	176.8	5.5	111.2	E468 Q472 Y479 Y480	E468-R476 IonicContact OE2-NH1 2.83Å; E468-R476 PolarHBondContact OE2-NH1 3.27Å; Q472-R476 WeakPolarHBondContact O-CB 3.45Å; Q472-R476 PolarHBondContact O-N 2.97Å; R476-Y479 PolarHBondContact O-N 3.09Å; R476-Y480 HydrophobicContact CG-CD2 4.14Å; R476-Y480 HydrophobicContact CG-CE2 3.71Å; R476-Y480 WeakPolarHBondContact O-CD2 3.44Å; R476-Y480 PolarHBondContact O-N 2.91Å; R476-Y480 VanDerWaalsContact O-N 3.11Å
477	S	76.5	Confident	71.9	Confident	9 Å²	9	65.1 Å²	65.1	6%	0.063	32%	0.323	C	S	.	.	H	α-helix	trans	-64.7	-40	174	-59.3	0	0	0	0	112.4	I473 N475 Y480 L481 V524 T527	I473-S477 VanDerWaalsContact O-CB 3.25Å; I473-S477 WeakPolarHBondContact O-CB 3.15Å; I473-S477 PolarHBondContact O-N 3.47Å; I473-S477 PolarHBondContact O-OG 2.69Å; N475-S477 VanDerWaalsContact C-N 3.3Å; N475-S477 PolarHBondContact O-N 3.44Å; S477-Y480 PolarHBondContact O-N 3.36Å; S477-L481 VanDerWaalsContact O-CB 3.3Å; S477-L481 WeakPolarHBondContact O-CB 3.46Å; S477-L481 PolarHBondContact O-N 2.75Å; S477-V524 WeakPolarHBondContact O-CG1 3.45Å; S477-T527 PolarHBondContact OG-OG1 2.93Å
478	A	72.9	Confident	73.4	Confident	34 Å²	34	59 Å²	59	28%	0.281	29%	0.29	S	S	.	.	H	α-helix	trans	-64.2	-40.1	175.8	0	0	0	0	0	112.3	L474 N475 L481 L482 M528	L474-A478 WeakPolarHBondContact O-CB 3.27Å; L474-A478 PolarHBondContact O-N 3.27Å; N475-A478 WeakPolarHBondContact O-CB 3.23Å; N475-A478 PolarHBondContact O-N 3.19Å; N475-A478 VanDerWaalsContact O-N 3.1Å; A478-L481 PolarHBondContact O-N 3.11Å; A478-L482 WeakPolarHBondContact O-CG 3.31Å; A478-L482 PolarHBondContact O-N 2.94Å; A478-L482 VanDerWaalsContact O-N 3.08Å; A478-M528 HydrophobicContact CB-CE 3.89Å
479	Y	75.8	Confident	74.3	Confident	104 Å²	104	60.7 Å²	60.7	41%	0.408	29%	0.294	S	S	.	.	H	α-helix	trans	-59.8	-53.3	174	172.5	-99	0	0	0	111.9	Y409 N475 R476 L481 L482 Y483	Y409-Y479 PolarHBondContact OH-OH 3.1Å; N475-Y479 PolarHBondContact O-N 3.44Å; R476-Y479 PolarHBondContact O-N 3.09Å; Y479-L481 VanDerWaalsContact C-N 3.29Å; Y479-L481 PolarHBondContact O-N 3.06Å; Y479-L482 PolarHBondContact O-N 2.96Å; Y479-L482 VanDerWaalsContact O-N 3.13Å; Y479-Y483 PolarHBondContact O-N 3.46Å
480	Y	76.5	Confident	74.6	Confident	36 Å²	36	61.8 Å²	61.8	14%	0.141	29%	0.294	C	S	.	.	H	α-helix	trans	-61.7	-36.2	177.4	-70.9	-60.7	0	0	0	112.4	L459 P460 R476 S477 L482 Y483 F484	L459-Y480 HydrophobicContact CD1-CD1 4.24Å; L459-Y480 HydrophobicContact CD1-CD2 3.45Å; L459-Y480 VanDerWaalsContact CD1-CD2 3.45Å; L459-Y480 HydrophobicContact CD1-CE1 4.46Å; L459-Y480 HydrophobicContact CD1-CE2 3.69Å; L459-Y480 HydrophobicContact CD1-CG 3.76Å; P460-Y480 WeakPolarHBondContact CD-OH 3.43Å; R476-Y480 HydrophobicContact CG-CD2 4.14Å; R476-Y480 HydrophobicContact CG-CE2 3.71Å; R476-Y480 WeakPolarHBondContact O-CD2 3.44Å; R476-Y480 PolarHBondContact O-N 2.91Å; R476-Y480 VanDerWaalsContact O-N 3.11Å; S477-Y480 PolarHBondContact O-N 3.36Å; Y480-L482 VanDerWaalsContact C-N 3.32Å; Y480-L482 PolarHBondContact O-N 2.64Å; Y480-Y483 PolarHBondContact O-N 3.08Å; Y480-F484 HydrophobicContact CD1-CZ 4.34Å; Y480-F484 WeakPolarHBondContact O-CD2 3.12Å; Y480-F484 VanDerWaalsContact O-CG 3.27Å; Y480-F484 WeakPolarHBondContact O-CG 3.18Å; Y480-F484 PolarHBondContact O-N 2.98Å
481	L	78.2	Confident	75.5	Confident	26 Å²	26	59.3 Å²	59.3	14%	0.136	28%	0.279	C	S	.	.	H	α-helix	trans	-61.9	-37.1	175.4	-176	66.6	0	0	0	112.5	S477 A478 Y479 K485 V524 Q525 M528	S477-L481 VanDerWaalsContact O-CB 3.3Å; S477-L481 WeakPolarHBondContact O-CB 3.46Å; S477-L481 PolarHBondContact O-N 2.75Å; A478-L481 PolarHBondContact O-N 3.11Å; Y479-L481 VanDerWaalsContact C-N 3.29Å; Y479-L481 PolarHBondContact O-N 3.06Å; L481-K485 HydrophobicContact CG-CD 4.38Å; L481-K485 WeakPolarHBondContact O-CB 3.3Å; L481-K485 WeakPolarHBondContact O-CD 3.48Å; L481-K485 WeakPolarHBondContact O-CG 3.45Å; L481-K485 PolarHBondContact O-N 2.71Å; L481-V524 HydrophobicContact CB-CG1 3.93Å; L481-Q525 HydrophobicContact CD1-CG 3.91Å; L481-M528 HydrophobicContact CD2-SD 3.83Å
482	L	71.9	Confident	76.4	Confident	84 Å²	84	57.5 Å²	57.5	44%	0.44	27%	0.267	S	S	.	.	H	α-helix	trans	-71.5	-47.9	174.5	-70.6	169.7	0	0	0	111	A478 Y479 Y480 F484 K485 S486	A478-L482 WeakPolarHBondContact O-CG 3.31Å; A478-L482 PolarHBondContact O-N 2.94Å; A478-L482 VanDerWaalsContact O-N 3.08Å; Y479-L482 PolarHBondContact O-N 2.96Å; Y479-L482 VanDerWaalsContact O-N 3.13Å; Y480-L482 VanDerWaalsContact C-N 3.32Å; Y480-L482 PolarHBondContact O-N 2.64Å; L482-F484 PolarHBondContact O-N 2.9Å; L482-K485 PolarHBondContact O-N 2.85Å; L482-S486 PolarHBondContact O-N 3.05Å; L482-S486 PolarHBondContact O-OG 3.14Å
483	Y	77.7	Confident	77	Confident	72 Å²	72	58.6 Å²	58.6	28%	0.282	27%	0.27	S	S	.	.	H	α-helix	trans	-54.4	-52.1	177.7	174.9	-100.4	0	0	0	112.3	Y479 Y480 K485 S486 R487	Y479-Y483 PolarHBondContact O-N 3.46Å; Y480-Y483 PolarHBondContact O-N 3.08Å; Y483-K485 PolarHBondContact O-N 2.94Å; Y483-S486 PolarHBondContact O-N 3.39Å; Y483-R487 PolarHBondContact O-N 3.48Å
484	F	79.7	Confident	77.5	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.009	28%	0.279	C	S	.	.	H	α-helix	trans	-64.7	-37.1	179.6	-60.5	-38.5	0	0	0	112.6	Y480 L482 R487 L488 L517 Q520 L521 V524	Y480-F484 HydrophobicContact CD1-CZ 4.34Å; Y480-F484 WeakPolarHBondContact O-CD2 3.12Å; Y480-F484 VanDerWaalsContact O-CG 3.27Å; Y480-F484 WeakPolarHBondContact O-CG 3.18Å; Y480-F484 PolarHBondContact O-N 2.98Å; L482-F484 PolarHBondContact O-N 2.9Å; F484-R487 PolarHBondContact O-N 3.18Å; F484-L488 WeakPolarHBondContact O-CB 3.21Å; F484-L488 PolarHBondContact O-N 2.72Å; F484-L517 HydrophobicContact CD1-CD2 3.56Å; F484-L517 HydrophobicContact CE1-CD2 4.08Å; F484-Q520 HydrophobicContact CD2-CB 4.32Å; F484-Q520 HydrophobicContact CE1-CB 4.08Å; F484-Q520 VanDerWaalsContact CE1-OE1 3.3Å; F484-Q520 HydrophobicContact CE2-CB 3.6Å; F484-Q520 HydrophobicContact CZ-CB 3.48Å; F484-Q520 VanDerWaalsContact CZ-CB 3.48Å; F484-Q520 HydrophobicContact CZ-CG 4.37Å; F484-L521 HydrophobicContact CB-CB 4Å; F484-L521 HydrophobicContact CB-CD1 3.94Å; F484-L521 HydrophobicContact CB-CG 4.44Å; F484-L521 HydrophobicContact CD2-CB 4.1Å; F484-L521 HydrophobicContact CG-CB 4.36Å; F484-V524 HydrophobicContact CE2-CG2 3.87Å
485	K	79.2	Confident	78.4	Confident	72 Å²	72	60.7 Å²	60.7	31%	0.313	28%	0.278	S	S	.	.	H	α-helix	trans	-66.1	-40.5	174.6	-77.6	173.6	-178.7	174	0	112.6	L481 L482 Y483 L488 R489 L521	L481-K485 HydrophobicContact CG-CD 4.38Å; L481-K485 WeakPolarHBondContact O-CB 3.3Å; L481-K485 WeakPolarHBondContact O-CD 3.48Å; L481-K485 WeakPolarHBondContact O-CG 3.45Å; L481-K485 PolarHBondContact O-N 2.71Å; L482-K485 PolarHBondContact O-N 2.85Å; Y483-K485 PolarHBondContact O-N 2.94Å; K485-L488 PolarHBondContact O-N 3.31Å; K485-R489 WeakPolarHBondContact O-CG 3.41Å; K485-R489 PolarHBondContact O-N 3.31Å; K485-R489 PolarHBondContact O-NE 3.01Å; K485-L521 HydrophobicContact CG-CD1 4.07Å
486	S	69.1	Low	79.3	Confident	55 Å²	55	61.4 Å²	61.4	39%	0.385	28%	0.28	S	S	.	.	H	α-helix	trans	-63.4	-44.1	173.8	-66.8	0	0	0	0	111.4	L482 Y483 L488 R489 E490	L482-S486 PolarHBondContact O-N 3.05Å; L482-S486 PolarHBondContact O-OG 3.14Å; Y483-S486 PolarHBondContact O-N 3.39Å; S486-L488 VanDerWaalsContact C-N 3.35Å; S486-L488 PolarHBondContact O-N 3.5Å; S486-R489 PolarHBondContact O-N 2.89Å; S486-R489 PolarHBondContact OG-NH2 3.44Å; S486-E490 PolarHBondContact O-N 3.25Å
487	R	78	Confident	79.7	Confident	115 Å²	115	64.7 Å²	64.7	43%	0.434	30%	0.298	S	S	.	.	H	α-helix	trans	-67.9	-32.8	178.6	-161.7	65.3	-177.8	173	4.1	113.4	Y483 F484 Y491 L517	Y483-R487 PolarHBondContact O-N 3.48Å; F484-R487 PolarHBondContact O-N 3.18Å; R487-Y491 PolarHBondContact O-N 3.3Å; R487-L517 HydrophobicContact CB-CD1 4.09Å; R487-L517 HydrophobicContact CB-CD2 4.39Å; R487-L517 HydrophobicContact CG-CD1 3.5Å; R487-L517 HydrophobicContact CG-CD2 4.3Å
488	L	85.4	Confident	80.1	Confident	24 Å²	24	68.4 Å²	68.4	13%	0.126	32%	0.317	C	S	.	.	H	α-helix	trans	-68	-43.6	173.6	-167.9	69.6	0	0	0	111.8	F484 K485 S486 E490 Y491 E492 I514 L518	F484-L488 WeakPolarHBondContact O-CB 3.21Å; F484-L488 PolarHBondContact O-N 2.72Å; K485-L488 PolarHBondContact O-N 3.31Å; S486-L488 VanDerWaalsContact C-N 3.35Å; S486-L488 PolarHBondContact O-N 3.5Å; L488-E490 VanDerWaalsContact C-N 3.35Å; L488-E490 PolarHBondContact O-N 3.5Å; L488-Y491 PolarHBondContact O-N 2.84Å; L488-E492 WeakPolarHBondContact O-CG 3.5Å; L488-E492 PolarHBondContact O-N 2.8Å; L488-I514 HydrophobicContact CD1-CG2 3.72Å; L488-L518 HydrophobicContact CD1-CD2 3.92Å; L488-L518 HydrophobicContact CD1-CG 4.21Å; L488-L518 HydrophobicContact CD2-CD2 3.92Å
489	R	79.3	Confident	80.7	Confident	78 Å²	78	74.1 Å²	74.1	29%	0.294	33%	0.333	S	S	.	.	H	α-helix	trans	-60.3	-41.1	175.6	-76.2	176.8	-69.9	-170.1	4	112.5	K485 S486 Y491 E492 K493	K485-R489 WeakPolarHBondContact O-CG 3.41Å; K485-R489 PolarHBondContact O-N 3.31Å; K485-R489 PolarHBondContact O-NE 3.01Å; S486-R489 PolarHBondContact O-N 2.89Å; S486-R489 PolarHBondContact OG-NH2 3.44Å; R489-Y491 VanDerWaalsContact C-N 3.32Å; R489-Y491 PolarHBondContact O-N 2.98Å; R489-E492 PolarHBondContact O-N 3.16Å; R489-K493 WeakPolarHBondContact O-CB 3.37Å; R489-K493 PolarHBondContact O-N 2.95Å
490	E	79.5	Confident	80.9	Confident	89 Å²	89	72.6 Å²	72.6	42%	0.416	35%	0.348	S	S	.	.	H	α-helix	trans	-64.1	-38	178.4	-161.5	59.1	-149.8	0	0	111.8	S486 L488 K493 Q494	S486-E490 PolarHBondContact O-N 3.25Å; L488-E490 VanDerWaalsContact C-N 3.35Å; L488-E490 PolarHBondContact O-N 3.5Å; E490-K493 IonicContact OE1-NZ 3.39Å; E490-K493 IonicContact OE2-NZ 2.64Å; E490-Q494 WeakPolarHBondContact O-CB 3.23Å; E490-Q494 PolarHBondContact O-N 3.27Å
491	Y	87.8	Confident	81.5	Confident	33 Å²	33	77 Å²	77	13%	0.129	36%	0.364	C	S	.	.	H	α-helix	trans	-66.3	-42	171.3	167.9	-101.2	0	0	0	112.8	R487 L488 R489 K493 Q494 F495 P503 D507 K508 N511 I514	R487-Y491 PolarHBondContact O-N 3.3Å; L488-Y491 PolarHBondContact O-N 2.84Å; R489-Y491 VanDerWaalsContact C-N 3.32Å; R489-Y491 PolarHBondContact O-N 2.98Å; Y491-K493 VanDerWaalsContact C-N 3.3Å; Y491-K493 PolarHBondContact O-N 3.16Å; Y491-Q494 PolarHBondContact O-N 2.97Å; Y491-F495 HydrophobicContact CE2-CB 4.47Å; Y491-F495 HydrophobicContact CE2-CD2 4.16Å; Y491-F495 AromaticContact CZ-CD2 3.87Å; Y491-F495 VanDerWaalsContact O-CB 3.23Å; Y491-F495 WeakPolarHBondContact O-CB 3.49Å; Y491-F495 PolarHBondContact O-N 2.86Å; Y491-F495 WeakPolarHBondContact OH-CD2 3.28Å; Y491-P503 HydrophobicContact CE1-CB 4.06Å; Y491-P503 HydrophobicContact CE1-CG 3.99Å; Y491-D507 PolarHBondContact OH-O 2.89Å; Y491-K508 HydrophobicContact CE1-CG 4.02Å; Y491-N511 HydrophobicContact CE2-CB 4.39Å; Y491-I514 HydrophobicContact CD1-CD1 4.06Å; Y491-I514 HydrophobicContact CD1-CG1 3.88Å; Y491-I514 HydrophobicContact CD1-CG2 3.9Å; Y491-I514 HydrophobicContact CD2-CD1 3.82Å; Y491-I514 HydrophobicContact CD2-CG1 3.66Å; Y491-I514 HydrophobicContact CE1-CG1 4.16Å; Y491-I514 HydrophobicContact CE1-CG2 4.08Å; Y491-I514 HydrophobicContact CE2-CG1 3.96Å; Y491-I514 HydrophobicContact CG-CD1 3.49Å; Y491-I514 VanDerWaalsContact CG-CD1 3.49Å; Y491-I514 HydrophobicContact CG-CG1 3.61Å; Y491-I514 HydrophobicContact CG-CG2 4.45Å
492	E	85.3	Confident	81.8	Confident	56 Å²	56	81.2 Å²	81.2	26%	0.262	38%	0.382	S	S	.	.	H	α-helix	trans	-61.5	-39.7	176.8	-70.9	-177.3	149.4	0	0	111.9	L488 R489 E496 P503 K508	L488-E492 WeakPolarHBondContact O-CG 3.5Å; L488-E492 PolarHBondContact O-N 2.8Å; R489-E492 PolarHBondContact O-N 3.16Å; E492-E496 WeakPolarHBondContact O-CB 3.38Å; E492-E496 PolarHBondContact O-N 3.2Å; E492-P503 HydrophobicContact CB-CG 4.32Å; E492-P503 HydrophobicContact CG-CG 3.87Å; E492-K508 WeakPolarHBondContact OE1-CE 3.37Å; E492-K508 IonicContact OE1-NZ 2.68Å; E492-K508 PolarHBondContact OE1-NZ 3.05Å
493	K	79.7	Confident	82.5	Confident	133 Å²	133	77.7 Å²	77.7	58%	0.578	36%	0.364	S	S	*	.	H	α-helix	trans	-67.7	-47.1	175.9	-179.3	-173.9	168	-154.4	0	112.4	R489 E490 Y491 F495 E496 H497	R489-K493 WeakPolarHBondContact O-CB 3.37Å; R489-K493 PolarHBondContact O-N 2.95Å; E490-K493 IonicContact OE1-NZ 3.39Å; E490-K493 IonicContact OE2-NZ 2.64Å; Y491-K493 VanDerWaalsContact C-N 3.3Å; Y491-K493 PolarHBondContact O-N 3.16Å; K493-F495 VanDerWaalsContact C-N 3.33Å; K493-F495 PolarHBondContact O-N 3.35Å; K493-E496 PolarHBondContact O-N 2.69Å; K493-H497 WeakPolarHBondContact O-CB 3.32Å; K493-H497 PolarHBondContact O-N 2.99Å
494	Q	81.4	Confident	82.9	Confident	94 Å²	94	77.6 Å²	77.6	44%	0.439	37%	0.371	S	S	.	.	H	α-helix	trans	-61.3	-42.5	175.8	-174	64.2	48.2	0	0	111.1	E490 Y491 H497 D498	E490-Q494 WeakPolarHBondContact O-CB 3.23Å; E490-Q494 PolarHBondContact O-N 3.27Å; Y491-Q494 PolarHBondContact O-N 2.97Å; Q494-H497 WeakPolarHBondContact O-CB 3.39Å; Q494-H497 PolarHBondContact O-N 3.32Å; Q494-D498 PolarHBondContact NE2-OD1 3.34Å; Q494-D498 PolarHBondContact NE2-OD2 2.96Å; Q494-D498 WeakPolarHBondContact O-CB 3.46Å; Q494-D498 PolarHBondContact O-N 3.06Å
495	F	90.7	Very high	83.1	Confident	16 Å²	16	81.2 Å²	81.2	7%	0.07	39%	0.391	C	S	.	.	H	α-helix	trans	-67.4	-38.4	177.7	-168.6	-76.8	0	0	0	112.3	Y491 K493 H497 D498 Y499 R501 P503 D507	Y491-F495 HydrophobicContact CE2-CB 4.47Å; Y491-F495 HydrophobicContact CE2-CD2 4.16Å; Y491-F495 AromaticContact CZ-CD2 3.87Å; Y491-F495 VanDerWaalsContact O-CB 3.23Å; Y491-F495 WeakPolarHBondContact O-CB 3.49Å; Y491-F495 PolarHBondContact O-N 2.86Å; Y491-F495 WeakPolarHBondContact OH-CD2 3.28Å; K493-F495 VanDerWaalsContact C-N 3.33Å; K493-F495 PolarHBondContact O-N 3.35Å; F495-H497 VanDerWaalsContact C-N 3.34Å; F495-D498 PolarHBondContact O-N 2.59Å; F495-Y499 AromaticContact CD1-CD2 3.83Å; F495-Y499 HydrophobicContact CD1-CD2 3.83Å; F495-Y499 HydrophobicContact CD1-CG 4.4Å; F495-Y499 AromaticContact CD2-CD2 3.57Å; F495-Y499 HydrophobicContact CD2-CD2 3.57Å; F495-Y499 AromaticContact CD2-CE2 3.68Å; F495-Y499 HydrophobicContact CD2-CE2 3.68Å; F495-Y499 AromaticContact CE1-CD2 3.8Å; F495-Y499 HydrophobicContact CE1-CD2 3.8Å; F495-Y499 HydrophobicContact CE1-CG 4.06Å; F495-Y499 AromaticContact CE2-CD2 3.55Å; F495-Y499 HydrophobicContact CE2-CD2 3.55Å; F495-Y499 AromaticContact CE2-CE2 3.6Å; F495-Y499 HydrophobicContact CE2-CE2 3.6Å; F495-Y499 HydrophobicContact CE2-CG 4.35Å; F495-Y499 AromaticContact CG-CD2 3.71Å; F495-Y499 HydrophobicContact CG-CD2 3.71Å; F495-Y499 HydrophobicContact CG-CE2 4.26Å; F495-Y499 AromaticContact CZ-CD2 3.66Å; F495-Y499 HydrophobicContact CZ-CD2 3.66Å; F495-Y499 HydrophobicContact CZ-CE2 4.12Å; F495-Y499 HydrophobicContact CZ-CG 4.04Å; F495-Y499 WeakPolarHBondContact O-CB 3.17Å; F495-Y499 WeakPolarHBondContact O-CD2 3.4Å; F495-Y499 PolarHBondContact O-N 3.18Å; F495-R501 VanDerWaalsContact CD1-O 3.3Å; F495-R501 WeakPolarHBondContact CD1-O 3.44Å; F495-R501 HydrophobicContact CE1-CG 4Å; F495-P503 HydrophobicContact CB-CB 4.32Å; F495-P503 HydrophobicContact CB-CG 4.16Å; F495-P503 HydrophobicContact CD1-CB 3.58Å; F495-P503 HydrophobicContact CD1-CG 4.05Å; F495-P503 HydrophobicContact CD2-CB 4.08Å; F495-P503 HydrophobicContact CE1-CB 3.82Å; F495-P503 HydrophobicContact CE2-CB 4.28Å; F495-P503 HydrophobicContact CG-CB 3.73Å; F495-P503 HydrophobicContact CG-CG 4.09Å; F495-P503 HydrophobicContact CZ-CB 4.16Å; F495-D507 HydrophobicContact CE2-CB 3.79Å; F495-D507 HydrophobicContact CZ-CB 3.69Å
496	E	85.2	Confident	83.4	Confident	77 Å²	77	81 Å²	81	36%	0.36	40%	0.402	S	S	.	.	H	α-helix	trans	-69	-32	175.9	-170.7	165.8	-152.1	0	0	112.6	E492 K493 G500 R501 K502	E492-E496 WeakPolarHBondContact O-CB 3.38Å; E492-E496 PolarHBondContact O-N 3.2Å; K493-E496 PolarHBondContact O-N 2.69Å; E496-G500 VanDerWaalsContact O-CA 3.26Å; E496-G500 WeakPolarHBondContact O-CA 3.35Å; E496-G500 PolarHBondContact O-N 3.3Å; E496-G500 VanDerWaalsContact O-N 3.08Å; E496-R501 WeakPolarHBondContact CA-O 3.4Å; E496-K502 VanDerWaalsContact CD-CG 3.41Å; E496-K502 HydrophobicContact CG-CG 4.24Å; E496-K502 WeakPolarHBondContact OE1-CE 3.25Å; E496-K502 VanDerWaalsContact OE1-CG 3.27Å; E496-K502 WeakPolarHBondContact OE1-CG 3.35Å; E496-K502 IonicContact OE1-NZ 3.35Å; E496-K502 WeakPolarHBondContact OE2-CE 3.41Å; E496-K502 WeakPolarHBondContact OE2-CG 3.35Å; E496-K502 IonicContact OE2-NZ 2.73Å; E496-K502 PolarHBondContact OE2-NZ 3.22Å
497	H	83.7	Confident	84.3	Confident	149 Å²	149	79.9 Å²	79.9	69%	0.69	39%	0.392	S	S	*	.	H	α-helix	trans	-65.2	-52.3	168.7	175.3	-88.4	0	0	0	111.9	K493 Q494 F495	K493-H497 WeakPolarHBondContact O-CB 3.32Å; K493-H497 PolarHBondContact O-N 2.99Å; Q494-H497 WeakPolarHBondContact O-CB 3.39Å; Q494-H497 PolarHBondContact O-N 3.32Å; F495-H497 VanDerWaalsContact C-N 3.34Å
498	D	86.3	Confident	84.9	Confident	87 Å²	87	75.2 Å²	75.2	47%	0.465	37%	0.374	S	S	.	.	H	α-helix	trans	-76.9	-27.7	-170.6	-63.5	-18	0	0	0	113.9	Q494 F495	Q494-D498 PolarHBondContact NE2-OD1 3.34Å; Q494-D498 PolarHBondContact NE2-OD2 2.96Å; Q494-D498 WeakPolarHBondContact O-CB 3.46Å; Q494-D498 PolarHBondContact O-N 3.06Å; F495-D498 PolarHBondContact O-N 2.59Å
499	Y	85.2	Confident	85	Confident	155 Å²	155	80.2 Å²	80.2	61%	0.608	39%	0.393	S	S	*	.	H	α-helix	trans	-117.9	-0.5	-176.2	-62.1	-79	0	0	0	114.6	F495 R501	F495-Y499 AromaticContact CD1-CD2 3.83Å; F495-Y499 HydrophobicContact CD1-CD2 3.83Å; F495-Y499 HydrophobicContact CD1-CG 4.4Å; F495-Y499 AromaticContact CD2-CD2 3.57Å; F495-Y499 HydrophobicContact CD2-CD2 3.57Å; F495-Y499 AromaticContact CD2-CE2 3.68Å; F495-Y499 HydrophobicContact CD2-CE2 3.68Å; F495-Y499 AromaticContact CE1-CD2 3.8Å; F495-Y499 HydrophobicContact CE1-CD2 3.8Å; F495-Y499 HydrophobicContact CE1-CG 4.06Å; F495-Y499 AromaticContact CE2-CD2 3.55Å; F495-Y499 HydrophobicContact CE2-CD2 3.55Å; F495-Y499 AromaticContact CE2-CE2 3.6Å; F495-Y499 HydrophobicContact CE2-CE2 3.6Å; F495-Y499 HydrophobicContact CE2-CG 4.35Å; F495-Y499 AromaticContact CG-CD2 3.71Å; F495-Y499 HydrophobicContact CG-CD2 3.71Å; F495-Y499 HydrophobicContact CG-CE2 4.26Å; F495-Y499 AromaticContact CZ-CD2 3.66Å; F495-Y499 HydrophobicContact CZ-CD2 3.66Å; F495-Y499 HydrophobicContact CZ-CE2 4.12Å; F495-Y499 HydrophobicContact CZ-CG 4.04Å; F495-Y499 WeakPolarHBondContact O-CB 3.17Å; F495-Y499 WeakPolarHBondContact O-CD2 3.4Å; F495-Y499 PolarHBondContact O-N 3.18Å; Y499-R501 PolarHBondContact O-N 3.48Å; Y499-R501 VanDerWaalsContact O-N 3.09Å
500	G	79	Confident	85.3	Confident	71 Å²	71	81 Å²	81	73%	0.732	41%	0.41	S	S	*	.	S	Bend	trans	62.1	15.6	-179.4	0	0	0	0	0	114.8	E496	E496-G500 VanDerWaalsContact O-CA 3.26Å; E496-G500 WeakPolarHBondContact O-CA 3.35Å; E496-G500 PolarHBondContact O-N 3.3Å; E496-G500 VanDerWaalsContact O-N 3.08Å
501	R	88.8	Confident	85.6	Confident	128 Å²	128	79.3 Å²	79.3	48%	0.483	40%	0.404	S	S	.	.	S	Bend	trans	-147.4	148.7	-178.1	78.6	-178.9	-153.4	-164	2.2	109.8	F495 E496 Y499 D507	F495-R501 VanDerWaalsContact CD1-O 3.3Å; F495-R501 WeakPolarHBondContact CD1-O 3.44Å; F495-R501 HydrophobicContact CE1-CG 4Å; E496-R501 WeakPolarHBondContact CA-O 3.4Å; Y499-R501 PolarHBondContact O-N 3.48Å; Y499-R501 VanDerWaalsContact O-N 3.09Å; R501-D507 IonicContact CZ-OD2 3.42Å; R501-D507 IonicContact NE-OD2 3.07Å; R501-D507 IonicContact NH2-OD1 3.32Å; R501-D507 PolarHBondContact NH2-OD1 3.31Å; R501-D507 IonicContact NH2-OD2 3.85Å; R501-D507 PolarHBondContact NH2-OD2 3.45Å
502	K	84.8	Confident	85.5	Confident	115 Å²	115	82.5 Å²	82.5	50%	0.5	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-67	145.5	169.9	-67.1	-174.3	-178.7	-73.5	0	111.3	E496	E496-K502 VanDerWaalsContact CD-CG 3.41Å; E496-K502 HydrophobicContact CG-CG 4.24Å; E496-K502 WeakPolarHBondContact OE1-CE 3.25Å; E496-K502 VanDerWaalsContact OE1-CG 3.27Å; E496-K502 WeakPolarHBondContact OE1-CG 3.35Å; E496-K502 IonicContact OE1-NZ 3.35Å; E496-K502 WeakPolarHBondContact OE2-CE 3.41Å; E496-K502 WeakPolarHBondContact OE2-CG 3.35Å; E496-K502 IonicContact OE2-NZ 2.73Å; E496-K502 PolarHBondContact OE2-NZ 3.22Å
503	P	86	Confident	85.3	Confident	11 Å²	11	83.9 Å²	83.9	7%	0.071	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-68.4	134.8	180	26.2	-32.6	0	0	0	111.7	Y491 E492 F495 D507 K508	Y491-P503 HydrophobicContact CE1-CB 4.06Å; Y491-P503 HydrophobicContact CE1-CG 3.99Å; E492-P503 HydrophobicContact CB-CG 4.32Å; E492-P503 HydrophobicContact CG-CG 3.87Å; F495-P503 HydrophobicContact CB-CB 4.32Å; F495-P503 HydrophobicContact CB-CG 4.16Å; F495-P503 HydrophobicContact CD1-CB 3.58Å; F495-P503 HydrophobicContact CD1-CG 4.05Å; F495-P503 HydrophobicContact CD2-CB 4.08Å; F495-P503 HydrophobicContact CE1-CB 3.82Å; F495-P503 HydrophobicContact CE2-CB 4.28Å; F495-P503 HydrophobicContact CG-CB 3.73Å; F495-P503 HydrophobicContact CG-CG 4.09Å; F495-P503 HydrophobicContact CZ-CB 4.16Å; P503-D507 HydrophobicContact CB-CB 3.85Å; P503-K508 HydrophobicContact CB-CG 4.27Å; P503-K508 HydrophobicContact CG-CG 4.44Å
504	T	87.1	Confident	85.8	Confident	69 Å²	69	78 Å²	78	42%	0.423	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-71.4	165.5	167.4	67.5	0	0	0	0	110.5	A506 D507 K508	T504-A506 PolarHBondContact O-N 3.02Å; T504-A506 PolarHBondContact OG1-N 3.43Å; T504-D507 WeakPolarHBondContact CB-OD2 3.33Å; T504-D507 WeakPolarHBondContact CG2-OD2 3.39Å; T504-D507 PolarHBondContact N-OD2 3.44Å; T504-D507 WeakPolarHBondContact O-CB 3.35Å; T504-D507 PolarHBondContact O-N 2.89Å; T504-D507 PolarHBondContact OG1-N 3.42Å; T504-D507 VanDerWaalsContact OG1-N 3.16Å; T504-D507 PolarHBondContact OG1-OD2 2.93Å; T504-K508 PolarHBondContact O-N 2.88Å
505	N	84.2	Confident	86.1	Confident	79 Å²	79	74.8 Å²	74.8	42%	0.422	40%	0.398	S	S	.	.	H	α-helix	trans	-60.6	-30.5	173.7	-75.4	29.9	0	0	0	112.2	K508 Y509	N505-K508 PolarHBondContact O-N 2.85Å; N505-Y509 WeakPolarHBondContact O-CD2 3.26Å; N505-Y509 PolarHBondContact O-N 3.35Å
506	A	84.4	Confident	85.9	Confident	67 Å²	67	77.5 Å²	77.5	55%	0.554	41%	0.411	S	S	*	.	H	α-helix	trans	-65	-43.4	171.9	0	0	0	0	0	111.7	T504 K508 Y509 S510	T504-A506 PolarHBondContact O-N 3.02Å; T504-A506 PolarHBondContact OG1-N 3.43Å; A506-K508 PolarHBondContact O-N 2.86Å; A506-Y509 PolarHBondContact O-N 2.76Å; A506-S510 WeakPolarHBondContact O-CB 3.19Å; A506-S510 PolarHBondContact O-N 3.28Å; A506-S510 PolarHBondContact O-OG 3.23Å
507	D	89	Confident	85.9	Confident	31 Å²	31	74.4 Å²	74.4	17%	0.166	40%	0.397	C	S	.	.	H	α-helix	trans	-61	-45.1	175.8	-56.7	-51.5	0	0	0	111.2	Y491 F495 R501 P503 T504 Y509 S510	Y491-D507 PolarHBondContact OH-O 2.89Å; F495-D507 HydrophobicContact CE2-CB 3.79Å; F495-D507 HydrophobicContact CZ-CB 3.69Å; R501-D507 IonicContact CZ-OD2 3.42Å; R501-D507 IonicContact NE-OD2 3.07Å; R501-D507 IonicContact NH2-OD1 3.32Å; R501-D507 PolarHBondContact NH2-OD1 3.31Å; R501-D507 IonicContact NH2-OD2 3.85Å; R501-D507 PolarHBondContact NH2-OD2 3.45Å; P503-D507 HydrophobicContact CB-CB 3.85Å; T504-D507 WeakPolarHBondContact CB-OD2 3.33Å; T504-D507 WeakPolarHBondContact CG2-OD2 3.39Å; T504-D507 PolarHBondContact N-OD2 3.44Å; T504-D507 WeakPolarHBondContact O-CB 3.35Å; T504-D507 PolarHBondContact O-N 2.89Å; T504-D507 PolarHBondContact OG1-N 3.42Å; T504-D507 VanDerWaalsContact OG1-N 3.16Å; T504-D507 PolarHBondContact OG1-OD2 2.93Å; D507-Y509 PolarHBondContact O-N 3.5Å; D507-S510 WeakPolarHBondContact O-CB 3.47Å; D507-S510 PolarHBondContact O-N 2.98Å; D507-S510 VanDerWaalsContact O-N 3.12Å
508	K	89.3	Confident	86.2	Confident	17 Å²	17	67.6 Å²	67.6	7%	0.074	37%	0.365	C	S	.	.	H	α-helix	trans	-56.8	-50.6	176.4	-70.7	178.3	176.4	-173.4	0	112.7	Y491 E492 P503 T504 N505 A506 S510 N511 I514 L518	Y491-K508 HydrophobicContact CE1-CG 4.02Å; E492-K508 WeakPolarHBondContact OE1-CE 3.37Å; E492-K508 IonicContact OE1-NZ 2.68Å; E492-K508 PolarHBondContact OE1-NZ 3.05Å; P503-K508 HydrophobicContact CB-CG 4.27Å; P503-K508 HydrophobicContact CG-CG 4.44Å; T504-K508 PolarHBondContact O-N 2.88Å; N505-K508 PolarHBondContact O-N 2.85Å; A506-K508 PolarHBondContact O-N 2.86Å; K508-S510 PolarHBondContact O-N 3.31Å; K508-N511 PolarHBondContact O-N 3.4Å; K508-I514 HydrophobicContact CB-CG2 4.3Å; K508-L518 HydrophobicContact CB-CD1 4.11Å
509	Y	88.8	Confident	86.3	Confident	130 Å²	130	68.7 Å²	68.7	51%	0.51	36%	0.363	S	S	.	.	H	α-helix	trans	-73.5	-12.7	178.3	-73.7	-64.9	0	0	0	113.7	N505 A506 D507 N511 A515 L518	N505-Y509 WeakPolarHBondContact O-CD2 3.26Å; N505-Y509 PolarHBondContact O-N 3.35Å; A506-Y509 PolarHBondContact O-N 2.76Å; D507-Y509 PolarHBondContact O-N 3.5Å; Y509-N511 VanDerWaalsContact C-N 3.34Å; Y509-A515 HydrophobicContact CD1-CB 4.09Å; Y509-L518 HydrophobicContact CD1-CD1 4.34Å; Y509-L518 HydrophobicContact CE1-CB 4.38Å; Y509-L518 HydrophobicContact CE1-CD1 3.94Å
510	S	85.4	Confident	86.2	Confident	93 Å²	93	61.8 Å²	61.8	65%	0.65	34%	0.337	S	S	*	.	H	α-helix	trans	-76	-20.4	174.3	-58.6	0	0	0	0	113.1	A506 D507 K508	A506-S510 WeakPolarHBondContact O-CB 3.19Å; A506-S510 PolarHBondContact O-N 3.28Å; A506-S510 PolarHBondContact O-OG 3.23Å; D507-S510 WeakPolarHBondContact O-CB 3.47Å; D507-S510 PolarHBondContact O-N 2.98Å; D507-S510 VanDerWaalsContact O-N 3.12Å; K508-S510 PolarHBondContact O-N 3.31Å
511	N	85.5	Confident	86.6	Confident	54 Å²	54	59 Å²	59	29%	0.289	30%	0.304	S	S	.	.	S	Bend	trans	-95.8	114.1	173.9	-177	-25.9	0	0	0	109.6	Y491 K508 Y509 K513 I514 A515	Y491-N511 HydrophobicContact CE2-CB 4.39Å; K508-N511 PolarHBondContact O-N 3.4Å; Y509-N511 VanDerWaalsContact C-N 3.34Å; N511-K513 PolarHBondContact O-N 2.89Å; N511-K513 PolarHBondContact OD1-N 3.25Å; N511-K513 VanDerWaalsContact OD1-N 3.1Å; N511-I514 HydrophobicContact CB-CB 4.11Å; N511-I514 HydrophobicContact CB-CG1 3.81Å; N511-I514 PolarHBondContact O-N 3.41Å; N511-A515 PolarHBondContact O-N 3.23Å
512	P	85.5	Confident	86.4	Confident	101 Å²	101	55.8 Å²	55.8	66%	0.656	30%	0.302	S	S	*	.	H	α-helix	trans	-62.4	-31	-173.2	24.8	-34.4	0	0	0	113	I514 E516	P512-I514 VanDerWaalsContact C-N 3.31Å; P512-I514 PolarHBondContact O-N 3.37Å; P512-E516 PolarHBondContact O-N 2.92Å; P512-E516 VanDerWaalsContact O-N 3.07Å
513	K	82.2	Confident	86.4	Confident	84 Å²	84	53.9 Å²	53.9	37%	0.365	30%	0.295	S	S	.	.	H	α-helix	trans	-69.4	-30.9	177	-63.4	-175.2	165.7	-155.8	0	111.9	Y456 N511 L517	Y456-K513 HydrophobicContact CE2-CB 4.5Å; Y456-K513 HydrophobicContact CE2-CD 3.73Å; Y456-K513 HydrophobicContact CE2-CG 4.07Å; Y456-K513 WeakPolarHBondContact OH-CD 3.24Å; Y456-K513 PolarHBondContact OH-NZ 3.3Å; N511-K513 PolarHBondContact O-N 2.89Å; N511-K513 PolarHBondContact OD1-N 3.25Å; N511-K513 VanDerWaalsContact OD1-N 3.1Å; K513-L517 WeakPolarHBondContact O-CD1 3.44Å; K513-L517 VanDerWaalsContact O-CG 3.29Å; K513-L517 WeakPolarHBondContact O-CG 3.19Å; K513-L517 PolarHBondContact O-N 3.03Å
514	I	89	Confident	86.1	Confident	10 Å²	10	53.4 Å²	53.4	5%	0.051	29%	0.292	C	S	.	.	H	α-helix	trans	-83.3	-37.7	177.9	-53.9	-55.6	0	0	0	111.1	L488 Y491 K508 N511 P512 E516 L517 L518	L488-I514 HydrophobicContact CD1-CG2 3.72Å; Y491-I514 HydrophobicContact CD1-CD1 4.06Å; Y491-I514 HydrophobicContact CD1-CG1 3.88Å; Y491-I514 HydrophobicContact CD1-CG2 3.9Å; Y491-I514 HydrophobicContact CD2-CD1 3.82Å; Y491-I514 HydrophobicContact CD2-CG1 3.66Å; Y491-I514 HydrophobicContact CE1-CG1 4.16Å; Y491-I514 HydrophobicContact CE1-CG2 4.08Å; Y491-I514 HydrophobicContact CE2-CG1 3.96Å; Y491-I514 HydrophobicContact CG-CD1 3.49Å; Y491-I514 VanDerWaalsContact CG-CD1 3.49Å; Y491-I514 HydrophobicContact CG-CG1 3.61Å; Y491-I514 HydrophobicContact CG-CG2 4.45Å; K508-I514 HydrophobicContact CB-CG2 4.3Å; N511-I514 HydrophobicContact CB-CB 4.11Å; N511-I514 HydrophobicContact CB-CG1 3.81Å; N511-I514 PolarHBondContact O-N 3.41Å; P512-I514 VanDerWaalsContact C-N 3.31Å; P512-I514 PolarHBondContact O-N 3.37Å; I514-E516 VanDerWaalsContact C-N 3.3Å; I514-E516 PolarHBondContact O-N 2.98Å; I514-L517 HydrophobicContact CD1-CD1 4.08Å; I514-L517 PolarHBondContact O-N 3.15Å; I514-L518 HydrophobicContact CG2-CD1 4.31Å; I514-L518 WeakPolarHBondContact O-CG 3.46Å; I514-L518 PolarHBondContact O-N 3.11Å
515	A	88	Confident	85.9	Confident	27 Å²	27	53.9 Å²	53.9	22%	0.223	29%	0.289	C	S	.	.	H	α-helix	trans	-56.9	-43.1	171	0	0	0	0	0	111.8	Y509 N511 L518 R519	Y509-A515 HydrophobicContact CD1-CB 4.09Å; N511-A515 PolarHBondContact O-N 3.23Å; A515-L518 PolarHBondContact O-N 3.23Å; A515-R519 PolarHBondContact O-N 3.35Å
516	E	87.1	Confident	85.9	Confident	72 Å²	72	53.9 Å²	53.9	34%	0.336	29%	0.287	S	S	.	.	H	α-helix	trans	-67.4	-40.6	175.9	-179.3	55.9	-158.8	0	0	112.8	P512 I514 L518 R519 Q520	P512-E516 PolarHBondContact O-N 2.92Å; P512-E516 VanDerWaalsContact O-N 3.07Å; I514-E516 VanDerWaalsContact C-N 3.3Å; I514-E516 PolarHBondContact O-N 2.98Å; E516-L518 VanDerWaalsContact C-N 3.33Å; E516-L518 PolarHBondContact O-N 2.68Å; E516-R519 VanDerWaalsContact O-CB 3.3Å; E516-R519 WeakPolarHBondContact O-CB 3.49Å; E516-R519 PolarHBondContact O-N 3.11Å; E516-R519 VanDerWaalsContact O-N 3.14Å; E516-R519 IonicContact OE1-CZ 3.56Å; E516-R519 IonicContact OE1-NE 3.47Å; E516-R519 PolarHBondContact OE1-NE 2.95Å; E516-R519 IonicContact OE1-NH2 3.46Å; E516-R519 PolarHBondContact OE1-NH2 3.22Å; E516-R519 IonicContact OE2-CZ 3.29Å; E516-R519 IonicContact OE2-NE 2.67Å; E516-R519 PolarHBondContact OE2-NE 2.94Å; E516-R519 IonicContact OE2-NH2 3.27Å; E516-Q520 PolarHBondContact O-N 3.04Å; E516-Q520 WeakPolarHBondContact OE1-CG 3.4Å; E516-Q520 PolarHBondContact OE1-NE2 3.3Å
517	L	85.8	Confident	85.6	Confident	13 Å²	13	52.2 Å²	52.2	7%	0.068	27%	0.27	C	S	.	.	H	α-helix	trans	-62.2	-38.9	173.9	-74.2	164.3	0	0	0	112.2	F484 R487 K513 I514 R519 L521	F484-L517 HydrophobicContact CD1-CD2 3.56Å; F484-L517 HydrophobicContact CE1-CD2 4.08Å; R487-L517 HydrophobicContact CB-CD1 4.09Å; R487-L517 HydrophobicContact CB-CD2 4.39Å; R487-L517 HydrophobicContact CG-CD1 3.5Å; R487-L517 HydrophobicContact CG-CD2 4.3Å; K513-L517 WeakPolarHBondContact O-CD1 3.44Å; K513-L517 VanDerWaalsContact O-CG 3.29Å; K513-L517 WeakPolarHBondContact O-CG 3.19Å; K513-L517 PolarHBondContact O-N 3.03Å; I514-L517 HydrophobicContact CD1-CD1 4.08Å; I514-L517 PolarHBondContact O-N 3.15Å; L517-R519 VanDerWaalsContact C-N 3.32Å; L517-L521 WeakPolarHBondContact O-CB 3.45Å; L517-L521 PolarHBondContact O-N 3.33Å
518	L	88.4	Confident	85.1	Confident	5 Å²	5	51.6 Å²	51.6	3%	0.026	27%	0.266	C	S	.	.	H	α-helix	trans	-66.6	-34	173.6	-71.4	169.8	0	0	0	112	L488 K508 Y509 I514 A515 E516 S522	L488-L518 HydrophobicContact CD1-CD2 3.92Å; L488-L518 HydrophobicContact CD1-CG 4.21Å; L488-L518 HydrophobicContact CD2-CD2 3.92Å; K508-L518 HydrophobicContact CB-CD1 4.11Å; Y509-L518 HydrophobicContact CD1-CD1 4.34Å; Y509-L518 HydrophobicContact CE1-CB 4.38Å; Y509-L518 HydrophobicContact CE1-CD1 3.94Å; I514-L518 HydrophobicContact CG2-CD1 4.31Å; I514-L518 WeakPolarHBondContact O-CG 3.46Å; I514-L518 PolarHBondContact O-N 3.11Å; A515-L518 PolarHBondContact O-N 3.23Å; E516-L518 VanDerWaalsContact C-N 3.33Å; E516-L518 PolarHBondContact O-N 2.68Å; L518-S522 WeakPolarHBondContact O-CB 3.26Å; L518-S522 PolarHBondContact O-N 2.97Å; L518-S522 VanDerWaalsContact O-N 3.09Å; L518-S522 PolarHBondContact O-OG 3.32Å
519	R	88.9	Confident	84.7	Confident	110 Å²	110	56.5 Å²	56.5	42%	0.415	28%	0.284	S	S	.	.	H	α-helix	trans	-63.8	-55.2	174	-158.6	-171.8	69.2	62.7	22.7	110.7	A515 E516 L517 L521 S522 E523	A515-R519 PolarHBondContact O-N 3.35Å; E516-R519 VanDerWaalsContact O-CB 3.3Å; E516-R519 WeakPolarHBondContact O-CB 3.49Å; E516-R519 PolarHBondContact O-N 3.11Å; E516-R519 VanDerWaalsContact O-N 3.14Å; E516-R519 IonicContact OE1-CZ 3.56Å; E516-R519 IonicContact OE1-NE 3.47Å; E516-R519 PolarHBondContact OE1-NE 2.95Å; E516-R519 IonicContact OE1-NH2 3.46Å; E516-R519 PolarHBondContact OE1-NH2 3.22Å; E516-R519 IonicContact OE2-CZ 3.29Å; E516-R519 IonicContact OE2-NE 2.67Å; E516-R519 PolarHBondContact OE2-NE 2.94Å; E516-R519 IonicContact OE2-NH2 3.27Å; L517-R519 VanDerWaalsContact C-N 3.32Å; R519-L521 PolarHBondContact O-N 3.12Å; R519-S522 WeakPolarHBondContact O-CA 3.43Å; R519-S522 WeakPolarHBondContact O-CB 3.37Å; R519-S522 PolarHBondContact O-N 2.88Å; R519-E523 IonicContact CZ-OE1 3.45Å; R519-E523 IonicContact CZ-OE2 2.76Å; R519-E523 IonicContact NH1-OE1 3.68Å; R519-E523 PolarHBondContact NH1-OE1 2.86Å; R519-E523 IonicContact NH1-OE2 2.76Å; R519-E523 PolarHBondContact NH1-OE2 2.9Å; R519-E523 IonicContact NH2-OE1 3.77Å; R519-E523 IonicContact NH2-OE2 2.95Å; R519-E523 PolarHBondContact NH2-OE2 3.1Å; R519-E523 VanDerWaalsContact NH2-OE2 3.07Å; R519-E523 PolarHBondContact O-N 2.87Å
520	Q	84.3	Confident	84.2	Confident	11 Å²	11	56 Å²	56	5%	0.051	29%	0.286	C	S	.	.	H	α-helix	trans	-65.6	-35.1	-179.8	-62.4	-178.8	19.8	0	0	112.9	F484 E516 S522 E523 V524	F484-Q520 HydrophobicContact CD2-CB 4.32Å; F484-Q520 HydrophobicContact CE1-CB 4.08Å; F484-Q520 VanDerWaalsContact CE1-OE1 3.3Å; F484-Q520 HydrophobicContact CE2-CB 3.6Å; F484-Q520 HydrophobicContact CZ-CB 3.48Å; F484-Q520 VanDerWaalsContact CZ-CB 3.48Å; F484-Q520 HydrophobicContact CZ-CG 4.37Å; E516-Q520 PolarHBondContact O-N 3.04Å; E516-Q520 WeakPolarHBondContact OE1-CG 3.4Å; E516-Q520 PolarHBondContact OE1-NE2 3.3Å; Q520-S522 VanDerWaalsContact C-N 3.27Å; Q520-S522 PolarHBondContact O-N 2.93Å; Q520-E523 WeakPolarHBondContact CA-OE2 3.29Å; Q520-E523 PolarHBondContact O-N 3.35Å; Q520-V524 WeakPolarHBondContact O-CG2 3.46Å; Q520-V524 PolarHBondContact O-N 2.9Å
521	L	85.6	Confident	83.7	Confident	11 Å²	11	52.7 Å²	52.7	6%	0.058	26%	0.261	C	S	.	.	H	α-helix	trans	-64.2	-31.2	172.3	176.9	147.7	0	0	0	112.6	F484 K485 L517 R519 Q525	F484-L521 HydrophobicContact CB-CB 4Å; F484-L521 HydrophobicContact CB-CD1 3.94Å; F484-L521 HydrophobicContact CB-CG 4.44Å; F484-L521 HydrophobicContact CD2-CB 4.1Å; F484-L521 HydrophobicContact CG-CB 4.36Å; K485-L521 HydrophobicContact CG-CD1 4.07Å; L517-L521 WeakPolarHBondContact O-CB 3.45Å; L517-L521 PolarHBondContact O-N 3.33Å; R519-L521 PolarHBondContact O-N 3.12Å; L521-Q525 VanDerWaalsContact O-CG 3.32Å; L521-Q525 WeakPolarHBondContact O-CG 3.37Å; L521-Q525 PolarHBondContact O-N 2.89Å
522	S	85.5	Confident	83.1	Confident	62 Å²	62	53.8 Å²	53.8	43%	0.434	26%	0.263	S	S	.	.	H	α-helix	trans	-73	-42.7	173.5	-57.9	0	0	0	0	111.6	L518 R519 Q520 Q525 E526	L518-S522 WeakPolarHBondContact O-CB 3.26Å; L518-S522 PolarHBondContact O-N 2.97Å; L518-S522 VanDerWaalsContact O-N 3.09Å; L518-S522 PolarHBondContact O-OG 3.32Å; R519-S522 WeakPolarHBondContact O-CA 3.43Å; R519-S522 WeakPolarHBondContact O-CB 3.37Å; R519-S522 PolarHBondContact O-N 2.88Å; Q520-S522 VanDerWaalsContact C-N 3.27Å; Q520-S522 PolarHBondContact O-N 2.93Å; S522-Q525 PolarHBondContact O-N 3.47Å; S522-E526 PolarHBondContact O-N 3.45Å; S522-E526 VanDerWaalsContact O-N 3.1Å
523	E	85.4	Confident	82.5	Confident	74 Å²	74	53.7 Å²	53.7	35%	0.346	26%	0.257	S	S	.	.	H	α-helix	trans	-57.9	-50.3	175.8	-67.6	174.9	135.6	0	0	111.3	L459 R519 Q520 Q525 E526 T527	L459-E523 HydrophobicContact CD2-CB 4.21Å; R519-E523 IonicContact CZ-OE1 3.45Å; R519-E523 IonicContact CZ-OE2 2.76Å; R519-E523 IonicContact NH1-OE1 3.68Å; R519-E523 PolarHBondContact NH1-OE1 2.86Å; R519-E523 IonicContact NH1-OE2 2.76Å; R519-E523 PolarHBondContact NH1-OE2 2.9Å; R519-E523 IonicContact NH2-OE1 3.77Å; R519-E523 IonicContact NH2-OE2 2.95Å; R519-E523 PolarHBondContact NH2-OE2 3.1Å; R519-E523 VanDerWaalsContact NH2-OE2 3.07Å; R519-E523 PolarHBondContact O-N 2.87Å; Q520-E523 WeakPolarHBondContact CA-OE2 3.29Å; Q520-E523 PolarHBondContact O-N 3.35Å; E523-Q525 VanDerWaalsContact C-N 3.31Å; E523-Q525 PolarHBondContact O-N 2.98Å; E523-E526 PolarHBondContact O-N 2.96Å; E523-T527 PolarHBondContact O-N 3.11Å
524	V	80	Confident	81.3	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.006	26%	0.259	C	S	.	.	H	α-helix	trans	-63.3	-32.9	177.5	169.2	0	0	0	0	112.8	L459 S477 L481 F484 Q520 E526 T527 M528	L459-V524 HydrophobicContact CD1-CG2 3.73Å; L459-V524 HydrophobicContact CD2-CG2 3.9Å; S477-V524 WeakPolarHBondContact O-CG1 3.45Å; L481-V524 HydrophobicContact CB-CG1 3.93Å; F484-V524 HydrophobicContact CE2-CG2 3.87Å; Q520-V524 WeakPolarHBondContact O-CG2 3.46Å; Q520-V524 PolarHBondContact O-N 2.9Å; V524-E526 VanDerWaalsContact C-N 3.29Å; V524-E526 PolarHBondContact O-N 3.35Å; V524-T527 PolarHBondContact O-OG1 3.13Å; V524-T527 VanDerWaalsContact O-OG1 3.07Å; V524-M528 WeakPolarHBondContact O-CB 3.34Å; V524-M528 VanDerWaalsContact O-CG 3.26Å; V524-M528 WeakPolarHBondContact O-CG 3.33Å; V524-M528 PolarHBondContact O-N 2.8Å
525	Q	82.7	Confident	79.7	Confident	79 Å²	79	54.9 Å²	54.9	37%	0.369	29%	0.285	S	S	.	.	H	α-helix	trans	-71.2	-24.4	173.3	-78.6	-174.6	48	0	0	113.5	L481 L521 S522 E523 R529	L481-Q525 HydrophobicContact CD1-CG 3.91Å; L521-Q525 VanDerWaalsContact O-CG 3.32Å; L521-Q525 WeakPolarHBondContact O-CG 3.37Å; L521-Q525 PolarHBondContact O-N 2.89Å; S522-Q525 PolarHBondContact O-N 3.47Å; E523-Q525 VanDerWaalsContact C-N 3.31Å; E523-Q525 PolarHBondContact O-N 2.98Å; Q525-R529 PolarHBondContact O-N 2.91Å; Q525-R529 PolarHBondContact O-NE 3.46Å
526	E	83.8	Confident	77.6	Confident	80 Å²	80	61.6 Å²	61.6	37%	0.374	31%	0.31	S	S	.	.	H	α-helix	trans	-82.5	-42.1	176.6	-153.9	62.1	-112.7	0	0	111.4	S522 E523 V524 M528 R529 Q530	S522-E526 PolarHBondContact O-N 3.45Å; S522-E526 VanDerWaalsContact O-N 3.1Å; E523-E526 PolarHBondContact O-N 2.96Å; V524-E526 VanDerWaalsContact C-N 3.29Å; V524-E526 PolarHBondContact O-N 3.35Å; E526-M528 VanDerWaalsContact C-N 3.33Å; E526-M528 PolarHBondContact O-N 3.09Å; E526-R529 VanDerWaalsContact CD-CZ 3.49Å; E526-R529 CarbonylContact O-C 3.59Å; E526-R529 WeakPolarHBondContact O-CA 3.31Å; E526-R529 WeakPolarHBondContact O-CB 3.48Å; E526-R529 PolarHBondContact O-N 3.2Å; E526-R529 IonicContact OE1-CZ 3.57Å; E526-R529 VanDerWaalsContact OE1-CZ 3.31Å; E526-R529 IonicContact OE1-NE 2.72Å; E526-R529 IonicContact OE1-NH1 3.15Å; E526-R529 PolarHBondContact OE1-NH1 3.34Å; E526-R529 IonicContact OE1-NH2 3.67Å; E526-R529 IonicContact OE2-CZ 2.7Å; E526-R529 IonicContact OE2-NH1 3.65Å; E526-R529 PolarHBondContact OE2-NH1 2.81Å; E526-R529 IonicContact OE2-NH2 3.17Å; E526-R529 PolarHBondContact OE2-NH2 3.08Å; E526-Q530 WeakPolarHBondContact O-CG 3.28Å; E526-Q530 PolarHBondContact O-N 3.42Å
527	T	78.5	Confident	75.1	Confident	32 Å²	32	65.2 Å²	65.2	20%	0.196	33%	0.33	C	S	.	.	H	α-helix	trans	-58.6	-44.8	173.3	61.8	0	0	0	0	111.3	T462 S477 E523 V524 R529 Q530 I531	T462-T527 HydrophobicContact CG2-CG2 3.86Å; S477-T527 PolarHBondContact OG-OG1 2.93Å; E523-T527 PolarHBondContact O-N 3.11Å; V524-T527 PolarHBondContact O-OG1 3.13Å; V524-T527 VanDerWaalsContact O-OG1 3.07Å; T527-R529 PolarHBondContact O-N 2.82Å; T527-Q530 PolarHBondContact O-N 2.94Å; T527-I531 WeakPolarHBondContact O-CG1 3.35Å; T527-I531 PolarHBondContact O-N 3.31Å
528	M	78.6	Confident	72.4	Confident	17 Å²	17	68.5 Å²	68.5	8%	0.084	35%	0.354	C	S	.	.	H	α-helix	trans	-64.2	-20.6	174	-69.4	-171.4	105.1	0	0	113.8	L474 A478 L481 V524 E526 K532	L474-M528 HydrophobicContact CD1-CB 4.4Å; L474-M528 HydrophobicContact CD1-CE 3.59Å; L474-M528 HydrophobicContact CD1-CG 4.03Å; L474-M528 HydrophobicContact CG-CE 4.45Å; A478-M528 HydrophobicContact CB-CE 3.89Å; L481-M528 HydrophobicContact CD2-SD 3.83Å; V524-M528 WeakPolarHBondContact O-CB 3.34Å; V524-M528 VanDerWaalsContact O-CG 3.26Å; V524-M528 WeakPolarHBondContact O-CG 3.33Å; V524-M528 PolarHBondContact O-N 2.8Å; E526-M528 VanDerWaalsContact C-N 3.33Å; E526-M528 PolarHBondContact O-N 3.09Å; M528-K532 WeakPolarHBondContact O-CB 3.37Å; M528-K532 WeakPolarHBondContact O-CD 3.47Å; M528-K532 WeakPolarHBondContact O-CG 3.39Å
529	R	80.2	Confident	69.7	Low	121 Å²	121	75 Å²	75	46%	0.457	39%	0.388	S	S	.	.	H	α-helix	trans	-83.7	-45.4	172.2	-93.1	-175.9	-82.6	132.1	-1.1	111.6	Q525 E526 T527 I531 K532 L533	Q525-R529 PolarHBondContact O-N 2.91Å; Q525-R529 PolarHBondContact O-NE 3.46Å; E526-R529 VanDerWaalsContact CD-CZ 3.49Å; E526-R529 CarbonylContact O-C 3.59Å; E526-R529 WeakPolarHBondContact O-CA 3.31Å; E526-R529 WeakPolarHBondContact O-CB 3.48Å; E526-R529 PolarHBondContact O-N 3.2Å; E526-R529 IonicContact OE1-CZ 3.57Å; E526-R529 VanDerWaalsContact OE1-CZ 3.31Å; E526-R529 IonicContact OE1-NE 2.72Å; E526-R529 IonicContact OE1-NH1 3.15Å; E526-R529 PolarHBondContact OE1-NH1 3.34Å; E526-R529 IonicContact OE1-NH2 3.67Å; E526-R529 IonicContact OE2-CZ 2.7Å; E526-R529 IonicContact OE2-NH1 3.65Å; E526-R529 PolarHBondContact OE2-NH1 2.81Å; E526-R529 IonicContact OE2-NH2 3.17Å; E526-R529 PolarHBondContact OE2-NH2 3.08Å; T527-R529 PolarHBondContact O-N 2.82Å; R529-I531 PolarHBondContact O-N 3.38Å; R529-K532 CarbonylContact O-C 3.56Å; R529-K532 PolarHBondContact O-N 3.13Å; R529-K532 VanDerWaalsContact O-N 3.15Å; R529-L533 WeakPolarHBondContact O-CG 3.37Å; R529-L533 PolarHBondContact O-N 3.46Å; R529-L533 VanDerWaalsContact O-N 3.1Å
530	Q	77.3	Confident	66.7	Low	118 Å²	118	73.6 Å²	73.6	55%	0.551	41%	0.409	S	S	*	.	H	α-helix	trans	-55.3	-49.5	176.7	-66.5	-74.1	25.7	0	0	111.6	E526 T527 K532 L533 S534	E526-Q530 WeakPolarHBondContact O-CG 3.28Å; E526-Q530 PolarHBondContact O-N 3.42Å; T527-Q530 PolarHBondContact O-N 2.94Å; Q530-K532 VanDerWaalsContact C-N 3.28Å; Q530-K532 PolarHBondContact O-N 2.91Å; Q530-L533 WeakPolarHBondContact O-CB 3.32Å; Q530-L533 PolarHBondContact O-N 3.16Å; Q530-S534 PolarHBondContact O-N 3.17Å; Q530-S534 PolarHBondContact O-OG 3.35Å
531	I	74.6	Confident	64	Low	25 Å²	25	79.2 Å²	79.2	13%	0.128	44%	0.444	C	S	.	.	H	α-helix	trans	-63.3	-34	179.6	-62.8	164	0	0	0	111.8	N470 I473 T527 R529 L533 S534 G535	N470-I531 HydrophobicContact CB-CG2 3.97Å; I473-I531 HydrophobicContact CB-CD1 3.97Å; I473-I531 HydrophobicContact CG2-CD1 3.57Å; T527-I531 WeakPolarHBondContact O-CG1 3.35Å; T527-I531 PolarHBondContact O-N 3.31Å; R529-I531 PolarHBondContact O-N 3.38Å; I531-L533 VanDerWaalsContact C-N 3.25Å; I531-L533 PolarHBondContact O-N 2.82Å; I531-S534 PolarHBondContact O-OG 3.45Å; I531-G535 PolarHBondContact O-N 3.48Å
532	K	73.2	Confident	61.3	Low	76 Å²	76	87 Å²	87	33%	0.33	48%	0.478	S	S	.	.	H	α-helix	trans	-80.1	-3.8	176.7	-69	176.2	-169.5	172	0	113.9	M528 R529 Q530 K536	M528-K532 WeakPolarHBondContact O-CB 3.37Å; M528-K532 WeakPolarHBondContact O-CD 3.47Å; M528-K532 WeakPolarHBondContact O-CG 3.39Å; R529-K532 CarbonylContact O-C 3.56Å; R529-K532 PolarHBondContact O-N 3.13Å; R529-K532 VanDerWaalsContact O-N 3.15Å; Q530-K532 VanDerWaalsContact C-N 3.28Å; Q530-K532 PolarHBondContact O-N 2.91Å; K532-K536 WeakPolarHBondContact O-CE 3.19Å
533	L	72.9	Confident	58.5	Low	100 Å²	100	89.4 Å²	89.4	52%	0.524	49%	0.494	S	S	.	.	H	α-helix	trans	-102.4	-40.9	172.3	-70.1	166.3	0	0	0	111.1	R529 Q530 I531	R529-L533 WeakPolarHBondContact O-CG 3.37Å; R529-L533 PolarHBondContact O-N 3.46Å; R529-L533 VanDerWaalsContact O-N 3.1Å; Q530-L533 WeakPolarHBondContact O-CB 3.32Å; Q530-L533 PolarHBondContact O-N 3.16Å; I531-L533 VanDerWaalsContact C-N 3.25Å; I531-L533 PolarHBondContact O-N 2.82Å
534	S	57.9	Low	55.7	Low	60 Å²	60	91.6 Å²	91.6	42%	0.42	52%	0.518	S	S	.	.	H	α-helix	trans	-65.1	-42.4	175.7	58.5	0	0	0	0	112.4	Q530 I531 K536 I537	Q530-S534 PolarHBondContact O-N 3.17Å; Q530-S534 PolarHBondContact O-OG 3.35Å; I531-S534 PolarHBondContact O-OG 3.45Å; S534-K536 PolarHBondContact O-N 2.78Å; S534-I537 PolarHBondContact O-N 3.25Å
535	G	55.2	Low	53.3	Low	58 Å²	58	98.7 Å²	98.7	60%	0.598	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	29.2	175.7	0	0	0	0	0	115.9	I531	I531-G535 PolarHBondContact O-N 3.48Å
536	K	43.5	Very low	50.8	Low	169 Å²	169	102.6 Å²	102.6	74%	0.735	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136	3.4	175.3	-63.7	-173	178	-177.4	0	113.6	K532 S534	K532-K536 WeakPolarHBondContact O-CE 3.19Å; S534-K536 PolarHBondContact O-N 2.78Å
537	I	34.6	Very low	48	Very low	148 Å²	148	102 Å²	102	76%	0.759	59%	0.591	S	S	*	*	S	Bend	trans	-118.7	-11.1	-167.3	-61.1	178.6	0	0	0	112.2	S534	S534-I537 PolarHBondContact O-N 3.25Å
538	S	29.2	Very low	45.6	Very low	81 Å²	81	107.9 Å²	107.9	57%	0.566	62%	0.616	S	S	*	*	S	Bend	trans	-109.6	154.1	171.2	67.7	0	0	0	0	113
539	D	31	Very low	43.2	Very low	141 Å²	141	113.7 Å²	113.7	75%	0.754	65%	0.648	S	S	*	*			trans	66.5	78.6	160.5	-45.4	-41.5	0	0	0	118.3	T541	D539-T541 PolarHBondContact O-N 3.48Å; D539-T541 VanDerWaalsContact O-N 3.14Å
540	G	26.7	Very low	40.7	Very low	82 Å²	82	112.3 Å²	112.3	85%	0.845	67%	0.671	S	S	*	*			trans	-81.9	71	173	0	0	0	0	0	114.9
541	T	28.7	Very low	38.3	Very low	128 Å²	128	114.9 Å²	114.9	79%	0.785	68%	0.677	S	S	*	*			trans	-133.6	4.7	173.7	-28.1	0	0	0	0	115	D539	D539-T541 PolarHBondContact O-N 3.48Å; D539-T541 VanDerWaalsContact O-N 3.14Å
542	F	28	Very low	35.9	Very low	176 Å²	176	118.5 Å²	118.5	77%	0.772	71%	0.705	S	S	*	*			trans	-102.6	39.7	-178.3	-104.3	-82.3	0	0	0	115.2	S544	F542-S544 PolarHBondContact O-N 2.84Å; F542-S544 VanDerWaalsContact O-N 3.16Å
543	S	25.7	Very low	33.7	Very low	112 Å²	112	117.6 Å²	117.6	78%	0.783	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	71.2	-176.8	-61.5	0	0	0	0	113.5
544	S	26.6	Very low	31.5	Very low	120 Å²	120	116.7 Å²	116.7	84%	0.839	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-159.3	-29.8	162	-84.4	0	0	0	0	116.6	F542	F542-S544 PolarHBondContact O-N 2.84Å; F542-S544 VanDerWaalsContact O-N 3.16Å
545	I	29.9	Very low	29.9	Very low	150 Å²	150	119.2 Å²	119.2	77%	0.769	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	-19.5	-169.1	-63.7	179.3	0	0	0	114	G547	I545-G547 PolarHBondContact O-N 2.9Å
546	I	30.3	Very low	28.5	Very low	160 Å²	160	124.1 Å²	124.1	82%	0.821	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	48.1	-177.9	-43.8	-174.5	0	0	0	111.7
547	G	25.6	Very low	27.6	Very low	68 Å²	68	120.5 Å²	120.5	70%	0.701	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-16.7	-179.6	0	0	0	0	0	115.3	I545	I545-G547 PolarHBondContact O-N 2.9Å
548	Q	28.2	Very low	27.3	Very low	155 Å²	155	123.6 Å²	123.6	72%	0.724	72%	0.724	S	S	*	*	S	Bend	trans	-148.3	93.2	-176.2	-67.6	-167.9	61.1	0	0	113.8
549	N	28.2	Very low	27.1	Very low	140 Å²	140	124.2 Å²	124.2	75%	0.749	72%	0.718	S	S	*	*			trans	177.8	82.2	143.5	-95.2	-38.4	0	0	0	112.5	Y551	N549-Y551 HydrophobicContact CB-CD2 4.33Å; N549-Y551 HydrophobicContact CB-CE2 4.41Å; N549-Y551 PolarHBondContact O-N 3.16Å
550	G	26.6	Very low	26.8	Very low	91 Å²	91	124.8 Å²	124.8	94%	0.938	72%	0.721	S	S	*	*			trans	-74	94.6	179.2	0	0	0	0	0	114.2
551	Y	26.7	Very low	26.7	Very low	172 Å²	172	129.9 Å²	129.9	68%	0.675	72%	0.716	S	S	*	*			trans	-104.3	114.8	171.9	-82.1	-86.8	0	0	0	112.2	K21 N549	K21-Y551 PolarHBondContact NZ-OH 2.93Å; N549-Y551 HydrophobicContact CB-CD2 4.33Å; N549-Y551 HydrophobicContact CB-CE2 4.41Å; N549-Y551 PolarHBondContact O-N 3.16Å
552	S	26	Very low	26.6	Very low	102 Å²	102	129 Å²	129	71%	0.713	72%	0.716	S	S	*	*			trans	-160.6	165.9	161	-167.6	0	0	0	0	111.7
553	S	25.7	Very low	26.4	Very low	56 Å²	56	128.5 Å²	128.5	39%	0.392	72%	0.719	S	S	.	*			trans	67.4	57.7	176.3	-153.5	0	0	0	0	117.2	K661	S553-K661 WeakPolarHBondContact OG-CE 3.26Å
554	A	26.6	Very low	26.4	Very low	82 Å²	82	133 Å²	133	68%	0.678	73%	0.725	S	S	*	*			trans	-123.9	-16.7	170.3	0	0	0	0	0	116
555	Y	25.2	Very low	26.5	Very low	113 Å²	113	133 Å²	133	44%	0.443	72%	0.72	S	S	.	*	S	Bend	trans	-122.6	89.4	179.2	-65.4	-74.3	0	0	0	110.6	T23 T24	T23-Y555 HydrophobicContact CG2-CE1 3.96Å; T23-Y555 VanDerWaalsContact CG2-OH 3.27Å; T23-Y555 WeakPolarHBondContact CG2-OH 3.23Å; T23-Y555 PolarHBondContact O-OH 3.47Å; T24-Y555 PolarHBondContact O-OH 3.49Å
556	N	24.7	Very low	26.2	Very low	160 Å²	160	134.2 Å²	134.2	86%	0.856	72%	0.722	S	S	*	*			trans	-171.9	68.1	169.1	-105.9	-17.5	0	0	0	110.5
557	T	26	Very low	26.2	Very low	94 Å²	94	136 Å²	136	58%	0.577	72%	0.724	S	S	*	*			trans	-158.4	147.8	166.2	-45.2	0	0	0	0	107.3
558	Y	26.7	Very low	26.2	Very low	212 Å²	212	140.2 Å²	140.2	83%	0.831	73%	0.731	S	S	*	*	S	Bend	trans	75.8	37.9	-173.8	-52.4	-77	0	0	0	117.4
559	E	26.1	Very low	26.3	Very low	94 Å²	94	140.5 Å²	140.5	44%	0.439	74%	0.735	S	S	.	*	S	Bend	trans	-174	100.2	135.4	-108.2	166.8	-159.8	0	0	109.5
560	N	24.7	Very low	26.1	Very low	153 Å²	153	139.3 Å²	139.3	82%	0.818	73%	0.733	S	S	*	*			trans	-177.7	52.6	167.6	-112.7	-71.1	0	0	0	112.5
561	Y	25.3	Very low	26.2	Very low	189 Å²	189	142.6 Å²	142.6	74%	0.741	73%	0.73	S	S	*	*			trans	-148.9	82.8	170.8	-87.1	-76.3	0	0	0	111.4
562	S	24.7	Very low	26.2	Very low	110 Å²	110	139.9 Å²	139.9	77%	0.769	73%	0.731	S	S	*	*			trans	158.4	77.6	133	-166.7	0	0	0	0	111.9
563	I	25.5	Very low	26.3	Very low	165 Å²	165	142.3 Å²	142.3	85%	0.846	73%	0.734	S	S	*	*			trans	-125.6	88.7	153.7	-57	-178.3	0	0	0	107.3
564	K	24	Very low	26.4	Very low	208 Å²	208	145.1 Å²	145.1	90%	0.904	75%	0.745	S	S	*	*			trans	-137.6	60.4	166.2	-89	-161.7	172.2	-172.3	0	109.1
565	T	28.9	Very low	26.4	Very low	120 Å²	120	147.1 Å²	147.1	74%	0.736	74%	0.744	S	S	*	*			trans	-111.7	129.8	178	-37.6	0	0	0	0	108.7
566	Q	25.1	Very low	26.6	Very low	174 Å²	174	147.7 Å²	147.7	81%	0.813	76%	0.755	S	S	*	*			trans	-69.9	144.3	-167.7	-51.2	112.3	-25.4	0	0	112.6
567	K	29.4	Very low	26.8	Very low	197 Å²	197	146.8 Å²	146.8	86%	0.857	75%	0.75	S	S	*	*				-166.2	128.3	117.4	-104.8	162.2	-175.2	179.3	0	111.7
568	N	25.7	Very low	27	Very low	158 Å²	158	149.3 Å²	149.3	85%	0.845	76%	0.758	S	S	*	*			trans	-75.2	129.3	163.6	-65.2	-12.7	0	0	0	108.2
569	I	30.4	Very low	27.2	Very low	161 Å²	161	147 Å²	147	83%	0.826	76%	0.755	S	S	*	*			trans	-130.5	105.8	146.4	-61.1	-176.4	0	0	0	106.4
570	T	23.4	Very low	27.3	Very low	115 Å²	115	149.4 Å²	149.4	71%	0.706	77%	0.771	S	S	*	*			trans	-74.4	139.3	164.7	44.5	0	0	0	0	109.2
571	N	29.4	Very low	27.6	Very low	160 Å²	160	145.3 Å²	145.3	86%	0.856	77%	0.765	S	S	*	*			trans	-157.8	125	134.2	-100.7	-15.6	0	0	0	112.5
572	T	25.6	Very low	27.8	Very low	114 Å²	114	141.7 Å²	141.7	70%	0.699	77%	0.767	S	S	*	*			trans	-56.6	154.1	167.7	-41.8	0	0	0	0	112
573	I	28.4	Very low	28.2	Very low	153 Å²	153	143.9 Å²	143.9	79%	0.785	77%	0.768	S	S	*	*				178	108.3	126.4	-89.9	156.6	0	0	0	111.8
574	N	28.6	Very low	28.4	Very low	116 Å²	116	141.4 Å²	141.4	62%	0.62	76%	0.757	S	S	*	*			trans	53.3	119.9	133.3	-58.4	-0.1	0	0	0	123.9
575	N	27.4	Very low	28.8	Very low	123 Å²	123	139.7 Å²	139.7	66%	0.658	75%	0.752	S	S	*	*				87.7	112.4	115	-65.8	5.2	0	0	0	123.4
576	N	28.1	Very low	28.7	Very low	125 Å²	125	143 Å²	143	67%	0.668	76%	0.756	S	S	*	*				87.4	143.9	120.9	-61.6	-3.4	0	0	0	122
577	N	29.2	Very low	28.9	Very low	141 Å²	141	142.4 Å²	142.4	75%	0.754	76%	0.757	S	S	*	*			trans	74.7	142.6	153.9	-64	-9.5	0	0	0	117.9
578	I	31	Very low	28.9	Very low	147 Å²	147	138 Å²	138	75%	0.754	75%	0.747	S	S	*	*			cis	-150.4	162.8	-0.4	-123.2	161.9	0	0	0	112.6
579	H	30.2	Very low	28.9	Very low	163 Å²	163	135.7 Å²	135.7	76%	0.755	74%	0.743	S	S	*	*			trans	-28.7	158.8	163.1	-101.5	-38.7	0	0	0	117.3
580	N	29.3	Very low	28.9	Very low	146 Å²	146	133.3 Å²	133.3	78%	0.781	74%	0.741	S	S	*	*				-172.5	166.8	53.5	-128.9	-24	0	0	0	114.6
581	G	30.3	Very low	29.1	Very low	67 Å²	67	132.1 Å²	132.1	69%	0.691	74%	0.742	S	S	*	*			trans	81.6	106.2	166.7	0	0	0	0	0	115.9
582	S	29.3	Very low	29	Very low	112 Å²	112	135.7 Å²	135.7	78%	0.783	75%	0.745	S	S	*	*			cis	87.8	108.5	23.4	-163.6	0	0	0	0	116.1
583	I	33.5	Very low	29.1	Very low	156 Å²	156	135 Å²	135	80%	0.8	75%	0.746	S	S	*	*			trans	-166.3	113	140.8	-97	151.3	0	0	0	108.8
584	N	30.1	Very low	29	Very low	113 Å²	113	136.4 Å²	136.4	60%	0.604	75%	0.749	S	S	*	*			trans	48.8	146.1	136.7	-55.7	29.5	0	0	0	122
585	E	30.8	Very low	29	Very low	173 Å²	173	139.3 Å²	139.3	81%	0.808	76%	0.756	S	S	*	*			cis	-156	169.5	-9.5	-120	162.7	150.7	0	0	113
586	K	27.3	Very low	29.1	Very low	189 Å²	189	142.8 Å²	142.8	82%	0.822	77%	0.768	S	S	*	*			trans	-86.3	161.5	-179.7	-60	165.7	179.1	168.6	0	112
587	I	30.5	Very low	29.1	Very low	161 Å²	161	141.7 Å²	141.7	83%	0.826	77%	0.77	S	S	*	*			trans	155.4	138.5	146.3	-87.6	155.1	0	0	0	108.5
588	T	28.7	Very low	28.8	Very low	106 Å²	106	143.4 Å²	143.4	65%	0.65	77%	0.771	S	S	*	*			cis	176.6	138.3	-41.6	25.3	0	0	0	0	106.7
589	S	26	Very low	28.9	Very low	109 Å²	109	142.5 Å²	142.5	76%	0.762	78%	0.775	S	S	*	*			trans	74.8	159.9	145.3	71.6	0	0	0	0	123
590	S	30.3	Very low	28.7	Very low	111 Å²	111	141.8 Å²	141.8	78%	0.776	77%	0.77	S	S	*	*			trans	57.8	128	179.2	57.1	0	0	0	0	118.3
591	A	26.2	Very low	28.6	Very low	89 Å²	89	143.9 Å²	143.9	74%	0.736	78%	0.777	S	S	*	*			cis	90.5	121.8	17.6	0	0	0	0	0	117
592	Y	29	Very low	28.5	Very low	235 Å²	235	146.3 Å²	146.3	92%	0.922	77%	0.774	S	S	*	*			trans	-158.3	160.3	140.1	-113.9	-78.5	0	0	0	109.8
593	S	26.5	Very low	28.6	Very low	101 Å²	101	148.2 Å²	148.2	71%	0.706	78%	0.776	S	S	*	*			trans	-150.4	149.6	-168.4	-52.9	0	0	0	0	112.4
594	E	27.8	Very low	28.4	Very low	182 Å²	182	149.5 Å²	149.5	85%	0.85	78%	0.778	S	S	*	*			trans	-176.3	164.5	152.5	-106.4	164.7	-176.5	0	0	110.3
595	K	27.3	Very low	28.4	Very low	176 Å²	176	149.4 Å²	149.4	77%	0.765	78%	0.781	S	S	*	*				177.1	121.9	-59	-101.6	175.2	177.5	173.6	0	107.1
596	Q	29.5	Very low	28.5	Very low	196 Å²	196	148.1 Å²	148.1	92%	0.916	78%	0.78	S	S	*	*			trans	165.8	155.7	155.5	-98.2	162.8	60.9	0	0	109.8
597	S	28.5	Very low	28.5	Very low	102 Å²	102	144.9 Å²	144.9	71%	0.713	77%	0.772	S	S	*	*				-160.9	132.9	-59.7	42.1	0	0	0	0	111.2
598	F	23.6	Very low	28.4	Very low	177 Å²	177	148 Å²	148	78%	0.776	78%	0.775	S	S	*	*			trans	-6.4	152.7	155.1	-77.8	-67.7	0	0	0	120.9	K600	F598-K600 HydrophobicContact CD1-CG 4.37Å; F598-K600 HydrophobicContact CE1-CG 4.45Å
599	P	32.1	Very low	28.4	Very low	128 Å²	128	148.8 Å²	148.8	83%	0.831	78%	0.78	S	S	*	*				-138.8	-179.5	54.1	40.2	-21.7	0	0	0	118.4
600	K	25.8	Very low	28.4	Very low	149 Å²	149	155 Å²	155	65%	0.648	79%	0.786	S	S	*	*			trans	-99.2	164.7	178.8	-50.2	174.3	-179	179.2	0	111.6	F598	F598-K600 HydrophobicContact CD1-CG 4.37Å; F598-K600 HydrophobicContact CE1-CG 4.45Å
601	M	28.4	Very low	28.3	Very low	189 Å²	189	158.4 Å²	158.4	93%	0.931	79%	0.79	S	S	*	*			trans	-136.4	157.3	134.8	-78.7	-149.5	-61.7	0	0	109.1
602	D	28.2	Very low	28.6	Very low	118 Å²	118	161.7 Å²	161.7	63%	0.631	80%	0.795	S	S	*	*			trans	-109.6	-178.1	-165.9	-52.6	-81.6	0	0	0	112.8
603	N	30.3	Very low	28.4	Very low	152 Å²	152	162.3 Å²	162.3	81%	0.813	80%	0.795	S	S	*	*			trans	101.8	136.2	157.3	-57.2	-30.9	0	0	0	120.7
604	E	30.7	Very low	28.5	Very low	183 Å²	183	163 Å²	163	86%	0.855	80%	0.8	S	S	*	*			trans	71.5	143.3	154.8	-68.9	175.6	-176	0	0	122.2
605	V	29.4	Very low	28.7	Very low	111 Å²	111	160 Å²	160	67%	0.673	80%	0.799	S	S	*	*			cis	-176.6	148.7	-43.7	129.6	0	0	0	0	109.5
606	N	31.7	Very low	28.7	Very low	146 Å²	146	159.2 Å²	159.2	78%	0.781	80%	0.804	S	S	*	*			trans	63.3	154.2	166.3	-72.1	-2.4	0	0	0	119.1
607	D	28.8	Very low	28.7	Very low	122 Å²	122	154.9 Å²	154.9	65%	0.652	80%	0.795	S	S	*	*			cis	-162.3	-151.6	-29	-159.9	-21.9	0	0	0	107.8
608	Y	28.3	Very low	28.6	Very low	227 Å²	227	155.9 Å²	155.9	89%	0.89	80%	0.797	S	S	*	*			trans	88.4	51.7	179.5	-59.2	-68.1	0	0	0	117.3
609	T	28.1	Very low	28.8	Very low	122 Å²	122	156.7 Å²	156.7	75%	0.748	80%	0.8	S	S	*	*			trans	-131.8	121.5	141	59.2	0	0	0	0	111.8
610	R	26.6	Very low	28.5	Very low	239 Å²	239	154.6 Å²	154.6	90%	0.902	79%	0.789	S	S	*	*			trans	125.1	80.9	159.4	-170.1	-167.5	-53.9	-179.8	3.9	115.6
611	E	28.4	Very low	28.6	Very low	183 Å²	183	152.1 Å²	152.1	86%	0.855	79%	0.79	S	S	*	*			trans	-166	145.2	149.3	-108.3	170.5	-159.7	0	0	106.2
612	L	31	Very low	28.6	Very low	158 Å²	158	152 Å²	152	83%	0.827	78%	0.784	S	S	*	*			cis	-123.7	144.9	8	-69.8	156.1	0	0	0	111.1
613	R	24.6	Very low	28.6	Very low	247 Å²	247	151.2 Å²	151.2	93%	0.932	79%	0.788	S	S	*	*			trans	-145.6	85	167.6	-139.6	-166	-164.1	-164.8	6	110
614	S	30.4	Very low	28.6	Very low	115 Å²	115	149.2 Å²	149.2	80%	0.804	79%	0.786	S	S	*	*			trans	-168.8	165.6	170.8	-100.6	0	0	0	0	111.6
615	S	31.9	Very low	28.7	Very low	120 Å²	120	148.4 Å²	148.4	84%	0.839	79%	0.786	S	S	*	*			trans	67.9	102	166.5	-54.8	0	0	0	0	117.8
616	N	27	Very low	28.7	Very low	160 Å²	160	150.4 Å²	150.4	86%	0.856	79%	0.792	S	S	*	*			trans	-69.3	154.2	159.4	-56.8	-54.5	0	0	0	110.5
617	S	28.6	Very low	28.9	Very low	105 Å²	105	148 Å²	148	73%	0.734	79%	0.785	S	S	*	*				157.7	131.3	111.2	59.9	0	0	0	0	115.1
618	T	27.7	Very low	28.9	Very low	123 Å²	123	148.8 Å²	148.8	76%	0.755	79%	0.789	S	S	*	*			trans	43.8	125.4	144.2	48.5	0	0	0	0	123.9
619	F	27.6	Very low	29.1	Very low	193 Å²	193	145.6 Å²	145.6	85%	0.846	79%	0.787	S	S	*	*			trans	86.7	116.1	131.2	-100.9	-125.3	0	0	0	122.9
620	S	26.1	Very low	29.1	Very low	85 Å²	85	149.3 Å²	149.3	59%	0.594	79%	0.793	S	S	*	*				89	101.1	112.8	-175	0	0	0	0	122.3
621	S	27.5	Very low	29.3	Very low	96 Å²	96	144.5 Å²	144.5	67%	0.671	79%	0.789	S	S	*	*				84.9	126.2	119.5	-56.9	0	0	0	0	123.1
622	K	28.8	Very low	29.1	Very low	187 Å²	187	144.1 Å²	144.1	81%	0.813	79%	0.788	S	S	*	*			trans	73.2	97.3	130.2	-71.9	-179.2	177.2	-178.7	0	121.2
623	S	27.8	Very low	29.2	Very low	102 Å²	102	144.4 Å²	144.4	71%	0.713	79%	0.79	S	S	*	*				55	127.7	117.5	65.4	0	0	0	0	122.2
624	S	30.2	Very low	29.4	Very low	109 Å²	109	140.8 Å²	140.8	76%	0.762	78%	0.784	S	S	*	*			trans	-164.4	129.1	131.3	8.8	0	0	0	0	115.2
625	I	32.5	Very low	29.3	Very low	166 Å²	166	142.4 Å²	142.4	85%	0.851	78%	0.784	S	S	*	*			trans	77.9	146.6	134.8	-62.1	168.8	0	0	0	120.7
626	L	29.4	Very low	29.2	Very low	154 Å²	154	144.3 Å²	144.3	81%	0.806	78%	0.783	S	S	*	*			trans	-116.9	-175.2	-172.1	-110.1	71.9	0	0	0	109.6
627	P	35.7	Very low	29.3	Very low	96 Å²	96	142.6 Å²	142.6	62%	0.623	78%	0.784	S	S	*	*			cis	-138.2	-154.8	-28.6	37.7	-16.9	0	0	0	112.8
628	N	28.2	Very low	29.3	Very low	138 Å²	138	148.8 Å²	148.8	74%	0.738	79%	0.791	S	S	*	*			trans	72.1	115	164.4	-63.7	-13.4	0	0	0	117.2
629	N	33.4	Very low	29.4	Very low	160 Å²	160	151.4 Å²	151.4	86%	0.856	80%	0.795	S	S	*	*				-156.5	173.7	60.1	-97.6	-52.1	0	0	0	114.4
630	K	27.4	Very low	29.4	Very low	200 Å²	200	151.2 Å²	151.2	87%	0.87	79%	0.794	S	S	*	*			trans	-81.2	122.4	-176.2	-56.9	170.6	-177.7	173.8	0	113.2
631	V	30.4	Very low	29.7	Very low	137 Å²	137	154.4 Å²	154.4	83%	0.83	81%	0.805	S	S	*	*			trans	-141.9	151.8	144.2	-178.3	0	0	0	0	108.1
632	E	26.1	Very low	29.9	Very low	175 Å²	175	154.9 Å²	154.9	82%	0.818	81%	0.808	S	S	*	*			trans	-51.6	141.3	-179.7	-63.8	147	176.2	0	0	114.1
633	N	31.8	Very low	30.8	Very low	165 Å²	165	153.1 Å²	153.1	88%	0.882	81%	0.807	S	S	*	*			trans	-157	129.8	156.2	-107.6	-60.1	0	0	0	110.7
634	E	28.3	Very low	31.6	Very low	171 Å²	171	155.9 Å²	155.9	80%	0.799	80%	0.802	S	S	*	*			trans	-83.1	162.4	168.3	-61.5	-171.8	137.4	0	0	110.6
635	N	29.4	Very low	33	Very low	149 Å²	149	153.6 Å²	153.6	80%	0.797	79%	0.785	S	S	*	*			trans	71.5	98	177.3	-47.1	-83.2	0	0	0	116.3
636	L	29.3	Very low	35.2	Very low	160 Å²	160	151.4 Å²	151.4	84%	0.838	77%	0.773	S	S	*	*			trans	-168.8	79.1	139.3	-108.9	161.6	0	0	0	112.9
637	S	28.7	Very low	37.8	Very low	124 Å²	124	145.8 Å²	145.8	87%	0.867	74%	0.744	S	S	*	*			trans	-146.4	55.8	166.2	-79.7	0	0	0	0	111.6
638	R	29.3	Very low	40.2	Very low	235 Å²	235	145.7 Å²	145.7	89%	0.887	74%	0.735	S	S	*	*			trans	-133.6	72.3	166.3	-74.7	-168.2	-179.7	-168.3	3.7	109.6
639	Q	30.2	Very low	42.8	Very low	177 Å²	177	141.9 Å²	141.9	83%	0.827	72%	0.719	S	S	*	*			trans	-95.9	102.2	173.5	-76.2	-174.6	-20.6	0	0	110.9
640	F	27.6	Very low	45.4	Very low	190 Å²	190	134.4 Å²	134.4	83%	0.833	68%	0.679	S	S	*	*			trans	20.7	91.6	152.8	-59	-84.4	0	0	0	119.7	S642	F640-S642 PolarHBondContact O-N 3.33Å
641	D	31	Very low	48.5	Very low	152 Å²	152	126.7 Å²	126.7	81%	0.813	65%	0.646	S	S	*	*			trans	-74.8	90.5	148.6	-110.7	-38.8	0	0	0	109	N643	D641-N643 PolarHBondContact O-N 3.45Å; D641-N643 VanDerWaalsContact O-N 3.07Å
642	S	33.2	Very low	51.3	Low	106 Å²	106	125.6 Å²	125.6	74%	0.741	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	0.9	-169.7	54.2	0	0	0	0	115.7	F640	F640-S642 PolarHBondContact O-N 3.33Å
643	N	46.4	Very low	54.4	Low	150 Å²	150	119.8 Å²	119.8	80%	0.802	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.2	0.3	-174.5	-77.2	-42.9	0	0	0	115.3	D641	D641-N643 PolarHBondContact O-N 3.45Å; D641-N643 VanDerWaalsContact O-N 3.07Å
644	R	44.3	Very low	57.3	Low	160 Å²	160	112.2 Å²	112.2	60%	0.604	57%	0.568	S	S	*	*	S	Bend	trans	-88.9	123	178.3	-156.5	176.5	-166.2	166.7	5.9	110.5	L696	R644-L696 VanDerWaalsContact CZ-O 3.3Å; R644-L696 PolarHBondContact NE-O 3.38Å; R644-L696 PolarHBondContact NH2-O 2.88Å
645	P	60.3	Low	60.3	Low	61 Å²	61	105.6 Å²	105.6	40%	0.396	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-66.8	146	-179	27.3	-34.3	0	0	0	111.2	L696 H697	P645-L696 HydrophobicContact CG-CD1 4.49Å; P645-H697 PolarHBondContact O-CE1 3.27Å; P645-H697 PolarHBondContact O-NE2 2.75Å
646	I	79.8	Confident	63.4	Low	119 Å²	119	105.8 Å²	105.8	61%	0.61	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-61.2	143.8	178.2	-56.9	174.6	0	0	0	109.9	E648 S649 T650	I646-E648 VanDerWaalsContact C-N 3.26Å; I646-E648 HydrophobicContact CG2-CB 4.27Å; I646-E648 PolarHBondContact O-N 3.09Å; I646-S649 PolarHBondContact N-OG 2.72Å; I646-S649 PolarHBondContact O-N 3.05Å; I646-S649 PolarHBondContact O-OG 3.2Å; I646-S649 VanDerWaalsContact O-OG 3.05Å; I646-T650 WeakPolarHBondContact O-CB 3.28Å; I646-T650 PolarHBondContact O-N 2.91Å; I646-T650 PolarHBondContact O-OG1 2.86Å
647	I	83.2	Confident	66.3	Low	36 Å²	36	101.4 Å²	101.4	19%	0.185	51%	0.507	C	S	.	.	H	α-helix	trans	-58	-39.4	-179.7	-80.4	172.2	0	0	0	111.5	T650 F651 F693 H697 D705 T708	I647-T650 WeakPolarHBondContact O-CB 3.47Å; I647-T650 PolarHBondContact O-N 3.34Å; I647-F651 WeakPolarHBondContact O-CB 3.43Å; I647-F651 PolarHBondContact O-N 2.97Å; I647-F693 HydrophobicContact CB-CZ 4.46Å; I647-F693 HydrophobicContact CD1-CZ 4.4Å; I647-F693 HydrophobicContact CG1-CE2 4.39Å; I647-F693 HydrophobicContact CG1-CZ 4.05Å; I647-F693 HydrophobicContact CG2-CE2 3.98Å; I647-F693 HydrophobicContact CG2-CZ 3.86Å; I647-H697 HydrophobicContact CD1-CB 4.34Å; I647-H697 HydrophobicContact CG1-CB 4.19Å; I647-D705 VanDerWaalsContact CD1-OD1 3.25Å; I647-D705 WeakPolarHBondContact CD1-OD1 3.46Å; I647-T708 HydrophobicContact CG2-CG2 4.34Å
648	E	85.3	Confident	69.4	Low	95 Å²	95	95.8 Å²	95.8	44%	0.444	47%	0.467	S	S	.	.	H	α-helix	trans	-67.2	-44.7	176.2	-61.8	-178.2	163.1	0	0	112.9	I646 T650 F651 L652 T708	I646-E648 VanDerWaalsContact C-N 3.26Å; I646-E648 HydrophobicContact CG2-CB 4.27Å; I646-E648 PolarHBondContact O-N 3.09Å; E648-T650 VanDerWaalsContact C-N 3.26Å; E648-T650 PolarHBondContact O-N 3.31Å; E648-F651 WeakPolarHBondContact O-CB 3.24Å; E648-F651 PolarHBondContact O-N 2.93Å; E648-L652 WeakPolarHBondContact O-CG 3.28Å; E648-L652 PolarHBondContact O-N 3.28Å; E648-T708 HydrophobicContact CB-CG2 4.39Å; E648-T708 HydrophobicContact CG-CG2 3.82Å
649	S	83.4	Confident	72.4	Confident	57 Å²	57	87.3 Å²	87.3	40%	0.399	44%	0.442	S	S	.	.	H	α-helix	trans	-67.5	-29.8	175.8	68.4	0	0	0	0	112	I646 L653	I646-S649 PolarHBondContact N-OG 2.72Å; I646-S649 PolarHBondContact O-N 3.05Å; I646-S649 PolarHBondContact O-OG 3.2Å; I646-S649 VanDerWaalsContact O-OG 3.05Å; S649-L653 VanDerWaalsContact O-CB 3.26Å; S649-L653 WeakPolarHBondContact O-CB 3.1Å; S649-L653 PolarHBondContact O-N 3.04Å
650	T	88.7	Confident	75.2	Confident	4 Å²	4	83.4 Å²	83.4	3%	0.025	42%	0.424	C	S	.	.	H	α-helix	trans	-68.3	-42.3	171.4	-51.7	0	0	0	0	111.6	I646 I647 E648 L653 L654 F693 L696 H697	I646-T650 WeakPolarHBondContact O-CB 3.28Å; I646-T650 PolarHBondContact O-N 2.91Å; I646-T650 PolarHBondContact O-OG1 2.86Å; I647-T650 WeakPolarHBondContact O-CB 3.47Å; I647-T650 PolarHBondContact O-N 3.34Å; E648-T650 VanDerWaalsContact C-N 3.26Å; E648-T650 PolarHBondContact O-N 3.31Å; T650-L653 PolarHBondContact O-N 2.89Å; T650-L654 HydrophobicContact CG2-CD1 4.34Å; T650-L654 WeakPolarHBondContact O-CB 3.24Å; T650-L654 WeakPolarHBondContact O-CG 3.4Å; T650-L654 PolarHBondContact O-N 2.98Å; T650-F693 HydrophobicContact CG2-CD2 4.05Å; T650-L696 HydrophobicContact CG2-CD1 4.03Å; T650-H697 PolarHBondContact OG1-NE2 3.46Å
651	F	91.9	Very high	78.2	Confident	38 Å²	38	78.3 Å²	78.3	17%	0.167	40%	0.401	C	S	.	.	H	α-helix	trans	-62.5	-44.4	173.9	165.1	-97.4	0	0	0	112.2	I647 E648 L654 S655 T708 M709 P711 L712	I647-F651 WeakPolarHBondContact O-CB 3.43Å; I647-F651 PolarHBondContact O-N 2.97Å; E648-F651 WeakPolarHBondContact O-CB 3.24Å; E648-F651 PolarHBondContact O-N 2.93Å; F651-L654 PolarHBondContact O-N 2.96Å; F651-S655 WeakPolarHBondContact O-CB 3.34Å; F651-S655 PolarHBondContact O-N 3.37Å; F651-S655 PolarHBondContact O-OG 3.11Å; F651-T708 HydrophobicContact CB-CG2 3.85Å; F651-T708 HydrophobicContact CD1-CG2 4.18Å; F651-T708 WeakPolarHBondContact CD2-O 3.34Å; F651-T708 WeakPolarHBondContact CE2-O 3.45Å; F651-T708 HydrophobicContact CG-CG2 3.97Å; F651-M709 HydrophobicContact CB-SD 4.03Å; F651-M709 HydrophobicContact CD2-SD 3.89Å; F651-M709 HydrophobicContact CG-SD 4.43Å; F651-P711 HydrophobicContact CE2-CB 4.33Å; F651-P711 HydrophobicContact CE2-CG 4.23Å; F651-P711 HydrophobicContact CZ-CB 4.41Å; F651-P711 HydrophobicContact CZ-CG 4.11Å; F651-L712 HydrophobicContact CD2-CD1 3.91Å; F651-L712 HydrophobicContact CD2-CG 4.19Å; F651-L712 HydrophobicContact CE2-CD1 4.2Å; F651-L712 HydrophobicContact CE2-CG 3.97Å
652	L	89.2	Confident	81.1	Confident	114 Å²	114	71.7 Å²	71.7	60%	0.597	37%	0.365	S	S	*	.	H	α-helix	trans	-63.2	-44.6	176.2	-70.6	170.5	0	0	0	111.5	E648 S655 K656	E648-L652 WeakPolarHBondContact O-CG 3.28Å; E648-L652 PolarHBondContact O-N 3.28Å; L652-S655 PolarHBondContact O-N 2.85Å; L652-K656 WeakPolarHBondContact O-CB 3.28Å; L652-K656 PolarHBondContact O-N 2.91Å
653	L	90.2	Very high	83.7	Confident	52 Å²	52	73.3 Å²	73.3	27%	0.272	36%	0.362	S	S	.	.	H	α-helix	trans	-61.2	-43.5	175.6	178.5	61.7	0	0	0	112.3	S649 T650 R657	S649-L653 VanDerWaalsContact O-CB 3.26Å; S649-L653 WeakPolarHBondContact O-CB 3.1Å; S649-L653 PolarHBondContact O-N 3.04Å; T650-L653 PolarHBondContact O-N 2.89Å; L653-R657 HydrophobicContact CD1-CG 4.43Å; L653-R657 WeakPolarHBondContact O-CB 3.31Å; L653-R657 VanDerWaalsContact O-CG 3.29Å; L653-R657 WeakPolarHBondContact O-CG 3.37Å; L653-R657 PolarHBondContact O-N 3.24Å
654	L	93.3	Very high	85.6	Confident	7 Å²	7	70.3 Å²	70.3	4%	0.037	35%	0.345	C	S	.	.	H	α-helix	trans	-66.8	-42	176.8	-78.4	177.6	0	0	0	112.2	T650 F651 R657 L658 A689 Y692 F693 L712	T650-L654 HydrophobicContact CG2-CD1 4.34Å; T650-L654 WeakPolarHBondContact O-CB 3.24Å; T650-L654 WeakPolarHBondContact O-CG 3.4Å; T650-L654 PolarHBondContact O-N 2.98Å; F651-L654 PolarHBondContact O-N 2.96Å; L654-R657 PolarHBondContact O-N 3.24Å; L654-L658 WeakPolarHBondContact O-CB 3.22Å; L654-L658 VanDerWaalsContact O-CG 3.28Å; L654-L658 WeakPolarHBondContact O-CG 3.45Å; L654-L658 PolarHBondContact O-N 3.04Å; L654-A689 WeakPolarHBondContact CD1-O 3.37Å; L654-A689 HydrophobicContact CD2-CB 3.89Å; L654-Y692 HydrophobicContact CD1-CD1 4.4Å; L654-Y692 HydrophobicContact CD2-CD1 3.71Å; L654-Y692 HydrophobicContact CD2-CE1 4.36Å; L654-Y692 HydrophobicContact CD2-CG 4.47Å; L654-Y692 HydrophobicContact CG-CD1 4.27Å; L654-F693 HydrophobicContact CD1-CB 3.93Å; L654-F693 HydrophobicContact CD1-CD2 4.31Å; L654-L712 HydrophobicContact CB-CD1 4.2Å
655	S	92.6	Very high	87.7	Confident	31 Å²	31	65.2 Å²	65.2	22%	0.217	34%	0.337	C	S	.	.	H	α-helix	trans	-63.2	-47	177.4	-60.7	0	0	0	0	111.1	F651 L652 R657 L658 T659	F651-S655 WeakPolarHBondContact O-CB 3.34Å; F651-S655 PolarHBondContact O-N 3.37Å; F651-S655 PolarHBondContact O-OG 3.11Å; L652-S655 PolarHBondContact O-N 2.85Å; S655-R657 PolarHBondContact O-N 3.33Å; S655-L658 PolarHBondContact O-N 2.92Å; S655-L658 VanDerWaalsContact O-N 3.15Å; S655-T659 PolarHBondContact O-N 3.44Å; S655-T659 PolarHBondContact O-OG1 3.06Å
656	K	92.5	Very high	89	Confident	153 Å²	153	69.3 Å²	69.3	67%	0.665	36%	0.356	S	S	*	.	H	α-helix	trans	-57.9	-49.1	174.4	-175.4	174.6	179.4	176.9	0	112	L652 L658 T659 E660	L652-K656 WeakPolarHBondContact O-CB 3.28Å; L652-K656 PolarHBondContact O-N 2.91Å; K656-L658 PolarHBondContact O-N 2.73Å; K656-T659 PolarHBondContact O-N 3.33Å; K656-E660 VanDerWaalsContact O-CB 3.3Å; K656-E660 WeakPolarHBondContact O-CB 3.31Å; K656-E660 PolarHBondContact O-N 3.09Å
657	R	92	Very high	89.5	Confident	68 Å²	68	64.8 Å²	64.8	26%	0.257	33%	0.331	S	S	.	.	H	α-helix	trans	-61.6	-27	177.4	-77.6	174.4	172.3	166.8	1.6	113.5	L653 L654 S655 K661 Y692	L653-R657 HydrophobicContact CD1-CG 4.43Å; L653-R657 WeakPolarHBondContact O-CB 3.31Å; L653-R657 VanDerWaalsContact O-CG 3.29Å; L653-R657 WeakPolarHBondContact O-CG 3.37Å; L653-R657 PolarHBondContact O-N 3.24Å; L654-R657 PolarHBondContact O-N 3.24Å; S655-R657 PolarHBondContact O-N 3.33Å; R657-K661 WeakPolarHBondContact O-CB 3.43Å; R657-K661 VanDerWaalsContact O-CG 3.3Å; R657-K661 WeakPolarHBondContact O-CG 3.48Å; R657-K661 PolarHBondContact O-N 3.3Å; R657-Y692 PolarHBondContact NH1-OH 2.88Å
658	L	93.3	Very high	89.8	Confident	6 Å²	6	64.8 Å²	64.8	3%	0.031	33%	0.334	C	S	.	.	H	α-helix	trans	-77.6	-44.1	175.4	-75.7	165.1	0	0	0	111.7	L654 S655 K656 K661 R662 A685 L686 A689 L712	L654-L658 WeakPolarHBondContact O-CB 3.22Å; L654-L658 VanDerWaalsContact O-CG 3.28Å; L654-L658 WeakPolarHBondContact O-CG 3.45Å; L654-L658 PolarHBondContact O-N 3.04Å; S655-L658 PolarHBondContact O-N 2.92Å; S655-L658 VanDerWaalsContact O-N 3.15Å; K656-L658 PolarHBondContact O-N 2.73Å; L658-K661 CarbonylContact O-C 3.48Å; L658-K661 PolarHBondContact O-N 3.12Å; L658-R662 PolarHBondContact O-N 2.93Å; L658-R662 VanDerWaalsContact O-N 3.08Å; L658-A685 HydrophobicContact CD2-CB 3.82Å; L658-L686 HydrophobicContact CD1-CD2 3.78Å; L658-L686 HydrophobicContact CD2-CD2 4.32Å; L658-A689 HydrophobicContact CD1-CB 3.96Å; L658-A689 HydrophobicContact CD2-CB 4.2Å; L658-A689 HydrophobicContact CG-CB 4.26Å; L658-L712 HydrophobicContact CD1-CD2 3.51Å
659	T	91.5	Very high	89.8	Confident	58 Å²	58	64.8 Å²	64.8	36%	0.356	33%	0.334	S	S	.	.	H	α-helix	trans	-64.2	-42.6	174.9	-57.7	0	0	0	0	111.7	S655 K656 K661 R662 M663	S655-T659 PolarHBondContact O-N 3.44Å; S655-T659 PolarHBondContact O-OG1 3.06Å; K656-T659 PolarHBondContact O-N 3.33Å; T659-K661 VanDerWaalsContact C-N 3.27Å; T659-K661 PolarHBondContact O-N 2.82Å; T659-R662 WeakPolarHBondContact O-CA 3.19Å; T659-R662 WeakPolarHBondContact O-CB 3.19Å; T659-R662 PolarHBondContact O-N 3.24Å; T659-R662 PolarHBondContact OG1-NH1 2.86Å; T659-M663 PolarHBondContact O-N 2.83Å
660	E	88.8	Confident	89.9	Confident	95 Å²	95	65.4 Å²	65.4	44%	0.444	33%	0.332	S	S	.	.	H	α-helix	trans	-55.9	-41.2	172	-177.5	179.2	-165.7	0	0	111.7	K656 R662 M663 I664	K656-E660 VanDerWaalsContact O-CB 3.3Å; K656-E660 WeakPolarHBondContact O-CB 3.31Å; K656-E660 PolarHBondContact O-N 3.09Å; E660-R662 VanDerWaalsContact C-N 3.28Å; E660-R662 PolarHBondContact O-N 3.16Å; E660-M663 PolarHBondContact O-N 2.93Å; E660-I664 HydrophobicContact CG-CD1 3.82Å; E660-I664 WeakPolarHBondContact O-CB 3.45Å; E660-I664 WeakPolarHBondContact O-CG1 3.41Å; E660-I664 PolarHBondContact O-N 2.86Å
661	K	90.3	Very high	89.9	Confident	83 Å²	83	66.2 Å²	66.2	36%	0.361	34%	0.336	S	S	.	.	H	α-helix	trans	-76.5	-4.1	173.3	-74.1	-176.4	178.3	-168.6	0	115	S553 R657 L658 T659 R667	S553-K661 WeakPolarHBondContact OG-CE 3.26Å; R657-K661 WeakPolarHBondContact O-CB 3.43Å; R657-K661 VanDerWaalsContact O-CG 3.3Å; R657-K661 WeakPolarHBondContact O-CG 3.48Å; R657-K661 PolarHBondContact O-N 3.3Å; L658-K661 CarbonylContact O-C 3.48Å; L658-K661 PolarHBondContact O-N 3.12Å; T659-K661 VanDerWaalsContact C-N 3.27Å; T659-K661 PolarHBondContact O-N 2.82Å; K661-R667 PolarHBondContact O-NE 2.88Å; K661-R667 PolarHBondContact O-NH2 3.32Å
662	R	92.4	Very high	89.5	Confident	13 Å²	13	71.6 Å²	71.6	5%	0.049	36%	0.362	C	S	.	.	H	α-helix	trans	-87.5	-46.4	164.2	-70.6	179.7	-154	111.5	11	109.8	L658 T659 E660 A665 N666 R667 E669 E682 R715	L658-R662 PolarHBondContact O-N 2.93Å; L658-R662 VanDerWaalsContact O-N 3.08Å; T659-R662 WeakPolarHBondContact O-CA 3.19Å; T659-R662 WeakPolarHBondContact O-CB 3.19Å; T659-R662 PolarHBondContact O-N 3.24Å; T659-R662 PolarHBondContact OG1-NH1 2.86Å; E660-R662 VanDerWaalsContact C-N 3.28Å; E660-R662 PolarHBondContact O-N 3.16Å; R662-A665 CarbonylContact O-C 3.51Å; R662-A665 PolarHBondContact O-N 2.82Å; R662-N666 PolarHBondContact O-N 3.26Å; R662-R667 HydrophobicContact CB-CB 4.47Å; R662-R667 WeakPolarHBondContact CB-O 3.42Å; R662-R667 PolarHBondContact O-N 2.79Å; R662-E669 VanDerWaalsContact CD-OE2 3.31Å; R662-E669 WeakPolarHBondContact CD-OE2 3.23Å; R662-E669 IonicContact CZ-OE1 3.85Å; R662-E669 IonicContact CZ-OE2 3.87Å; R662-E669 IonicContact NE-OE1 2.7Å; R662-E669 IonicContact NE-OE2 3.74Å; R662-E669 VanDerWaalsContact NH1-CD 3.25Å; R662-E669 IonicContact NH1-OE1 3.8Å; R662-E669 PolarHBondContact NH1-OE1 3.21Å; R662-E669 IonicContact NH1-OE2 2.73Å; R662-E669 PolarHBondContact NH1-OE2 3.03Å; R662-E682 IonicContact CZ-OE1 2.8Å; R662-E682 VanDerWaalsContact CZ-OE1 3.32Å; R662-E682 IonicContact NE-OE1 2.67Å; R662-E682 PolarHBondContact NE-OE1 2.67Å; R662-E682 IonicContact NE-OE2 2.96Å; R662-E682 IonicContact NH2-OE1 3.74Å; R662-E682 PolarHBondContact NH2-OE1 2.96Å; R662-R715 VanDerWaalsContact NE-NH2 3.19Å
663	M	88.5	Confident	89.4	Confident	140 Å²	140	72.2 Å²	72.2	69%	0.69	37%	0.365	S	S	*	.	H	α-helix	trans	-57.6	-55.5	175.5	-63.9	178.3	72.7	0	0	112.4	T659 E660 A665 N666	T659-M663 PolarHBondContact O-N 2.83Å; E660-M663 PolarHBondContact O-N 2.93Å; M663-A665 PolarHBondContact O-N 2.96Å; M663-N666 PolarHBondContact O-N 3.31Å; M663-N666 PolarHBondContact O-OD1 3.48Å
664	I	86	Confident	89.2	Confident	86 Å²	86	70.1 Å²	70.1	44%	0.441	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-20	-178.4	-67.8	169	0	0	0	113.1	E660	E660-I664 HydrophobicContact CG-CD1 3.82Å; E660-I664 WeakPolarHBondContact O-CB 3.45Å; E660-I664 WeakPolarHBondContact O-CG1 3.41Å; E660-I664 PolarHBondContact O-N 2.86Å
665	A	87.9	Confident	89	Confident	54 Å²	54	73.1 Å²	73.1	45%	0.446	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114	9.7	-177.3	0	0	0	0	0	113.6	R662 M663 R667	R662-A665 CarbonylContact O-C 3.51Å; R662-A665 PolarHBondContact O-N 2.82Å; M663-A665 PolarHBondContact O-N 2.96Å; A665-R667 VanDerWaalsContact C-N 3.31Å; A665-R667 HydrophobicContact CB-CG 3.78Å; A665-R667 VanDerWaalsContact O-CG 3.25Å; A665-R667 WeakPolarHBondContact O-CG 3.32Å; A665-R667 PolarHBondContact O-N 3.41Å
666	N	88.3	Confident	88.8	Confident	146 Å²	146	75.2 Å²	75.2	78%	0.781	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.7	51.8	-175.2	-66.8	-16.2	0	0	0	113.1	R662 M663 Q678	R662-N666 PolarHBondContact O-N 3.26Å; M663-N666 PolarHBondContact O-N 3.31Å; M663-N666 PolarHBondContact O-OD1 3.48Å; N666-Q678 PolarHBondContact O-NE2 3.31Å
667	R	90.4	Very high	88.7	Confident	24 Å²	24	75.5 Å²	75.5	9%	0.091	39%	0.387	C	S	.	.			trans	-109.3	133.9	-179.6	-52.4	-172.8	-66.6	116.5	9.5	110.2	K661 R662 A665 M674 Q678 E682	K661-R667 PolarHBondContact O-NE 2.88Å; K661-R667 PolarHBondContact O-NH2 3.32Å; R662-R667 HydrophobicContact CB-CB 4.47Å; R662-R667 WeakPolarHBondContact CB-O 3.42Å; R662-R667 PolarHBondContact O-N 2.79Å; A665-R667 VanDerWaalsContact C-N 3.31Å; A665-R667 HydrophobicContact CB-CG 3.78Å; A665-R667 VanDerWaalsContact O-CG 3.25Å; A665-R667 WeakPolarHBondContact O-CG 3.32Å; A665-R667 PolarHBondContact O-N 3.41Å; R667-M674 HydrophobicContact CB-CE 3.95Å; R667-Q678 HydrophobicContact CG-CB 4.45Å; R667-Q678 HydrophobicContact CG-CG 3.97Å; R667-E682 IonicContact CZ-OE2 3.73Å; R667-E682 IonicContact NH1-OE2 3.19Å; R667-E682 PolarHBondContact NH1-OE2 2.85Å; R667-E682 IonicContact NH2-OE2 3.32Å; R667-E682 PolarHBondContact NH2-OE2 2.91Å
668	P	88.6	Confident	88.7	Confident	37 Å²	37	74.2 Å²	74.2	24%	0.24	38%	0.384	C	S	.	.			trans	-68	160.3	-177.9	25.8	-32.4	0	0	0	113	L673 M674	P668-L673 HydrophobicContact CB-CB 3.92Å; P668-L673 HydrophobicContact CG-CB 3.7Å; P668-L673 WeakPolarHBondContact CG-O 3.45Å; P668-M674 HydrophobicContact CG-CG 3.88Å; P668-M674 WeakPolarHBondContact O-CE 3.29Å
669	E	85.5	Confident	88.6	Confident	95 Å²	95	74.2 Å²	74.2	44%	0.444	38%	0.384	S	S	.	.	S	Bend	trans	-81	-30.5	178.9	-170	57	-126.9	0	0	112.1	R662 R715	R662-E669 VanDerWaalsContact CD-OE2 3.31Å; R662-E669 WeakPolarHBondContact CD-OE2 3.23Å; R662-E669 IonicContact CZ-OE1 3.85Å; R662-E669 IonicContact CZ-OE2 3.87Å; R662-E669 IonicContact NE-OE1 2.7Å; R662-E669 IonicContact NE-OE2 3.74Å; R662-E669 VanDerWaalsContact NH1-CD 3.25Å; R662-E669 IonicContact NH1-OE1 3.8Å; R662-E669 PolarHBondContact NH1-OE1 3.21Å; R662-E669 IonicContact NH1-OE2 2.73Å; R662-E669 PolarHBondContact NH1-OE2 3.03Å; E669-R715 PolarHBondContact O-NH1 3.3Å; E669-R715 PolarHBondContact O-NH2 3.08Å; E669-R715 IonicContact OE1-CZ 3.23Å; E669-R715 VanDerWaalsContact OE1-CZ 3.29Å; E669-R715 IonicContact OE1-NH1 3.71Å; E669-R715 PolarHBondContact OE1-NH1 3.37Å; E669-R715 IonicContact OE1-NH2 3.71Å; E669-R715 PolarHBondContact OE1-NH2 3.1Å
670	D	86.8	Confident	88.6	Confident	69 Å²	69	73.8 Å²	73.8	37%	0.369	39%	0.386	S	S	.	.	S	Bend	trans	-78.5	144.2	168.8	175.8	40.5	0	0	0	112	H672 L673	D670-H672 IonicContact OD1-CE1 2.71Å; D670-H672 IonicContact OD1-CG 3.36Å; D670-H672 PolarHBondContact OD1-N 3.4Å; D670-H672 IonicContact OD1-ND1 3.43Å; D670-H672 PolarHBondContact OD1-ND1 3.27Å; D670-H672 VanDerWaalsContact OD2-CB 3.31Å; D670-H672 WeakPolarHBondContact OD2-CB 3.06Å; D670-H672 IonicContact OD2-CG 3.09Å; D670-H672 PolarHBondContact OD2-N 3.4Å; D670-H672 IonicContact OD2-ND1 2.88Å; D670-H672 PolarHBondContact OD2-ND1 2.73Å; D670-L673 HydrophobicContact CB-CD1 4.41Å; D670-L673 HydrophobicContact CB-CG 4.45Å
671	L	87.8	Confident	88.8	Confident	21 Å²	21	71.3 Å²	71.3	11%	0.11	38%	0.382	C	S	.	.	S	Bend	trans	-77.9	-24.1	-178.5	-65.2	179.5	0	0	0	113.6	M674 V719 L722	L671-M674 HydrophobicContact CD2-SD 3.97Å; L671-M674 PolarHBondContact O-N 3.07Å; L671-V719 HydrophobicContact CD1-CG2 4.14Å; L671-V719 HydrophobicContact CD2-CG2 3.51Å; L671-L722 HydrophobicContact CB-CD2 4.2Å
672	H	83.7	Confident	88.9	Confident	152 Å²	152	67.4 Å²	67.4	70%	0.704	37%	0.365	S	S	*	.	S	Bend	trans	-79.2	-29.6	-178.3	-50.2	88.8	0	0	0	111.8	D670 M674	D670-H672 IonicContact OD1-CE1 2.71Å; D670-H672 IonicContact OD1-CG 3.36Å; D670-H672 PolarHBondContact OD1-N 3.4Å; D670-H672 IonicContact OD1-ND1 3.43Å; D670-H672 PolarHBondContact OD1-ND1 3.27Å; D670-H672 VanDerWaalsContact OD2-CB 3.31Å; D670-H672 WeakPolarHBondContact OD2-CB 3.06Å; D670-H672 IonicContact OD2-CG 3.09Å; D670-H672 PolarHBondContact OD2-N 3.4Å; D670-H672 IonicContact OD2-ND1 2.88Å; D670-H672 PolarHBondContact OD2-ND1 2.73Å; H672-M674 VanDerWaalsContact C-N 3.28Å; H672-M674 PolarHBondContact O-N 2.85Å
673	L	86.5	Confident	89	Confident	126 Å²	126	68.8 Å²	68.8	66%	0.66	37%	0.371	S	S	*	.	S	Bend	trans	-77.3	-7.6	172.9	-57.9	179.6	0	0	0	113.7	P668 D670	P668-L673 HydrophobicContact CB-CB 3.92Å; P668-L673 HydrophobicContact CG-CB 3.7Å; P668-L673 WeakPolarHBondContact CG-O 3.45Å; D670-L673 HydrophobicContact CB-CD1 4.41Å; D670-L673 HydrophobicContact CB-CG 4.45Å
674	M	86.8	Confident	89.2	Confident	9 Å²	9	66.1 Å²	66.1	4%	0.044	36%	0.359	C	S	.	.	S	Bend	trans	-81.3	128.8	179	-73.3	-171.1	143.1	0	0	112.1	R667 P668 L671 H672 Q678 I679 E682	R667-M674 HydrophobicContact CB-CE 3.95Å; P668-M674 HydrophobicContact CG-CG 3.88Å; P668-M674 WeakPolarHBondContact O-CE 3.29Å; L671-M674 HydrophobicContact CD2-SD 3.97Å; L671-M674 PolarHBondContact O-N 3.07Å; H672-M674 VanDerWaalsContact C-N 3.28Å; H672-M674 PolarHBondContact O-N 2.85Å; M674-Q678 HydrophobicContact CB-CB 4.09Å; M674-Q678 HydrophobicContact CG-CB 4.36Å; M674-I679 HydrophobicContact CB-CD1 4.22Å; M674-I679 HydrophobicContact CB-CG1 3.45Å; M674-I679 VanDerWaalsContact CB-CG1 3.45Å; M674-I679 HydrophobicContact CG-CG1 4.5Å; M674-I679 VanDerWaalsContact O-CD1 3.31Å; M674-I679 WeakPolarHBondContact O-CD1 3.21Å; M674-I679 HydrophobicContact SD-CG1 4.34Å; M674-E682 HydrophobicContact CE-CB 3.92Å; M674-E682 HydrophobicContact CE-CG 4.06Å; M674-E682 HydrophobicContact SD-CB 3.98Å; M674-E682 HydrophobicContact SD-CG 4.19Å
675	T	89.1	Confident	89.6	Confident	69 Å²	69	62.9 Å²	62.9	42%	0.423	35%	0.345	S	S	.	.			trans	-64.2	157.8	171	69.5	0	0	0	0	111.9	K677 Q678 I679	T675-K677 PolarHBondContact O-N 3.33Å; T675-K677 VanDerWaalsContact O-N 3.09Å; T675-Q678 CarbonylContact O-C 3.26Å; T675-Q678 WeakPolarHBondContact O-CA 3.1Å; T675-Q678 WeakPolarHBondContact O-CB 3.41Å; T675-Q678 PolarHBondContact O-N 3.29Å; T675-Q678 WeakPolarHBondContact OG1-CG 3.26Å; T675-Q678 PolarHBondContact OG1-N 3.01Å; T675-Q678 PolarHBondContact OG1-OE1 3.19Å; T675-I679 WeakPolarHBondContact O-CG1 3.38Å; T675-I679 PolarHBondContact O-N 2.9Å
676	P	89	Confident	89.9	Confident	75 Å²	75	60.3 Å²	60.3	49%	0.487	32%	0.324	S	S	.	.	H	α-helix	trans	-52.5	-35.2	177.2	-30.7	37.4	0	0	0	114.5	A680 L726	P676-A680 WeakPolarHBondContact O-CB 3.31Å; P676-A680 PolarHBondContact O-N 3.42Å; P676-A680 VanDerWaalsContact O-N 3.11Å; P676-L726 HydrophobicContact CB-CD1 4.01Å; P676-L726 HydrophobicContact CG-CD1 4.07Å; P676-L726 HydrophobicContact CG-CD2 4.07Å
677	K	89	Confident	90.2	Very high	160 Å²	160	56.6 Å²	56.6	70%	0.696	30%	0.302	S	S	*	.	H	α-helix	trans	-66.1	-43.5	173	-67.7	-179.7	-179.9	175.6	0	111.3	T675 A680 A681	T675-K677 PolarHBondContact O-N 3.33Å; T675-K677 VanDerWaalsContact O-N 3.09Å; K677-A680 PolarHBondContact O-N 2.75Å; K677-A681 PolarHBondContact O-N 3.41Å
678	Q	92.6	Very high	90.4	Very high	41 Å²	41	62.1 Å²	62.1	19%	0.192	33%	0.327	C	S	.	.	H	α-helix	trans	-69	-36.8	177.4	-69.9	170.6	-28	0	0	113.3	N666 R667 M674 T675 A680 A681 E682	N666-Q678 PolarHBondContact O-NE2 3.31Å; R667-Q678 HydrophobicContact CG-CB 4.45Å; R667-Q678 HydrophobicContact CG-CG 3.97Å; M674-Q678 HydrophobicContact CB-CB 4.09Å; M674-Q678 HydrophobicContact CG-CB 4.36Å; T675-Q678 CarbonylContact O-C 3.26Å; T675-Q678 WeakPolarHBondContact O-CA 3.1Å; T675-Q678 WeakPolarHBondContact O-CB 3.41Å; T675-Q678 PolarHBondContact O-N 3.29Å; T675-Q678 WeakPolarHBondContact OG1-CG 3.26Å; T675-Q678 PolarHBondContact OG1-N 3.01Å; T675-Q678 PolarHBondContact OG1-OE1 3.19Å; Q678-A680 VanDerWaalsContact C-N 3.34Å; Q678-A681 PolarHBondContact O-N 2.89Å; Q678-E682 PolarHBondContact O-N 3.41Å
679	I	91.6	Very high	90.6	Very high	6 Å²	6	60.8 Å²	60.8	3%	0.031	32%	0.319	C	S	.	.	H	α-helix	trans	-65.6	-39.2	174	-57.9	169.6	0	0	0	110.1	M674 T675 E682 K683 V719 L722 L723 L726	M674-I679 HydrophobicContact CB-CD1 4.22Å; M674-I679 HydrophobicContact CB-CG1 3.45Å; M674-I679 VanDerWaalsContact CB-CG1 3.45Å; M674-I679 HydrophobicContact CG-CG1 4.5Å; M674-I679 VanDerWaalsContact O-CD1 3.31Å; M674-I679 WeakPolarHBondContact O-CD1 3.21Å; M674-I679 HydrophobicContact SD-CG1 4.34Å; T675-I679 WeakPolarHBondContact O-CG1 3.38Å; T675-I679 PolarHBondContact O-N 2.9Å; I679-E682 PolarHBondContact O-N 3.12Å; I679-K683 WeakPolarHBondContact O-CB 3.47Å; I679-K683 PolarHBondContact O-N 2.8Å; I679-V719 HydrophobicContact CG2-CG1 3.95Å; I679-L722 HydrophobicContact CD1-CB 4.33Å; I679-L722 HydrophobicContact CD1-CD2 3.85Å; I679-L722 HydrophobicContact CG2-CB 4.36Å; I679-L723 HydrophobicContact CB-CG 4.46Å; I679-L723 HydrophobicContact CG2-CD1 3.78Å; I679-L723 HydrophobicContact CG2-CG 3.73Å; I679-L726 HydrophobicContact CD1-CD1 3.85Å
680	A	91.5	Very high	91	Very high	48 Å²	48	56.9 Å²	56.9	40%	0.397	30%	0.301	S	S	.	.	H	α-helix	trans	-62.9	-39.1	173.1	0	0	0	0	0	112.7	P676 K677 Q678 L684 L723	P676-A680 WeakPolarHBondContact O-CB 3.31Å; P676-A680 PolarHBondContact O-N 3.42Å; P676-A680 VanDerWaalsContact O-N 3.11Å; K677-A680 PolarHBondContact O-N 2.75Å; Q678-A680 VanDerWaalsContact C-N 3.34Å; A680-L684 PolarHBondContact O-N 3.12Å; A680-L723 HydrophobicContact CB-CD2 4.47Å
681	A	92.4	Very high	91.2	Very high	44 Å²	44	58.2 Å²	58.2	36%	0.364	31%	0.308	S	S	.	.	H	α-helix	trans	-67.3	-43.6	173.2	0	0	0	0	0	112.5	K677 Q678 K683 L684 A685	K677-A681 PolarHBondContact O-N 3.41Å; Q678-A681 PolarHBondContact O-N 2.89Å; A681-K683 VanDerWaalsContact C-N 3.32Å; A681-K683 PolarHBondContact O-N 3.48Å; A681-L684 PolarHBondContact O-N 2.84Å; A681-L684 VanDerWaalsContact O-N 3.12Å; A681-A685 PolarHBondContact O-N 2.7Å
682	E	93.6	Very high	91.3	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.7	-39.9	177.4	-171.7	68.7	172.4	0	0	111.5	R662 R667 M674 Q678 I679 L684 A685 L686 R715 V719	R662-E682 IonicContact CZ-OE1 2.8Å; R662-E682 VanDerWaalsContact CZ-OE1 3.32Å; R662-E682 IonicContact NE-OE1 2.67Å; R662-E682 PolarHBondContact NE-OE1 2.67Å; R662-E682 IonicContact NE-OE2 2.96Å; R662-E682 IonicContact NH2-OE1 3.74Å; R662-E682 PolarHBondContact NH2-OE1 2.96Å; R667-E682 IonicContact CZ-OE2 3.73Å; R667-E682 IonicContact NH1-OE2 3.19Å; R667-E682 PolarHBondContact NH1-OE2 2.85Å; R667-E682 IonicContact NH2-OE2 3.32Å; R667-E682 PolarHBondContact NH2-OE2 2.91Å; M674-E682 HydrophobicContact CE-CB 3.92Å; M674-E682 HydrophobicContact CE-CG 4.06Å; M674-E682 HydrophobicContact SD-CB 3.98Å; M674-E682 HydrophobicContact SD-CG 4.19Å; Q678-E682 PolarHBondContact O-N 3.41Å; I679-E682 PolarHBondContact O-N 3.12Å; E682-L684 VanDerWaalsContact C-N 3.31Å; E682-L684 PolarHBondContact O-N 2.93Å; E682-A685 PolarHBondContact O-N 3.39Å; E682-L686 HydrophobicContact CG-CD1 3.91Å; E682-L686 HydrophobicContact CG-CG 4.49Å; E682-L686 WeakPolarHBondContact O-CB 3.26Å; E682-L686 WeakPolarHBondContact O-CG 3.46Å; E682-L686 PolarHBondContact O-N 3.1Å; E682-R715 IonicContact OE1-CZ 2.68Å; E682-R715 IonicContact OE1-NE 2.91Å; E682-R715 PolarHBondContact OE1-NE 2.94Å; E682-R715 IonicContact OE1-NH2 3.91Å; E682-R715 PolarHBondContact OE1-NH2 2.93Å; E682-V719 HydrophobicContact CB-CG2 4.45Å; E682-V719 HydrophobicContact CG-CG2 3.89Å
683	K	93.8	Very high	91.7	Very high	43 Å²	43	53.6 Å²	53.6	19%	0.187	28%	0.283	C	S	.	.	H	α-helix	trans	-58.1	-43.9	173.5	-171.2	170.9	174.3	176	0	111.8	I679 A681 Q687 Y716 V719 L723	I679-K683 WeakPolarHBondContact O-CB 3.47Å; I679-K683 PolarHBondContact O-N 2.8Å; A681-K683 VanDerWaalsContact C-N 3.32Å; A681-K683 PolarHBondContact O-N 3.48Å; K683-Q687 WeakPolarHBondContact O-CB 3.4Å; K683-Q687 WeakPolarHBondContact O-CG 3.07Å; K683-Q687 PolarHBondContact O-N 3.42Å; K683-Y716 HydrophobicContact CG-CE2 4.08Å; K683-V719 HydrophobicContact CB-CG1 3.54Å; K683-V719 HydrophobicContact CG-CG1 4.15Å; K683-L723 HydrophobicContact CB-CD1 3.94Å; K683-L723 HydrophobicContact CD-CD1 3.38Å; K683-L723 HydrophobicContact CG-CD1 4.31Å
684	L	93	Very high	91.8	Very high	84 Å²	84	50.7 Å²	50.7	44%	0.44	27%	0.266	S	S	.	.	H	α-helix	trans	-70.3	-39	179.5	-175.6	61.7	0	0	0	111.8	A680 A681 E682 Q687 K688	A680-L684 PolarHBondContact O-N 3.12Å; A681-L684 PolarHBondContact O-N 2.84Å; A681-L684 VanDerWaalsContact O-N 3.12Å; E682-L684 VanDerWaalsContact C-N 3.31Å; E682-L684 PolarHBondContact O-N 2.93Å; L684-Q687 PolarHBondContact O-N 2.88Å; L684-K688 WeakPolarHBondContact O-CG 3.31Å; L684-K688 PolarHBondContact O-N 3.42Å
685	A	93.9	Very high	91.8	Very high	18 Å²	18	56.2 Å²	56.2	15%	0.149	30%	0.296	C	S	.	.	H	α-helix	trans	-62.9	-48.5	175.7	0	0	0	0	0	111.5	L658 A681 E682 Q687 K688 A689	L658-A685 HydrophobicContact CD2-CB 3.82Å; A681-A685 PolarHBondContact O-N 2.7Å; E682-A685 PolarHBondContact O-N 3.39Å; A685-Q687 PolarHBondContact O-N 3.02Å; A685-K688 PolarHBondContact O-N 2.9Å; A685-A689 WeakPolarHBondContact O-CB 3.43Å; A685-A689 PolarHBondContact O-N 3.37Å
686	L	94.6	Very high	91.7	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63.4	-38.6	175.6	-72.8	165.7	0	0	0	112.3	L658 E682 A689 L690 L712 R715 Y716 V719	L658-L686 HydrophobicContact CD1-CD2 3.78Å; L658-L686 HydrophobicContact CD2-CD2 4.32Å; E682-L686 HydrophobicContact CG-CD1 3.91Å; E682-L686 HydrophobicContact CG-CG 4.49Å; E682-L686 WeakPolarHBondContact O-CB 3.26Å; E682-L686 WeakPolarHBondContact O-CG 3.46Å; E682-L686 PolarHBondContact O-N 3.1Å; L686-A689 PolarHBondContact O-N 2.98Å; L686-L690 WeakPolarHBondContact O-CB 3.34Å; L686-L690 WeakPolarHBondContact O-CG 3.39Å; L686-L690 PolarHBondContact O-N 2.84Å; L686-L712 HydrophobicContact CD2-CD2 4.25Å; L686-R715 HydrophobicContact CD1-CB 4.37Å; L686-R715 HydrophobicContact CD1-CG 4.04Å; L686-Y716 HydrophobicContact CB-CD2 4.3Å; L686-V719 HydrophobicContact CD1-CG2 4.03Å
687	Q	94.6	Very high	91.6	Very high	68 Å²	68	53.4 Å²	53.4	32%	0.318	27%	0.273	S	S	.	.	H	α-helix	trans	-63.1	-43.6	174.4	-78.9	176.9	-26.6	0	0	112.2	K683 L684 A685 L691 Y716	K683-Q687 WeakPolarHBondContact O-CB 3.4Å; K683-Q687 WeakPolarHBondContact O-CG 3.07Å; K683-Q687 PolarHBondContact O-N 3.42Å; L684-Q687 PolarHBondContact O-N 2.88Å; A685-Q687 PolarHBondContact O-N 3.02Å; Q687-L691 VanDerWaalsContact O-CB 3.31Å; Q687-L691 WeakPolarHBondContact O-CB 3.09Å; Q687-L691 PolarHBondContact O-N 3.13Å; Q687-Y716 HydrophobicContact CG-CD2 4.35Å; Q687-Y716 HydrophobicContact CG-CE2 3.55Å; Q687-Y716 PolarHBondContact NE2-OH 2.72Å
688	K	93.4	Very high	91.4	Very high	139 Å²	139	47.1 Å²	47.1	60%	0.604	25%	0.253	S	S	*	.	H	α-helix	trans	-65	-39.4	175.1	-72.6	-174.2	176.2	-169	0	112	L684 A685 Y692	L684-K688 WeakPolarHBondContact O-CG 3.31Å; L684-K688 PolarHBondContact O-N 3.42Å; A685-K688 PolarHBondContact O-N 2.9Å; K688-Y692 WeakPolarHBondContact O-CB 3.32Å; K688-Y692 PolarHBondContact O-N 3.03Å
689	A	92.8	Very high	91.1	Very high	9 Å²	9	53.3 Å²	53.3	7%	0.074	28%	0.275	C	S	.	.	H	α-helix	trans	-65.3	-47.7	176.8	0	0	0	0	0	112.9	L654 L658 A685 L686 Y692 F693	L654-A689 WeakPolarHBondContact CD1-O 3.37Å; L654-A689 HydrophobicContact CD2-CB 3.89Å; L658-A689 HydrophobicContact CD1-CB 3.96Å; L658-A689 HydrophobicContact CD2-CB 4.2Å; L658-A689 HydrophobicContact CG-CB 4.26Å; A685-A689 WeakPolarHBondContact O-CB 3.43Å; A685-A689 PolarHBondContact O-N 3.37Å; L686-A689 PolarHBondContact O-N 2.98Å; A689-Y692 PolarHBondContact O-N 3.39Å; A689-F693 PolarHBondContact O-N 2.75Å
690	L	94.1	Very high	90.8	Very high	14 Å²	14	53.9 Å²	53.9	7%	0.073	28%	0.279	C	S	.	.	H	α-helix	trans	-67	-35.3	178.8	-70.2	173.3	0	0	0	112.3	L686 F693 E694 M709 L712 Y713 Y716	L686-L690 WeakPolarHBondContact O-CB 3.34Å; L686-L690 WeakPolarHBondContact O-CG 3.39Å; L686-L690 PolarHBondContact O-N 2.84Å; L690-F693 PolarHBondContact O-N 3.24Å; L690-E694 WeakPolarHBondContact O-CB 3.41Å; L690-E694 PolarHBondContact O-N 2.95Å; L690-M709 HydrophobicContact CD2-CE 3.81Å; L690-L712 HydrophobicContact CD2-CB 4Å; L690-Y713 HydrophobicContact CD1-CD1 4.02Å; L690-Y713 HydrophobicContact CD1-CE1 4.1Å; L690-Y713 HydrophobicContact CD2-CD1 4.06Å; L690-Y713 HydrophobicContact CD2-CE1 3.83Å; L690-Y713 HydrophobicContact CD2-CE2 4.29Å; L690-Y713 HydrophobicContact CD2-CG 4.39Å; L690-Y716 HydrophobicContact CD1-CD1 3.87Å; L690-Y716 HydrophobicContact CD1-CG 4.01Å
691	L	91.9	Very high	90.4	Very high	97 Å²	97	60.4 Å²	60.4	51%	0.508	30%	0.299	S	S	.	.	H	α-helix	trans	-69.3	-37.5	174.5	-174.1	64.2	0	0	0	112.1	Q687 F693 E694 N695	Q687-L691 VanDerWaalsContact O-CB 3.31Å; Q687-L691 WeakPolarHBondContact O-CB 3.09Å; Q687-L691 PolarHBondContact O-N 3.13Å; L691-F693 VanDerWaalsContact C-N 3.32Å; L691-F693 PolarHBondContact O-N 3.09Å; L691-E694 PolarHBondContact O-N 3.21Å; L691-N695 WeakPolarHBondContact O-CB 3.46Å; L691-N695 PolarHBondContact O-N 3.07Å; L691-N695 PolarHBondContact O-OD1 3.33Å
692	Y	89.9	Confident	89.9	Confident	75 Å²	75	64.6 Å²	64.6	29%	0.294	31%	0.311	S	S	.	.	H	α-helix	trans	-61.9	-40	172.6	-179.2	-99.5	0	0	0	111.7	L654 R657 K688 A689 L696	L654-Y692 HydrophobicContact CD1-CD1 4.4Å; L654-Y692 HydrophobicContact CD2-CD1 3.71Å; L654-Y692 HydrophobicContact CD2-CE1 4.36Å; L654-Y692 HydrophobicContact CD2-CG 4.47Å; L654-Y692 HydrophobicContact CG-CD1 4.27Å; R657-Y692 PolarHBondContact NH1-OH 2.88Å; K688-Y692 WeakPolarHBondContact O-CB 3.32Å; K688-Y692 PolarHBondContact O-N 3.03Å; A689-Y692 PolarHBondContact O-N 3.39Å; Y692-L696 HydrophobicContact CD1-CD1 3.92Å; Y692-L696 HydrophobicContact CE1-CD1 3.44Å; Y692-L696 VanDerWaalsContact CE1-CD1 3.44Å; Y692-L696 HydrophobicContact CE1-CG 4.46Å; Y692-L696 HydrophobicContact CE2-CD1 4.32Å; Y692-L696 WeakPolarHBondContact O-CG 3.34Å; Y692-L696 PolarHBondContact O-N 3.37Å; Y692-L696 VanDerWaalsContact O-N 3.12Å
693	F	91.3	Very high	89.2	Confident	1 Å²	1	70.4 Å²	70.4	0%	0.004	34%	0.338	C	S	.	.	H	α-helix	trans	-63.1	-48.6	171.3	-171.4	-80.6	0	0	0	111.9	I647 T650 L654 A689 L690 L691 N695 L696 H697 P700 M709	I647-F693 HydrophobicContact CB-CZ 4.46Å; I647-F693 HydrophobicContact CD1-CZ 4.4Å; I647-F693 HydrophobicContact CG1-CE2 4.39Å; I647-F693 HydrophobicContact CG1-CZ 4.05Å; I647-F693 HydrophobicContact CG2-CE2 3.98Å; I647-F693 HydrophobicContact CG2-CZ 3.86Å; T650-F693 HydrophobicContact CG2-CD2 4.05Å; L654-F693 HydrophobicContact CD1-CB 3.93Å; L654-F693 HydrophobicContact CD1-CD2 4.31Å; A689-F693 PolarHBondContact O-N 2.75Å; L690-F693 PolarHBondContact O-N 3.24Å; L691-F693 VanDerWaalsContact C-N 3.32Å; L691-F693 PolarHBondContact O-N 3.09Å; F693-N695 PolarHBondContact O-N 3.06Å; F693-L696 PolarHBondContact O-N 3.14Å; F693-L696 VanDerWaalsContact O-N 3.12Å; F693-H697 HydrophobicContact CD1-CB 4.27Å; F693-H697 AromaticContact CD2-CD2 3.89Å; F693-H697 HydrophobicContact CE1-CB 3.74Å; F693-H697 HydrophobicContact CE2-CB 4.47Å; F693-H697 AromaticContact CE2-CD2 3.57Å; F693-H697 HydrophobicContact CZ-CB 3.86Å; F693-H697 AromaticContact CZ-CD2 3.81Å; F693-H697 PolarHBondContact O-N 3.29Å; F693-P700 HydrophobicContact CD1-CG 4.45Å; F693-P700 HydrophobicContact CE1-CG 3.69Å; F693-P700 HydrophobicContact CZ-CG 4.25Å; F693-M709 HydrophobicContact CB-CE 3.86Å; F693-M709 HydrophobicContact CD1-CE 4.05Å; F693-M709 HydrophobicContact CD2-CE 3.48Å; F693-M709 VanDerWaalsContact CD2-CE 3.48Å; F693-M709 HydrophobicContact CD2-CG 4.11Å; F693-M709 HydrophobicContact CD2-SD 3.41Å; F693-M709 WeakPolarHBondContact CD2-SD 3.45Å; F693-M709 HydrophobicContact CE1-CG 4.16Å; F693-M709 HydrophobicContact CE2-CE 4.02Å; F693-M709 HydrophobicContact CE2-CG 3.62Å; F693-M709 HydrophobicContact CE2-SD 3.42Å; F693-M709 WeakPolarHBondContact CE2-SD 3.31Å; F693-M709 HydrophobicContact CG-CE 3.5Å; F693-M709 VanDerWaalsContact CG-CE 3.5Å; F693-M709 HydrophobicContact CG-SD 4.06Å; F693-M709 HydrophobicContact CZ-CG 3.66Å; F693-M709 HydrophobicContact CZ-SD 4.09Å
694	E	90	Very high	88.5	Confident	64 Å²	64	73 Å²	73	30%	0.299	35%	0.35	S	S	.	.	H	α-helix	trans	-60.9	-33.3	-179.5	-171.4	168	173.2	0	0	112.2	L690 L691 G698 R699	L690-E694 WeakPolarHBondContact O-CB 3.41Å; L690-E694 PolarHBondContact O-N 2.95Å; L691-E694 PolarHBondContact O-N 3.21Å; E694-G698 WeakPolarHBondContact O-CA 3.27Å; E694-G698 PolarHBondContact O-N 2.67Å; E694-R699 HydrophobicContact CG-CG 4.03Å; E694-R699 IonicContact OE1-CZ 2.81Å; E694-R699 IonicContact OE1-NE 3.61Å; E694-R699 PolarHBondContact OE1-NE 3.46Å; E694-R699 IonicContact OE1-NH2 3.18Å; E694-R699 PolarHBondContact OE1-NH2 2.94Å; E694-R699 IonicContact OE2-NE 3.9Å
695	N	86.9	Confident	88.2	Confident	125 Å²	125	70.4 Å²	70.4	67%	0.668	34%	0.337	S	S	*	.	H	α-helix	trans	-73.9	-35.3	174.5	-69.4	-0.7	0	0	0	113.3	L691 F693	L691-N695 WeakPolarHBondContact O-CB 3.46Å; L691-N695 PolarHBondContact O-N 3.07Å; L691-N695 PolarHBondContact O-OD1 3.33Å; F693-N695 PolarHBondContact O-N 3.06Å
696	L	85.6	Confident	87.8	Confident	55 Å²	55	75.4 Å²	75.4	29%	0.288	35%	0.352	S	S	.	.	H	α-helix	trans	-80.6	-41.6	-179.8	-74.6	-179.7	0	0	0	113.4	R644 P645 T650 Y692 F693	R644-L696 VanDerWaalsContact CZ-O 3.3Å; R644-L696 PolarHBondContact NE-O 3.38Å; R644-L696 PolarHBondContact NH2-O 2.88Å; P645-L696 HydrophobicContact CG-CD1 4.49Å; T650-L696 HydrophobicContact CG2-CD1 4.03Å; Y692-L696 HydrophobicContact CD1-CD1 3.92Å; Y692-L696 HydrophobicContact CE1-CD1 3.44Å; Y692-L696 VanDerWaalsContact CE1-CD1 3.44Å; Y692-L696 HydrophobicContact CE1-CG 4.46Å; Y692-L696 HydrophobicContact CE2-CD1 4.32Å; Y692-L696 WeakPolarHBondContact O-CG 3.34Å; Y692-L696 PolarHBondContact O-N 3.37Å; Y692-L696 VanDerWaalsContact O-N 3.12Å; F693-L696 PolarHBondContact O-N 3.14Å; F693-L696 VanDerWaalsContact O-N 3.12Å
697	H	86.4	Confident	87.3	Confident	30 Å²	30	79.2 Å²	79.2	14%	0.139	37%	0.372	C	S	.	.	H	α-helix	trans	-120.9	-10.4	-168.2	-62.5	-42.6	0	0	0	113.8	P645 I647 T650 F693	P645-H697 PolarHBondContact O-CE1 3.27Å; P645-H697 PolarHBondContact O-NE2 2.75Å; I647-H697 HydrophobicContact CD1-CB 4.34Å; I647-H697 HydrophobicContact CG1-CB 4.19Å; T650-H697 PolarHBondContact OG1-NE2 3.46Å; F693-H697 HydrophobicContact CD1-CB 4.27Å; F693-H697 AromaticContact CD2-CD2 3.89Å; F693-H697 HydrophobicContact CE1-CB 3.74Å; F693-H697 HydrophobicContact CE2-CB 4.47Å; F693-H697 AromaticContact CE2-CD2 3.57Å; F693-H697 HydrophobicContact CZ-CB 3.86Å; F693-H697 AromaticContact CZ-CD2 3.81Å; F693-H697 PolarHBondContact O-N 3.29Å
698	G	86.5	Confident	87	Confident	28 Å²	28	76.9 Å²	76.9	29%	0.289	36%	0.362	S	S	.	.			trans	76	-168.8	-163.9	0	0	0	0	0	111.6	E694	E694-G698 WeakPolarHBondContact O-CA 3.27Å; E694-G698 PolarHBondContact O-N 2.67Å
699	R	85.7	Confident	86.9	Confident	171 Å²	171	70.2 Å²	70.2	65%	0.645	33%	0.333	S	S	*	.	S	Bend	trans	-77.9	136.7	172.7	-63.8	-175.6	-177.5	157.5	13.2	109.9	E694 K701	E694-R699 HydrophobicContact CG-CG 4.03Å; E694-R699 IonicContact OE1-CZ 2.81Å; E694-R699 IonicContact OE1-NE 3.61Å; E694-R699 PolarHBondContact OE1-NE 3.46Å; E694-R699 IonicContact OE1-NH2 3.18Å; E694-R699 PolarHBondContact OE1-NH2 2.94Å; E694-R699 IonicContact OE2-NE 3.9Å; R699-K701 PolarHBondContact O-N 3.3Å
700	P	85.9	Confident	86.8	Confident	19 Å²	19	77.3 Å²	77.3	12%	0.123	36%	0.358	C	S	.	.			trans	-46.7	103.2	171.7	-36.6	42.5	0	0	0	113.8	F693 D705 R706 M709 Y713	F693-P700 HydrophobicContact CD1-CG 4.45Å; F693-P700 HydrophobicContact CE1-CG 3.69Å; F693-P700 HydrophobicContact CZ-CG 4.25Å; P700-D705 HydrophobicContact CB-CB 3.58Å; P700-D705 HydrophobicContact CG-CB 4.23Å; P700-R706 HydrophobicContact CB-CG 3.88Å; P700-M709 HydrophobicContact CG-CB 4.2Å; P700-M709 HydrophobicContact CG-CG 4.18Å; P700-Y713 HydrophobicContact CG-CE2 4.17Å
701	K	81.3	Confident	86.7	Confident	185 Å²	185	80.2 Å²	80.2	80%	0.804	38%	0.377	S	S	*	.			trans	-98.2	-29.3	178.5	-77.7	179	-176.8	176.6	0	111.9	R699 R706	R699-K701 PolarHBondContact O-N 3.3Å; K701-R706 VanDerWaalsContact C-NH1 3.32Å; K701-R706 PolarHBondContact O-NH1 2.89Å
702	E	82.5	Confident	86.8	Confident	132 Å²	132	76 Å²	76	62%	0.617	36%	0.355	S	S	*	.	S	Bend	trans	-82.4	163.3	178.2	-157.3	150.5	150.7	0	0	111.7	D705 R706	E702-D705 HydrophobicContact CB-CB 4.47Å; E702-D705 WeakPolarHBondContact CB-OD2 3.31Å; E702-D705 PolarHBondContact N-OD2 2.76Å; E702-R706 WeakPolarHBondContact O-CG 3.3Å; E702-R706 PolarHBondContact O-N 3.06Å; E702-R706 PolarHBondContact O-NH1 3.08Å; E702-R706 VanDerWaalsContact O-NH1 3.17Å
703	H	79.1	Confident	86.9	Confident	122 Å²	122	75.4 Å²	75.4	57%	0.565	35%	0.353	S	S	*	.	H	α-helix	trans	-66.6	-43.6	177	-175.7	-110	0	0	0	111.5	R706 I707	H703-R706 PolarHBondContact O-N 3.28Å; H703-I707 WeakPolarHBondContact CE1-CD1 3.48Å; H703-I707 PolarHBondContact O-N 2.88Å
704	Q	79.5	Confident	87	Confident	97 Å²	97	78 Å²	78	45%	0.453	37%	0.367	S	S	.	.	H	α-helix	trans	-62.5	-51.3	179.6	-168.2	66.2	2	0	0	111.3	R706 I707 T708	Q704-R706 PolarHBondContact O-N 2.94Å; Q704-R706 VanDerWaalsContact O-N 3.12Å; Q704-I707 WeakPolarHBondContact O-CA 3.45Å; Q704-I707 PolarHBondContact O-N 3Å; Q704-T708 PolarHBondContact O-N 2.81Å; Q704-T708 PolarHBondContact O-OG1 2.81Å
705	D	85.4	Confident	87.2	Confident	30 Å²	30	77.4 Å²	77.4	16%	0.16	36%	0.362	C	S	.	.	H	α-helix	trans	-49.7	-42	175.7	-52.3	-18.5	0	0	0	112.8	I647 P700 E702 M709	I647-D705 VanDerWaalsContact CD1-OD1 3.25Å; I647-D705 WeakPolarHBondContact CD1-OD1 3.46Å; P700-D705 HydrophobicContact CB-CB 3.58Å; P700-D705 HydrophobicContact CG-CB 4.23Å; E702-D705 HydrophobicContact CB-CB 4.47Å; E702-D705 WeakPolarHBondContact CB-OD2 3.31Å; E702-D705 PolarHBondContact N-OD2 2.76Å; D705-M709 WeakPolarHBondContact O-CB 3.34Å; D705-M709 PolarHBondContact O-N 3.22Å
706	R	86.1	Confident	87.6	Confident	123 Å²	123	73.8 Å²	73.8	46%	0.464	34%	0.339	S	S	.	.	H	α-helix	trans	-68.8	-33.1	-179.7	-78.3	-167.7	-62.3	-86.1	4.1	112.4	P700 K701 E702 H703 Q704 R710	P700-R706 HydrophobicContact CB-CG 3.88Å; K701-R706 VanDerWaalsContact C-NH1 3.32Å; K701-R706 PolarHBondContact O-NH1 2.89Å; E702-R706 WeakPolarHBondContact O-CG 3.3Å; E702-R706 PolarHBondContact O-N 3.06Å; E702-R706 PolarHBondContact O-NH1 3.08Å; E702-R706 VanDerWaalsContact O-NH1 3.17Å; H703-R706 PolarHBondContact O-N 3.28Å; Q704-R706 PolarHBondContact O-N 2.94Å; Q704-R706 VanDerWaalsContact O-N 3.12Å; R706-R710 WeakPolarHBondContact O-CB 3.49Å; R706-R710 PolarHBondContact O-N 3.38Å
707	I	85.1	Confident	87.9	Confident	80 Å²	80	78.1 Å²	78.1	41%	0.41	35%	0.352	S	S	.	.	H	α-helix	trans	-72.7	-54.5	174	-70.6	177	0	0	0	109.3	H703 Q704 M709 R710	H703-I707 WeakPolarHBondContact CE1-CD1 3.48Å; H703-I707 PolarHBondContact O-N 2.88Å; Q704-I707 WeakPolarHBondContact O-CA 3.45Å; Q704-I707 PolarHBondContact O-N 3Å; I707-M709 VanDerWaalsContact C-N 3.28Å; I707-M709 PolarHBondContact O-N 2.91Å; I707-R710 VanDerWaalsContact O-CB 3.23Å; I707-R710 WeakPolarHBondContact O-CB 3.35Å; I707-R710 PolarHBondContact O-N 2.91Å
708	T	88.6	Confident	88.2	Confident	18 Å²	18	78.5 Å²	78.5	11%	0.11	36%	0.358	C	S	.	.	H	α-helix	trans	-53.3	-43.8	-179.6	-56.1	0	0	0	0	111.9	I647 E648 F651 Q704	I647-T708 HydrophobicContact CG2-CG2 4.34Å; E648-T708 HydrophobicContact CB-CG2 4.39Å; E648-T708 HydrophobicContact CG-CG2 3.82Å; F651-T708 HydrophobicContact CB-CG2 3.85Å; F651-T708 HydrophobicContact CD1-CG2 4.18Å; F651-T708 WeakPolarHBondContact CD2-O 3.34Å; F651-T708 WeakPolarHBondContact CE2-O 3.45Å; F651-T708 HydrophobicContact CG-CG2 3.97Å; Q704-T708 PolarHBondContact O-N 2.81Å; Q704-T708 PolarHBondContact O-OG1 2.81Å
709	M	91	Very high	88.5	Confident	0 Å²	0	77.1 Å²	77.1	0%	0	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-6.3	179.1	-71.2	-66.3	-68.4	0	0	115.1	F651 L690 F693 P700 D705 I707 P711 L712 Y713	F651-M709 HydrophobicContact CB-SD 4.03Å; F651-M709 HydrophobicContact CD2-SD 3.89Å; F651-M709 HydrophobicContact CG-SD 4.43Å; L690-M709 HydrophobicContact CD2-CE 3.81Å; F693-M709 HydrophobicContact CB-CE 3.86Å; F693-M709 HydrophobicContact CD1-CE 4.05Å; F693-M709 HydrophobicContact CD2-CE 3.48Å; F693-M709 VanDerWaalsContact CD2-CE 3.48Å; F693-M709 HydrophobicContact CD2-CG 4.11Å; F693-M709 HydrophobicContact CD2-SD 3.41Å; F693-M709 WeakPolarHBondContact CD2-SD 3.45Å; F693-M709 HydrophobicContact CE1-CG 4.16Å; F693-M709 HydrophobicContact CE2-CE 4.02Å; F693-M709 HydrophobicContact CE2-CG 3.62Å; F693-M709 HydrophobicContact CE2-SD 3.42Å; F693-M709 WeakPolarHBondContact CE2-SD 3.31Å; F693-M709 HydrophobicContact CG-CE 3.5Å; F693-M709 VanDerWaalsContact CG-CE 3.5Å; F693-M709 HydrophobicContact CG-SD 4.06Å; F693-M709 HydrophobicContact CZ-CG 3.66Å; F693-M709 HydrophobicContact CZ-SD 4.09Å; P700-M709 HydrophobicContact CG-CB 4.2Å; P700-M709 HydrophobicContact CG-CG 4.18Å; D705-M709 WeakPolarHBondContact O-CB 3.34Å; D705-M709 PolarHBondContact O-N 3.22Å; I707-M709 VanDerWaalsContact C-N 3.28Å; I707-M709 PolarHBondContact O-N 2.91Å; M709-P711 VanDerWaalsContact C-CD 3.45Å; M709-L712 HydrophobicContact CE-CD1 3.85Å; M709-L712 PolarHBondContact O-N 2.88Å; M709-L712 HydrophobicContact SD-CD1 4.16Å; M709-Y713 HydrophobicContact CB-CD2 4.01Å; M709-Y713 HydrophobicContact CB-CE2 3.81Å; M709-Y713 WeakPolarHBondContact O-CD2 3.47Å; M709-Y713 PolarHBondContact O-N 3.21Å
710	R	90.6	Very high	88.8	Confident	158 Å²	158	73.7 Å²	73.7	60%	0.596	33%	0.334	S	S	*	.	H	α-helix	trans	-50.5	-47.1	-177.3	-177.1	-176.4	-77	-158	-0.8	113	R706 I707 L712 Y713 D714	R706-R710 WeakPolarHBondContact O-CB 3.49Å; R706-R710 PolarHBondContact O-N 3.38Å; I707-R710 VanDerWaalsContact O-CB 3.23Å; I707-R710 WeakPolarHBondContact O-CB 3.35Å; I707-R710 PolarHBondContact O-N 2.91Å; R710-L712 VanDerWaalsContact C-N 3.31Å; R710-L712 PolarHBondContact O-N 3.29Å; R710-Y713 PolarHBondContact O-N 2.93Å; R710-Y713 VanDerWaalsContact O-N 3.14Å; R710-D714 WeakPolarHBondContact CG-OD2 3.31Å; R710-D714 PolarHBondContact O-N 3.14Å
711	P	92	Very high	89	Confident	75 Å²	75	80.8 Å²	80.8	49%	0.487	36%	0.358	S	S	.	.	H	α-helix	trans	-59.2	-37.6	-175.6	-25.7	36.3	0	0	0	113.9	F651 M709 R715	F651-P711 HydrophobicContact CE2-CB 4.33Å; F651-P711 HydrophobicContact CE2-CG 4.23Å; F651-P711 HydrophobicContact CZ-CB 4.41Å; F651-P711 HydrophobicContact CZ-CG 4.11Å; M709-P711 VanDerWaalsContact C-CD 3.45Å; P711-R715 WeakPolarHBondContact O-CB 3.36Å; P711-R715 PolarHBondContact O-N 3.25Å
712	L	92.9	Very high	89.3	Confident	9 Å²	9	74 Å²	74	5%	0.047	33%	0.33	C	S	.	.	H	α-helix	trans	-72.4	-38.1	178.7	-64.9	179.8	0	0	0	112	F651 L654 L658 L686 L690 M709 R710 Y716	F651-L712 HydrophobicContact CD2-CD1 3.91Å; F651-L712 HydrophobicContact CD2-CG 4.19Å; F651-L712 HydrophobicContact CE2-CD1 4.2Å; F651-L712 HydrophobicContact CE2-CG 3.97Å; L654-L712 HydrophobicContact CB-CD1 4.2Å; L658-L712 HydrophobicContact CD1-CD2 3.51Å; L686-L712 HydrophobicContact CD2-CD2 4.25Å; L690-L712 HydrophobicContact CD2-CB 4Å; M709-L712 HydrophobicContact CE-CD1 3.85Å; M709-L712 PolarHBondContact O-N 2.88Å; M709-L712 HydrophobicContact SD-CD1 4.16Å; R710-L712 VanDerWaalsContact C-N 3.31Å; R710-L712 PolarHBondContact O-N 3.29Å; L712-Y716 WeakPolarHBondContact O-CB 3.43Å; L712-Y716 PolarHBondContact O-N 3.39Å; L712-Y716 VanDerWaalsContact O-N 3.1Å
713	Y	93.3	Very high	89.5	Confident	62 Å²	62	68.6 Å²	68.6	24%	0.243	31%	0.306	C	S	.	.	H	α-helix	trans	-67.4	-42.1	175.3	-77.7	-65.7	0	0	0	112.5	L690 P700 M709 R710 Y716 R717	L690-Y713 HydrophobicContact CD1-CD1 4.02Å; L690-Y713 HydrophobicContact CD1-CE1 4.1Å; L690-Y713 HydrophobicContact CD2-CD1 4.06Å; L690-Y713 HydrophobicContact CD2-CE1 3.83Å; L690-Y713 HydrophobicContact CD2-CE2 4.29Å; L690-Y713 HydrophobicContact CD2-CG 4.39Å; P700-Y713 HydrophobicContact CG-CE2 4.17Å; M709-Y713 HydrophobicContact CB-CD2 4.01Å; M709-Y713 HydrophobicContact CB-CE2 3.81Å; M709-Y713 WeakPolarHBondContact O-CD2 3.47Å; M709-Y713 PolarHBondContact O-N 3.21Å; R710-Y713 PolarHBondContact O-N 2.93Å; R710-Y713 VanDerWaalsContact O-N 3.14Å; Y713-Y716 PolarHBondContact O-N 3.32Å; Y713-R717 WeakPolarHBondContact O-CD 3.49Å; Y713-R717 VanDerWaalsContact O-CG 3.26Å; Y713-R717 WeakPolarHBondContact O-CG 3.49Å; Y713-R717 PolarHBondContact O-N 3.4Å
714	D	92.9	Very high	89.6	Confident	56 Å²	56	67 Å²	67	30%	0.299	30%	0.301	S	S	.	.	H	α-helix	trans	-74.1	-36.8	-179.1	-73.6	-34	0	0	0	112.4	R710 Y716 R717 S718	R710-D714 WeakPolarHBondContact CG-OD2 3.31Å; R710-D714 PolarHBondContact O-N 3.14Å; D714-Y716 VanDerWaalsContact C-N 3.33Å; D714-Y716 PolarHBondContact O-N 3.35Å; D714-R717 WeakPolarHBondContact O-CB 3.5Å; D714-R717 PolarHBondContact O-N 3.24Å; D714-R717 WeakPolarHBondContact OD1-CD 3.25Å; D714-R717 IonicContact OD1-CZ 2.73Å; D714-R717 IonicContact OD1-NE 2.7Å; D714-R717 IonicContact OD1-NH1 2.73Å; D714-R717 PolarHBondContact OD1-NH1 2.97Å; D714-S718 PolarHBondContact O-N 3.07Å; D714-S718 PolarHBondContact O-OG 3.34Å
715	R	93.7	Very high	89.7	Confident	50 Å²	50	66 Å²	66	19%	0.189	30%	0.304	C	S	.	.	H	α-helix	trans	-59.7	-43	168.8	-164.8	-179.6	-177.3	107.8	4	111.6	R662 E669 E682 L686 P711 S718 V719	R662-R715 VanDerWaalsContact NE-NH2 3.19Å; E669-R715 PolarHBondContact O-NH1 3.3Å; E669-R715 PolarHBondContact O-NH2 3.08Å; E669-R715 IonicContact OE1-CZ 3.23Å; E669-R715 VanDerWaalsContact OE1-CZ 3.29Å; E669-R715 IonicContact OE1-NH1 3.71Å; E669-R715 PolarHBondContact OE1-NH1 3.37Å; E669-R715 IonicContact OE1-NH2 3.71Å; E669-R715 PolarHBondContact OE1-NH2 3.1Å; E682-R715 IonicContact OE1-CZ 2.68Å; E682-R715 IonicContact OE1-NE 2.91Å; E682-R715 PolarHBondContact OE1-NE 2.94Å; E682-R715 IonicContact OE1-NH2 3.91Å; E682-R715 PolarHBondContact OE1-NH2 2.93Å; L686-R715 HydrophobicContact CD1-CB 4.37Å; L686-R715 HydrophobicContact CD1-CG 4.04Å; P711-R715 WeakPolarHBondContact O-CB 3.36Å; P711-R715 PolarHBondContact O-N 3.25Å; R715-S718 PolarHBondContact O-N 3.33Å; R715-V719 WeakPolarHBondContact O-CB 3.3Å; R715-V719 VanDerWaalsContact O-CG2 3.31Å; R715-V719 WeakPolarHBondContact O-CG2 3.42Å; R715-V719 PolarHBondContact O-N 2.96Å
716	Y	95.2	Very high	89.3	Confident	49 Å²	49	66.8 Å²	66.8	19%	0.192	31%	0.308	C	S	.	.	H	α-helix	trans	-65	-37.2	175.1	173.4	-120.7	0	0	0	113	K683 L686 Q687 L690 L712 Y713 D714 K720	K683-Y716 HydrophobicContact CG-CE2 4.08Å; L686-Y716 HydrophobicContact CB-CD2 4.3Å; Q687-Y716 HydrophobicContact CG-CD2 4.35Å; Q687-Y716 HydrophobicContact CG-CE2 3.55Å; Q687-Y716 PolarHBondContact NE2-OH 2.72Å; L690-Y716 HydrophobicContact CD1-CD1 3.87Å; L690-Y716 HydrophobicContact CD1-CG 4.01Å; L712-Y716 WeakPolarHBondContact O-CB 3.43Å; L712-Y716 PolarHBondContact O-N 3.39Å; L712-Y716 VanDerWaalsContact O-N 3.1Å; Y713-Y716 PolarHBondContact O-N 3.32Å; D714-Y716 VanDerWaalsContact C-N 3.33Å; D714-Y716 PolarHBondContact O-N 3.35Å; Y716-K720 WeakPolarHBondContact O-CB 3.37Å; Y716-K720 PolarHBondContact O-N 3.41Å
717	R	92.7	Very high	88.6	Confident	146 Å²	146	66.1 Å²	66.1	55%	0.551	31%	0.31	S	S	*	.	H	α-helix	trans	-62.6	-45.5	173.1	-74.8	157.9	166.5	-171.5	-2.8	111.3	Y713 D714 K720 R721	Y713-R717 WeakPolarHBondContact O-CD 3.49Å; Y713-R717 VanDerWaalsContact O-CG 3.26Å; Y713-R717 WeakPolarHBondContact O-CG 3.49Å; Y713-R717 PolarHBondContact O-N 3.4Å; D714-R717 WeakPolarHBondContact O-CB 3.5Å; D714-R717 PolarHBondContact O-N 3.24Å; D714-R717 WeakPolarHBondContact OD1-CD 3.25Å; D714-R717 IonicContact OD1-CZ 2.73Å; D714-R717 IonicContact OD1-NE 2.7Å; D714-R717 IonicContact OD1-NH1 2.73Å; D714-R717 PolarHBondContact OD1-NH1 2.97Å; R717-K720 PolarHBondContact O-N 3.23Å; R717-R721 WeakPolarHBondContact O-CG 3.34Å; R717-R721 PolarHBondContact O-N 3.13Å
718	S	92.2	Very high	87.4	Confident	38 Å²	38	64.9 Å²	64.9	27%	0.266	31%	0.308	S	S	.	.	H	α-helix	trans	-64.8	-49.8	177.7	-64.7	0	0	0	0	112.3	D714 R715 K720 R721 L722	D714-S718 PolarHBondContact O-N 3.07Å; D714-S718 PolarHBondContact O-OG 3.34Å; R715-S718 PolarHBondContact O-N 3.33Å; S718-K720 PolarHBondContact O-N 3.03Å; S718-R721 WeakPolarHBondContact O-CA 3.49Å; S718-R721 WeakPolarHBondContact O-CB 3.33Å; S718-R721 PolarHBondContact O-N 3.33Å; S718-L722 WeakPolarHBondContact O-CD1 3.23Å; S718-L722 PolarHBondContact O-N 3.03Å
719	V	92.9	Very high	85.7	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-53.8	-39.4	172.7	166.3	0	0	0	0	112	L671 I679 E682 K683 L686 R715 L723	L671-V719 HydrophobicContact CD1-CG2 4.14Å; L671-V719 HydrophobicContact CD2-CG2 3.51Å; I679-V719 HydrophobicContact CG2-CG1 3.95Å; E682-V719 HydrophobicContact CB-CG2 4.45Å; E682-V719 HydrophobicContact CG-CG2 3.89Å; K683-V719 HydrophobicContact CB-CG1 3.54Å; K683-V719 HydrophobicContact CG-CG1 4.15Å; L686-V719 HydrophobicContact CD1-CG2 4.03Å; R715-V719 WeakPolarHBondContact O-CB 3.3Å; R715-V719 VanDerWaalsContact O-CG2 3.31Å; R715-V719 WeakPolarHBondContact O-CG2 3.42Å; R715-V719 PolarHBondContact O-N 2.96Å; V719-L723 HydrophobicContact CG1-CD1 4.38Å; V719-L723 PolarHBondContact O-N 2.71Å; V719-L723 VanDerWaalsContact O-N 3.12Å
720	K	91.1	Very high	83.7	Confident	98 Å²	98	74 Å²	74	43%	0.426	36%	0.356	S	S	.	.	H	α-helix	trans	-71.4	-30.9	176.4	-174.6	179	176.7	-176.4	0	113	Y716 R717 S718 N724	Y716-K720 WeakPolarHBondContact O-CB 3.37Å; Y716-K720 PolarHBondContact O-N 3.41Å; R717-K720 PolarHBondContact O-N 3.23Å; S718-K720 PolarHBondContact O-N 3.03Å; K720-N724 PolarHBondContact O-N 2.89Å; K720-N724 PolarHBondContact O-OD1 2.91Å
721	R	90.5	Very high	81.2	Confident	169 Å²	169	71.7 Å²	71.7	64%	0.638	36%	0.356	S	S	*	.	H	α-helix	trans	-66.7	-54	171	-72.5	169.1	175.8	158.9	-5.3	110.4	R717 S718 L723 N724 C725	R717-R721 WeakPolarHBondContact O-CG 3.34Å; R717-R721 PolarHBondContact O-N 3.13Å; S718-R721 WeakPolarHBondContact O-CA 3.49Å; S718-R721 WeakPolarHBondContact O-CB 3.33Å; S718-R721 PolarHBondContact O-N 3.33Å; R721-L723 VanDerWaalsContact C-N 3.34Å; R721-L723 PolarHBondContact O-N 3.29Å; R721-N724 WeakPolarHBondContact O-CB 3.41Å; R721-N724 PolarHBondContact O-N 3.27Å; R721-C725 PolarHBondContact O-N 3.12Å; R721-C725 PolarHBondContact O-SG 3.39Å
722	L	88.1	Confident	78.5	Confident	43 Å²	43	69.8 Å²	69.8	23%	0.225	34%	0.342	C	S	.	.	H	α-helix	trans	-55.4	-47	-179.9	-84.8	76.5	0	0	0	111.9	L671 I679 S718 N724 C725 L726	L671-L722 HydrophobicContact CB-CD2 4.2Å; I679-L722 HydrophobicContact CD1-CB 4.33Å; I679-L722 HydrophobicContact CD1-CD2 3.85Å; I679-L722 HydrophobicContact CG2-CB 4.36Å; S718-L722 WeakPolarHBondContact O-CD1 3.23Å; S718-L722 PolarHBondContact O-N 3.03Å; L722-N724 VanDerWaalsContact C-N 3.31Å; L722-N724 PolarHBondContact O-N 3.17Å; L722-C725 WeakPolarHBondContact O-CB 3.47Å; L722-C725 PolarHBondContact O-N 2.88Å; L722-C725 VanDerWaalsContact O-N 3.09Å; L722-L726 WeakPolarHBondContact O-CG 3.28Å; L722-L726 PolarHBondContact O-N 3.12Å
723	L	87.3	Confident	75.5	Confident	18 Å²	18	75.1 Å²	75.1	9%	0.094	37%	0.37	C	S	.	.	H	α-helix	trans	-63.7	-32.3	177.8	-94.5	159.4	0	0	0	114.2	I679 A680 K683 V719 R721 Q727	I679-L723 HydrophobicContact CB-CG 4.46Å; I679-L723 HydrophobicContact CG2-CD1 3.78Å; I679-L723 HydrophobicContact CG2-CG 3.73Å; A680-L723 HydrophobicContact CB-CD2 4.47Å; K683-L723 HydrophobicContact CB-CD1 3.94Å; K683-L723 HydrophobicContact CD-CD1 3.38Å; K683-L723 HydrophobicContact CG-CD1 4.31Å; V719-L723 HydrophobicContact CG1-CD1 4.38Å; V719-L723 PolarHBondContact O-N 2.71Å; V719-L723 VanDerWaalsContact O-N 3.12Å; R721-L723 VanDerWaalsContact C-N 3.34Å; R721-L723 PolarHBondContact O-N 3.29Å; L723-Q727 VanDerWaalsContact O-CB 3.31Å; L723-Q727 WeakPolarHBondContact O-CB 3.45Å; L723-Q727 VanDerWaalsContact O-CG 3.23Å; L723-Q727 WeakPolarHBondContact O-CG 3.45Å; L723-Q727 PolarHBondContact O-N 3.33Å
724	N	81.7	Confident	72.5	Confident	89 Å²	89	79.2 Å²	79.2	48%	0.476	40%	0.395	S	S	.	.	H	α-helix	trans	-69.5	-36.1	173.5	-72.9	4.2	0	0	0	111.2	K720 R721 L722 S728	K720-N724 PolarHBondContact O-N 2.89Å; K720-N724 PolarHBondContact O-OD1 2.91Å; R721-N724 WeakPolarHBondContact O-CB 3.41Å; R721-N724 PolarHBondContact O-N 3.27Å; L722-N724 VanDerWaalsContact C-N 3.31Å; L722-N724 PolarHBondContact O-N 3.17Å; N724-S728 PolarHBondContact O-N 2.85Å
725	C	81.5	Confident	69.6	Low	74 Å²	74	80.9 Å²	80.9	50%	0.5	42%	0.416	S	S	.	.	H	α-helix	trans	-65.1	-48.9	175	-59.3	0	0	0	0	111.1	R721 L722 Q727 S728 N729	R721-C725 PolarHBondContact O-N 3.12Å; R721-C725 PolarHBondContact O-SG 3.39Å; L722-C725 WeakPolarHBondContact O-CB 3.47Å; L722-C725 PolarHBondContact O-N 2.88Å; L722-C725 VanDerWaalsContact O-N 3.09Å; C725-Q727 PolarHBondContact O-N 3.48Å; C725-S728 WeakPolarHBondContact O-CA 3.34Å; C725-S728 WeakPolarHBondContact O-CB 3.36Å; C725-S728 PolarHBondContact O-N 3.17Å; C725-S728 PolarHBondContact O-OG 3.49Å; C725-N729 PolarHBondContact O-N 3.29Å; C725-N729 PolarHBondContact O-OD1 3.23Å
726	L	77	Confident	66.6	Low	48 Å²	48	86.2 Å²	86.2	25%	0.251	44%	0.443	S	S	.	.	H	α-helix	trans	-59.3	-44.8	176.5	-66.8	166.9	0	0	0	111.8	P676 I679 L722 S728 N729 N730	P676-L726 HydrophobicContact CB-CD1 4.01Å; P676-L726 HydrophobicContact CG-CD1 4.07Å; P676-L726 HydrophobicContact CG-CD2 4.07Å; I679-L726 HydrophobicContact CD1-CD1 3.85Å; L722-L726 WeakPolarHBondContact O-CG 3.28Å; L722-L726 PolarHBondContact O-N 3.12Å; L726-S728 PolarHBondContact O-N 3.05Å; L726-S728 VanDerWaalsContact O-N 3.11Å; L726-N729 PolarHBondContact O-N 2.9Å; L726-N730 PolarHBondContact O-N 3.04Å; L726-N730 PolarHBondContact O-OD1 2.95Å; L726-N730 VanDerWaalsContact O-OD1 3.1Å
727	Q	70.9	Confident	63.5	Low	109 Å²	109	91.4 Å²	91.4	51%	0.509	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-13.8	173.6	-74	-177.3	-28.9	0	0	114.1	L723 C725	L723-Q727 VanDerWaalsContact O-CB 3.31Å; L723-Q727 WeakPolarHBondContact O-CB 3.45Å; L723-Q727 VanDerWaalsContact O-CG 3.23Å; L723-Q727 WeakPolarHBondContact O-CG 3.45Å; L723-Q727 PolarHBondContact O-N 3.33Å; C725-Q727 PolarHBondContact O-N 3.48Å
728	S	60.2	Low	60.6	Low	54 Å²	54	90.4 Å²	90.4	38%	0.378	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-4.4	173.1	84.7	0	0	0	0	114.2	N724 C725 L726 K1174	N724-S728 PolarHBondContact O-N 2.85Å; C725-S728 WeakPolarHBondContact O-CA 3.34Å; C725-S728 WeakPolarHBondContact O-CB 3.36Å; C725-S728 PolarHBondContact O-N 3.17Å; C725-S728 PolarHBondContact O-OG 3.49Å; L726-S728 PolarHBondContact O-N 3.05Å; L726-S728 VanDerWaalsContact O-N 3.11Å; S728-K1174 PolarHBondContact O-NZ 3.16Å; S728-K1174 PolarHBondContact OG-NZ 3.5Å
729	N	53	Low	57.7	Low	80 Å²	80	97.2 Å²	97.2	43%	0.428	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-41.1	-179.9	-70	9.6	0	0	0	111.7	C725 L726 N731 L732 K1174	C725-N729 PolarHBondContact O-N 3.29Å; C725-N729 PolarHBondContact O-OD1 3.23Å; L726-N729 PolarHBondContact O-N 2.9Å; N729-N731 PolarHBondContact O-N 3.27Å; N729-L732 PolarHBondContact O-N 2.98Å; N729-K1174 PolarHBondContact OD1-NZ 3.45Å
730	N	47.3	Very low	54.7	Low	129 Å²	129	105.1 Å²	105.1	69%	0.69	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	27	-178.9	-65.1	52.5	0	0	0	115.7	L726	L726-N730 PolarHBondContact O-N 3.04Å; L726-N730 PolarHBondContact O-OD1 2.95Å; L726-N730 VanDerWaalsContact O-OD1 3.1Å
731	N	39.6	Very low	51.9	Low	109 Å²	109	109.1 Å²	109.1	58%	0.583	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.1	11.8	163	-65.4	-69	0	0	0	111.6	N729 F1167	N729-N731 PolarHBondContact O-N 3.27Å; N731-F1167 HydrophobicContact CB-CZ 3.93Å
732	L	35.1	Very low	49	Very low	36 Å²	36	105.1 Å²	105.1	19%	0.188	57%	0.568	C	S	.	*	S	Bend	trans	-125.9	164.2	163.3	-76.8	110.3	0	0	0	109.3	N729 T1171 K1174	N729-L732 PolarHBondContact O-N 2.98Å; L732-T1171 HydrophobicContact CD1-CG2 3.88Å; L732-T1171 VanDerWaalsContact CD2-C 3.47Å; L732-T1171 HydrophobicContact CD2-CG2 3.53Å; L732-T1171 WeakPolarHBondContact CD2-O 3.32Å; L732-T1171 HydrophobicContact CG-CG2 3.65Å; L732-K1174 HydrophobicContact CD1-CB 4.37Å
733	N	30.4	Very low	46.4	Very low	120 Å²	120	110.4 Å²	110.4	64%	0.642	60%	0.596	S	S	*	*			trans	64.7	103.4	-178.3	-57.1	22.7	0	0	0	109.3
734	I	30.2	Very low	44	Very low	149 Å²	149	114.5 Å²	114.5	76%	0.764	62%	0.622	S	S	*	*			cis	47.3	80	36.9	-44.7	179.6	0	0	0	107.5
735	A	30.6	Very low	41.8	Very low	91 Å²	91	118 Å²	118	75%	0.752	64%	0.636	S	S	*	*				61.1	64.3	58.4	0	0	0	0	0	111.9
736	E	30.5	Very low	39.6	Very low	162 Å²	162	120 Å²	120	76%	0.757	64%	0.641	S	S	*	*			trans	-163.6	156.7	144.6	-113	156.3	-160.7	0	0	112
737	H	30.9	Very low	37.3	Very low	157 Å²	157	125.4 Å²	125.4	73%	0.727	67%	0.665	S	S	*	*			trans	42.8	110.9	165.7	-52	-54.2	0	0	0	122.1
738	T	32.1	Very low	35.5	Very low	126 Å²	126	125.2 Å²	125.2	77%	0.773	68%	0.676	S	S	*	*				162.1	130.5	120.6	36.5	0	0	0	0	108.3
739	E	30.7	Very low	34.2	Very low	181 Å²	181	128 Å²	128	85%	0.846	70%	0.695	S	S	*	*			cis	-148.1	150.8	-5.3	-125.9	156.1	-139.1	0	0	108.1
740	E	29.5	Very low	33.2	Very low	166 Å²	166	130.5 Å²	130.5	78%	0.776	71%	0.713	S	S	*	*			trans	-99.2	145.6	177	-64.7	-177.5	164.4	0	0	110.1
741	N	32.4	Very low	32.4	Very low	181 Å²	181	129.9 Å²	129.9	97%	0.968	72%	0.716	S	S	*	*			trans	-124	96	151.1	-93.3	-11	0	0	0	106.7
742	S	30.8	Very low	32	Very low	86 Å²	86	130 Å²	130	60%	0.601	73%	0.725	S	S	*	*			trans	-104	146.9	166.7	55.2	0	0	0	0	108.9
743	D	33.1	Very low	31.8	Very low	153 Å²	153	134.9 Å²	134.9	82%	0.818	75%	0.75	S	S	*	*			trans	-174.3	134	161.8	-89.6	-25.2	0	0	0	105.4
744	T	37	Very low	31.8	Very low	105 Å²	105	136.4 Å²	136.4	64%	0.644	76%	0.758	S	S	*	*			cis	-159.7	144.2	-0.1	17.2	0	0	0	0	109.9
745	E	34.2	Very low	31.7	Very low	163 Å²	163	135.6 Å²	135.6	76%	0.762	76%	0.755	S	S	*	*			trans	65.1	146.8	139.7	-62.1	-156.9	138.5	0	0	121.7
746	L	35.1	Very low	31.7	Very low	114 Å²	114	137.2 Å²	137.2	60%	0.597	76%	0.758	S	S	*	*			cis	-159.1	158.3	-9.2	-107.5	171.6	0	0	0	112.4
747	Q	30.1	Very low	31.7	Very low	162 Å²	162	136.6 Å²	136.6	76%	0.757	76%	0.757	S	S	*	*			trans	52.3	119.4	151.4	-70.2	159.4	17.6	0	0	119.9
748	S	32.1	Very low	31.8	Very low	106 Å²	106	137.9 Å²	137.9	74%	0.741	76%	0.756	S	S	*	*				-170	125.4	73	28.6	0	0	0	0	111.2
749	S	32.8	Very low	31.7	Very low	111 Å²	111	143.1 Å²	143.1	78%	0.776	76%	0.761	S	S	*	*				56.4	127.6	105.9	81.3	0	0	0	0	116
750	V	32.3	Very low	31.7	Very low	133 Å²	133	145.8 Å²	145.8	81%	0.806	76%	0.764	S	S	*	*			cis	-149.4	151	18.6	176.4	0	0	0	0	109.6
751	P	31.7	Very low	31.8	Very low	117 Å²	117	141.7 Å²	141.7	76%	0.76	75%	0.753	S	S	*	*			trans	-102.2	164	-174.3	39.2	-36.2	0	0	0	116.4
752	S	29.9	Very low	31.6	Very low	110 Å²	110	140.4 Å²	140.4	77%	0.769	75%	0.745	S	S	*	*			trans	-165.1	143.3	154.2	-113.4	0	0	0	0	115.2
753	I	31.6	Very low	31.6	Very low	140 Å²	140	143.7 Å²	143.7	72%	0.718	76%	0.755	S	S	*	*			trans	65.6	109.6	148.2	-65.4	166	0	0	0	119
754	D	29.2	Very low	31.5	Very low	151 Å²	151	141.1 Å²	141.1	81%	0.807	75%	0.749	S	S	*	*			trans	47.8	146.9	134	-43.5	-21	0	0	0	120.9
755	D	28.7	Very low	31.3	Very low	132 Å²	132	141.5 Å²	141.5	71%	0.706	75%	0.753	S	S	*	*			cis	-153.7	133.1	16.9	-179.1	11.5	0	0	0	111.6
756	P	30	Very low	31.2	Very low	126 Å²	126	141.7 Å²	141.7	82%	0.818	76%	0.759	S	S	*	*			trans	-110.6	71.8	-177	39.9	-32.4	0	0	0	115.8
757	M	32	Very low	31.1	Very low	149 Å²	149	143.1 Å²	143.1	73%	0.734	77%	0.766	S	S	*	*			trans	-135.9	147.1	176	-88.2	-174.9	55.7	0	0	112.1
758	R	32.6	Very low	31.1	Very low	184 Å²	184	143.5 Å²	143.5	69%	0.694	77%	0.77	S	S	*	*			cis	-158.6	133.8	3.7	177.6	-172.8	-166.6	178.5	9.4	111
759	R	30.7	Very low	31.1	Very low	236 Å²	236	143.4 Å²	143.4	89%	0.891	77%	0.767	S	S	*	*			trans	-88.8	143.5	158.7	-74.8	-171.6	176.3	-165.7	0.6	110.7
760	R	30.1	Very low	30.9	Very low	237 Å²	237	146.2 Å²	146.2	89%	0.894	77%	0.772	S	S	*	*			trans	78.1	105.3	167	-50.6	174.3	-179.2	170.5	1.2	119.1
761	S	31.1	Very low	30.9	Very low	79 Å²	79	147 Å²	147	55%	0.552	77%	0.771	S	S	*	*			trans	-178.6	125.7	146.9	43.9	0	0	0	0	105.9
762	I	29.1	Very low	30.8	Very low	155 Å²	155	147.9 Å²	147.9	80%	0.795	77%	0.769	S	S	*	*			cis	54.1	115	27.3	-49.3	-176.2	0	0	0	112.8
763	L	30.7	Very low	30.8	Very low	154 Å²	154	149.7 Å²	149.7	81%	0.806	77%	0.77	S	S	*	*	S	Bend	trans	82.5	102.1	179.1	-67.3	147	0	0	0	116.7
764	S	30.3	Very low	30.8	Very low	100 Å²	100	147.3 Å²	147.3	70%	0.699	77%	0.765	S	S	*	*			trans	23	118.1	134.8	-53	0	0	0	0	119.8	N766	S764-N766 PolarHBondContact O-N 3.47Å
765	P	33.5	Very low	30.9	Very low	112 Å²	112	144.9 Å²	144.9	73%	0.727	76%	0.76	S	S	*	*			trans	-75.1	110.3	158	31.1	-30.6	0	0	0	110.3	I767	P765-I767 HydrophobicContact CB-CD1 4.31Å; P765-I767 HydrophobicContact CB-CG1 4.27Å; P765-I767 PolarHBondContact O-N 3.07Å
766	N	31.2	Very low	31	Very low	167 Å²	167	144.9 Å²	144.9	89%	0.893	76%	0.759	S	S	*	*			trans	-85.5	92.3	154.3	-96.5	8.7	0	0	0	107.2	S764	S764-N766 PolarHBondContact O-N 3.47Å
767	I	33.1	Very low	31	Very low	145 Å²	145	146.4 Å²	146.4	74%	0.744	76%	0.755	S	S	*	*			trans	-108.8	111.3	168.2	-65.5	175.3	0	0	0	106.8	P765	P765-I767 HydrophobicContact CB-CD1 4.31Å; P765-I767 HydrophobicContact CB-CG1 4.27Å; P765-I767 PolarHBondContact O-N 3.07Å
768	M	30.4	Very low	30.8	Very low	169 Å²	169	144.6 Å²	144.6	83%	0.833	75%	0.748	S	S	*	*			trans	-73	141.9	160.6	-80.7	-168.3	67.4	0	0	108.8	L770	M768-L770 PolarHBondContact O-N 3.44Å
769	P	32.8	Very low	30.7	Very low	104 Å²	104	144.5 Å²	144.5	68%	0.675	75%	0.752	S	S	*	*			trans	-72.1	119.7	179	29.2	-33.3	0	0	0	110.4
770	L	28.4	Very low	30.6	Very low	171 Å²	171	137.4 Å²	137.4	90%	0.895	74%	0.739	S	S	*	*			trans	-92.4	94.6	153.3	-83.7	166	0	0	0	107.4	M768	M768-L770 PolarHBondContact O-N 3.44Å
771	I	31.9	Very low	30.7	Very low	150 Å²	150	133 Å²	133	77%	0.769	73%	0.732	S	S	*	*			trans	-102.6	132	157.2	-66.7	178.8	0	0	0	105.5
772	N	29.4	Very low	30.8	Very low	135 Å²	135	136.6 Å²	136.6	72%	0.722	74%	0.74	S	S	*	*			trans	-62.3	147.1	178.9	-56.7	-37.9	0	0	0	110.1
773	D	30.5	Very low	30.9	Very low	148 Å²	148	133.4 Å²	133.4	79%	0.791	73%	0.731	S	S	*	*				-145.8	116.1	112.8	-116.3	-36.9	0	0	0	112.6
774	S	31	Very low	30.9	Very low	89 Å²	89	132.7 Å²	132.7	62%	0.622	73%	0.733	S	S	*	*				34	100.7	125.1	-45.2	0	0	0	0	117.9
775	S	30.4	Very low	31	Very low	101 Å²	101	131.1 Å²	131.1	71%	0.706	73%	0.733	S	S	*	*				159.3	137.7	94.5	-78.3	0	0	0	0	116
776	I	31.1	Very low	30.9	Very low	132 Å²	132	131.6 Å²	131.6	68%	0.677	73%	0.734	S	S	*	*			trans	72.7	98.4	133.4	-67.8	172.2	0	0	0	118
777	Q	30.2	Very low	31	Very low	157 Å²	157	129.9 Å²	129.9	73%	0.734	73%	0.73	S	S	*	*				90.8	152.5	97.1	-72.3	-168.4	17.6	0	0	112.8
778	L	28.3	Very low	30.9	Very low	112 Å²	112	127.4 Å²	127.4	59%	0.586	73%	0.725	S	S	*	*			cis	-162.9	166.9	-8.4	-115.7	177.3	0	0	0	109.3
779	K	29.7	Very low	31.1	Very low	181 Å²	181	124.6 Å²	124.6	79%	0.787	72%	0.722	S	S	*	*			trans	67.2	154.3	148.4	-77.3	162.7	-179.5	165.6	0	117
780	S	29.3	Very low	31.3	Very low	88 Å²	88	124.1 Å²	124.1	62%	0.615	72%	0.721	S	S	*	*			cis	-166.3	-156.3	-22	-166.9	0	0	0	0	106.6
781	I	33	Very low	31.6	Very low	145 Å²	145	123 Å²	123	74%	0.744	72%	0.715	S	S	*	*			trans	78.3	95.3	169.3	-48.9	179.5	0	0	0	109.8
782	H	33.5	Very low	31.7	Very low	154 Å²	154	119.7 Å²	119.7	71%	0.713	71%	0.709	S	S	*	*				63.3	136.2	74.8	-59.1	-53.8	0	0	0	111.7
783	S	29.5	Very low	31.9	Very low	88 Å²	88	118.6 Å²	118.6	62%	0.615	71%	0.712	S	S	*	*			cis	-166.6	168.4	-4.1	-108.1	0	0	0	0	110
784	T	30.5	Very low	32	Very low	139 Å²	139	119 Å²	119	85%	0.853	71%	0.707	S	S	*	*			trans	49.9	122	148.1	53.8	0	0	0	0	120.7
785	G	32.8	Very low	32.1	Very low	66 Å²	66	122.7 Å²	122.7	68%	0.68	71%	0.712	S	S	*	*			trans	111.4	154.8	143.8	0	0	0	0	0	115.5
786	T	31.1	Very low	32.1	Very low	123 Å²	123	123.3 Å²	123.3	76%	0.755	72%	0.717	S	S	*	*			cis	-166.4	144.6	-8.6	3.4	0	0	0	0	108.1
787	T	33.7	Very low	32.1	Very low	131 Å²	131	124.2 Å²	124.2	80%	0.804	72%	0.721	S	S	*	*			trans	59.5	155.4	155.1	53.3	0	0	0	0	117.8
788	S	31.7	Very low	32.1	Very low	92 Å²	92	124.3 Å²	124.3	64%	0.643	73%	0.727	S	S	*	*			cis	-173.7	168.7	-21.3	52.8	0	0	0	0	107
789	S	35.3	Very low	32.2	Very low	110 Å²	110	124.3 Å²	124.3	77%	0.769	73%	0.733	S	S	*	*			trans	70.6	146.8	162.6	85.3	0	0	0	0	115.5
790	S	36.5	Very low	32.2	Very low	94 Å²	94	121.9 Å²	121.9	66%	0.657	73%	0.733	S	S	*	*			cis	-154.7	153	-0.5	-128.6	0	0	0	0	113.4
791	I	35.2	Very low	32.3	Very low	149 Å²	149	122.6 Å²	122.6	76%	0.764	74%	0.736	S	S	*	*			trans	48.8	93.4	144.1	-59.7	159.9	0	0	0	115
792	A	32.5	Very low	32.1	Very low	79 Å²	79	125.9 Å²	125.9	65%	0.653	74%	0.741	S	S	*	*				75.7	114.9	53.3	0	0	0	0	0	115.6
793	S	33.9	Very low	31.8	Very low	113 Å²	113	123.3 Å²	123.3	79%	0.79	74%	0.74	S	S	*	*			trans	-176	144	139.2	-80.4	0	0	0	0	109.1
794	F	31.9	Very low	31.6	Very low	157 Å²	157	124.4 Å²	124.4	69%	0.689	75%	0.747	S	S	*	*			cis	-173	138.5	-30.3	-122.1	-54	0	0	0	105.8
795	K	34.1	Very low	31.6	Very low	166 Å²	166	124.4 Å²	124.4	72%	0.722	74%	0.741	S	S	*	*			trans	51.9	116.2	155.6	-74.8	159	-176.9	175.4	0	117.9
796	S	29.5	Very low	31.3	Very low	114 Å²	114	129.1 Å²	129.1	80%	0.797	75%	0.746	S	S	*	*				48.4	104.4	60.7	-170	0	0	0	0	114.1
797	I	32.2	Very low	31.3	Very low	150 Å²	150	128.5 Å²	128.5	77%	0.769	75%	0.746	S	S	*	*			trans	-164.3	123	158.7	-100.6	146.6	0	0	0	107.2
798	N	28.8	Very low	31.2	Very low	160 Å²	160	128.6 Å²	128.6	86%	0.856	74%	0.741	S	S	*	*			trans	-75	151.8	159.3	-65.2	-30.3	0	0	0	107.3
799	P	31.1	Very low	31.2	Very low	112 Å²	112	129.9 Å²	129.9	73%	0.727	74%	0.74	S	S	*	*				-154.2	171.1	101.6	42.6	-25.9	0	0	0	116.5
800	V	29	Very low	31	Very low	130 Å²	130	134.4 Å²	134.4	79%	0.788	74%	0.74	S	S	*	*			trans	-58.1	173.6	145.9	-99.4	0	0	0	0	111.2
801	P	33.5	Very low	30.7	Very low	103 Å²	103	136 Å²	136	67%	0.669	74%	0.741	S	S	*	*			cis	-137	-170.1	10.9	28.9	-3.3	0	0	0	114.5
802	Y	28.5	Very low	30.6	Very low	214 Å²	214	138.9 Å²	138.9	84%	0.839	74%	0.744	S	S	*	*			trans	46.7	117.2	141.1	-85.8	-129.3	0	0	0	120.8
803	S	26.3	Very low	30.6	Very low	100 Å²	100	142 Å²	142	70%	0.699	75%	0.75	S	S	*	*				22.2	143.1	119.4	-46.3	0	0	0	0	121.5
804	S	26.6	Very low	30.7	Very low	110 Å²	110	141.3 Å²	141.3	77%	0.769	74%	0.742	S	S	*	*			trans	78.3	152.2	158.4	87.6	0	0	0	0	116
805	L	28.7	Very low	30.8	Very low	139 Å²	139	139.4 Å²	139.4	73%	0.728	74%	0.743	S	S	*	*			cis	-137.1	156.7	9.2	-89.6	173.5	0	0	0	113.8
806	Q	28.3	Very low	30.9	Very low	165 Å²	165	136.3 Å²	136.3	77%	0.771	74%	0.743	S	S	*	*			trans	-3.5	139.1	146.3	-57.8	165.7	-17.1	0	0	120
807	S	30.3	Very low	31	Very low	110 Å²	110	135.3 Å²	135.3	77%	0.769	74%	0.735	S	S	*	*			trans	178.4	147	131.9	-85.5	0	0	0	0	111.9
808	I	31.6	Very low	31	Very low	134 Å²	134	135.7 Å²	135.7	69%	0.687	74%	0.737	S	S	*	*			cis	-161.6	146	-10.2	-115.6	166.4	0	0	0	108.1
809	N	31.8	Very low	31.2	Very low	118 Å²	118	132.3 Å²	132.3	63%	0.631	73%	0.727	S	S	*	*			trans	62.6	149.7	173.7	-62.9	-38.1	0	0	0	117.2
810	R	29.9	Very low	31.4	Very low	205 Å²	205	132.7 Å²	132.7	77%	0.774	72%	0.722	S	S	*	*			cis	-168.4	165.9	-11.8	-101.6	175.9	-153.8	-169.3	4.3	106.1
811	L	31.9	Very low	31.7	Very low	129 Å²	129	132 Å²	132	68%	0.675	71%	0.714	S	S	*	*			cis	-157.1	173.6	4.8	-131.8	179.1	0	0	0	109.5
812	Y	32.9	Very low	31.8	Very low	209 Å²	209	132.9 Å²	132.9	82%	0.82	71%	0.713	S	S	*	*			trans	73	141	167.1	-83	-75.7	0	0	0	119.9
813	N	30.8	Very low	32.3	Very low	145 Å²	145	129.9 Å²	129.9	78%	0.775	71%	0.711	S	S	*	*			trans	-157.9	-169.6	-159.5	-151.1	17.1	0	0	0	105
814	P	37.1	Very low	32.9	Very low	97 Å²	97	130.6 Å²	130.6	63%	0.63	71%	0.713	S	S	*	*			cis	-111.3	-146.2	-23.2	14.7	12.3	0	0	0	110.3
815	V	34.7	Very low	33.6	Very low	117 Å²	117	131.5 Å²	131.5	71%	0.709	71%	0.714	S	S	*	*			cis	-160.3	153.9	15.7	-145.1	0	0	0	0	112.2
816	S	34.9	Very low	34.1	Very low	102 Å²	102	130.1 Å²	130.1	71%	0.713	71%	0.713	S	S	*	*			trans	56.4	147	143.8	58.7	0	0	0	0	122.7
817	S	32.7	Very low	34.3	Very low	92 Å²	92	127.4 Å²	127.4	64%	0.643	71%	0.712	S	S	*	*			cis	177.7	146.1	-16.6	53.4	0	0	0	0	111.8
818	I	32	Very low	34.5	Very low	158 Å²	158	129.7 Å²	129.7	81%	0.81	71%	0.713	S	S	*	*			trans	65.8	137.1	149.4	-64.2	160.2	0	0	0	116.5
819	S	32.5	Very low	34.8	Very low	90 Å²	90	131.3 Å²	131.3	63%	0.629	72%	0.72	S	S	*	*			cis	-163.1	-157.7	-15.3	54.7	0	0	0	0	107.6
820	D	35	Very low	35	Very low	120 Å²	120	130 Å²	130	64%	0.642	72%	0.719	S	S	*	*			cis	-167.6	174.2	7.4	-126.5	-35.9	0	0	0	113.9
821	N	35.8	Very low	35.4	Very low	115 Å²	115	128 Å²	128	62%	0.615	72%	0.723	S	S	*	*			trans	16.3	151.5	146.6	-61.3	-40.2	0	0	0	123.3
822	N	35.1	Very low	35.9	Very low	122 Å²	122	126.8 Å²	126.8	65%	0.652	72%	0.723	S	S	*	*			cis	-166.4	142.4	-9.9	-97.3	-30.5	0	0	0	108.3
823	L	38.3	Very low	35.9	Very low	151 Å²	151	122.5 Å²	122.5	79%	0.791	72%	0.719	S	S	*	*				61.5	153.7	79.2	-97.5	77.6	0	0	0	116.7
824	P	39.1	Very low	36.1	Very low	114 Å²	114	120.9 Å²	120.9	74%	0.74	72%	0.719	S	S	*	*			cis	-143.2	-173.7	-13.8	41.5	-22.1	0	0	0	116.9
825	V	41.7	Very low	36	Very low	129 Å²	129	120.6 Å²	120.6	78%	0.782	73%	0.725	S	S	*	*			trans	-96.3	161.9	164.2	-151.3	0	0	0	0	111.1
826	P	38.9	Very low	35.8	Very low	111 Å²	111	120.2 Å²	120.2	72%	0.721	73%	0.727	S	S	*	*				-142.4	154.1	120.8	25.2	-4.4	0	0	0	113.7
827	S	33.6	Very low	35.8	Very low	107 Å²	107	125.2 Å²	125.2	75%	0.748	74%	0.736	S	S	*	*			cis	71.4	143.9	49.9	-73.3	0	0	0	0	114.5
828	M	34.9	Very low	35.9	Very low	159 Å²	159	127.7 Å²	127.7	78%	0.783	74%	0.742	S	S	*	*			cis	-168.7	-173.5	-1.7	-109.5	-114.1	93.6	0	0	109.7
829	M	36.8	Very low	35.9	Very low	168 Å²	168	127.3 Å²	127.3	83%	0.828	74%	0.739	S	S	*	*			trans	81.2	146.1	159.8	-59.4	-164.1	179.9	0	0	119.8
830	S	36.2	Very low	36.2	Very low	89 Å²	89	128.2 Å²	128.2	62%	0.622	74%	0.743	S	S	*	*			cis	-175.9	164.7	-17	58.1	0	0	0	0	114.5
831	L	37.9	Very low	35.9	Very low	163 Å²	163	129.6 Å²	129.6	85%	0.853	75%	0.749	S	S	*	*			trans	81.3	156.3	151.8	-71.5	160.7	0	0	0	119.6
832	P	42.2	Very low	35.8	Very low	105 Å²	105	133.9 Å²	133.9	68%	0.682	76%	0.758	S	S	*	*			trans	-138.9	-161.4	-139.9	42.2	-21.4	0	0	0	115.7
833	T	34.7	Very low	35.6	Very low	118 Å²	118	132.3 Å²	132.3	72%	0.724	76%	0.756	S	S	*	*				151.6	130.8	124.2	-60.4	0	0	0	0	116.5
834	S	34.5	Very low	35.6	Very low	111 Å²	111	130.4 Å²	130.4	78%	0.776	75%	0.753	S	S	*	*			trans	75.5	153.4	150.8	69.4	0	0	0	0	125
835	A	35.1	Very low	35.2	Very low	91 Å²	91	132 Å²	132	75%	0.752	75%	0.754	S	S	*	*			trans	65	120.5	166.6	0	0	0	0	0	118.2
836	S	30.8	Very low	34.8	Very low	109 Å²	109	131.4 Å²	131.4	76%	0.762	75%	0.75	S	S	*	*			cis	97.3	89.2	15.9	-50.1	0	0	0	0	117.2
837	F	34.5	Very low	34.5	Very low	207 Å²	207	130.8 Å²	130.8	91%	0.908	75%	0.749	S	S	*	*			trans	-168.3	152.9	155.2	-85	-50.4	0	0	0	108.1
838	N	33.8	Very low	34.7	Very low	144 Å²	144	130.3 Å²	130.3	77%	0.77	74%	0.743	S	S	*	*			cis	-157.6	175.4	-20.7	-164.1	12.2	0	0	0	109.4
839	M	32.6	Very low	34.5	Very low	150 Å²	150	131.4 Å²	131.4	74%	0.739	75%	0.747	S	S	*	*			trans	-110.2	171.9	165.9	-74.3	-83.2	-174.4	0	0	110.5
840	P	38.3	Very low	34.3	Very low	110 Å²	110	127.7 Å²	127.7	71%	0.714	74%	0.737	S	S	*	*				-145.9	158.8	92.8	39	-23.8	0	0	0	116.3
841	I	28.5	Very low	34	Very low	148 Å²	148	128.6 Å²	128.6	76%	0.759	74%	0.739	S	S	*	*			trans	-98.5	140.3	161.3	-65.2	167	0	0	0	108.5
842	Y	34.1	Very low	33.6	Very low	205 Å²	205	128.3 Å²	128.3	80%	0.804	74%	0.738	S	S	*	*			trans	-131.9	125	157.1	-86.3	-97.4	0	0	0	106.9
843	S	30.3	Very low	33	Very low	89 Å²	89	127.6 Å²	127.6	62%	0.622	74%	0.735	S	S	*	*			cis	93.5	142	27.4	88	0	0	0	0	114.5
844	P	39.1	Very low	32.9	Very low	111 Å²	111	127.9 Å²	127.9	72%	0.721	73%	0.732	S	S	*	*			trans	-123	-142	-149.4	39.3	-20.7	0	0	0	113.8
845	I	31.1	Very low	32.7	Very low	149 Å²	149	128.4 Å²	128.4	76%	0.764	73%	0.726	S	S	*	*			trans	88.1	140	175	-45.1	152.1	0	0	0	110.9
846	T	33.2	Very low	32.7	Very low	115 Å²	115	130.4 Å²	130.4	71%	0.706	72%	0.724	S	S	*	*			cis	-158.9	144.2	27.7	-18.4	0	0	0	0	114
847	S	32.6	Very low	32.9	Very low	99 Å²	99	132.5 Å²	132.5	69%	0.692	72%	0.722	S	S	*	*			trans	52.9	171	133.2	72.3	0	0	0	0	124.2
848	P	37.5	Very low	32.9	Very low	97 Å²	97	128.3 Å²	128.3	63%	0.63	71%	0.713	S	S	*	*				-141.2	-169.1	-52.2	42.1	-24.7	0	0	0	114
849	Q	31.8	Very low	32.7	Very low	182 Å²	182	127.3 Å²	127.3	85%	0.85	71%	0.707	S	S	*	*			trans	71.3	151.9	152.5	-78.7	173.4	18.6	0	0	118.6
850	S	31.4	Very low	32.8	Very low	89 Å²	89	126.5 Å²	126.5	62%	0.622	71%	0.706	S	S	*	*			cis	-163.2	169.7	-9.2	54.8	0	0	0	0	114.7
851	T	30	Very low	32.5	Very low	108 Å²	108	131.2 Å²	131.2	66%	0.663	71%	0.709	S	S	*	*			trans	64.9	121.5	142.7	45.9	0	0	0	0	123.3
852	L	29.4	Very low	32.8	Very low	158 Å²	158	131 Å²	131	83%	0.827	71%	0.709	S	S	*	*			trans	62.9	165.2	143	-82.5	79.7	0	0	0	117.5
853	S	30	Very low	32.7	Very low	89 Å²	89	128.6 Å²	128.6	62%	0.622	71%	0.71	S	S	*	*			cis	-168.4	173.2	-31.8	65.1	0	0	0	0	105.7
854	N	31.6	Very low	32.9	Very low	125 Å²	125	129.1 Å²	129.1	67%	0.668	71%	0.71	S	S	*	*			cis	-167.2	175.9	14.1	-130.6	-10.5	0	0	0	106.9
855	N	31.8	Very low	32.7	Very low	122 Å²	122	129.8 Å²	129.8	65%	0.652	71%	0.712	S	S	*	*			trans	35.5	132.2	138.1	-56.8	-9.4	0	0	0	120.1
856	N	34.6	Very low	32.6	Very low	132 Å²	132	133.3 Å²	133.3	71%	0.706	72%	0.715	S	S	*	*			cis	-162.7	154	31	-106.4	-14.1	0	0	0	109.9
857	H	33.7	Very low	32.7	Very low	154 Å²	154	137.4 Å²	137.4	71%	0.713	72%	0.723	S	S	*	*				62.1	135.1	83.5	-120.7	36.2	0	0	0	112.6
858	V	34.5	Very low	32.5	Very low	119 Å²	119	141.3 Å²	141.3	72%	0.721	73%	0.731	S	S	*	*			cis	-140.8	162.6	27	-171	0	0	0	0	111.5
859	N	31	Very low	32.5	Very low	122 Å²	122	141.2 Å²	141.2	65%	0.652	73%	0.73	S	S	*	*			trans	-70.4	161	171.7	-30.2	-89.8	0	0	0	112.8
860	D	34.9	Very low	32.4	Very low	134 Å²	134	138.7 Å²	138.7	72%	0.717	73%	0.727	S	S	*	*				-177.7	171	105.7	-93.8	-19.5	0	0	0	110.7
861	R	31.1	Very low	32.1	Very low	208 Å²	208	140 Å²	140	79%	0.785	73%	0.731	S	S	*	*			cis	179.5	164.5	-42.5	-164.5	167.6	-177.2	163.3	0.4	107.5
862	L	35.8	Very low	32.1	Very low	144 Å²	144	141.2 Å²	141.2	75%	0.754	74%	0.738	S	S	*	*			trans	73.7	114.1	172.8	-47.2	174	0	0	0	114
863	D	30.7	Very low	32	Very low	154 Å²	154	139 Å²	139	82%	0.824	73%	0.732	S	S	*	*			cis	90.3	164.8	26.9	-160.8	18	0	0	0	114.8
864	V	34.7	Very low	32.1	Very low	101 Å²	101	139.7 Å²	139.7	61%	0.612	74%	0.736	S	S	*	*			trans	94.8	89.1	161.2	-165.1	0	0	0	0	118.7
865	T	35.3	Very low	32.1	Very low	124 Å²	124	141.4 Å²	141.4	76%	0.761	74%	0.744	S	S	*	*			trans	73.9	144.9	146	65.9	0	0	0	0	120.6
866	R	29.3	Very low	32.2	Very low	223 Å²	223	140.7 Å²	140.7	84%	0.842	75%	0.746	S	S	*	*			cis	92.7	96.6	18.3	-170.7	-160.9	-171	-175.5	6.4	116
867	K	34.5	Very low	32	Very low	202 Å²	202	139 Å²	139	88%	0.878	74%	0.744	S	S	*	*			trans	-178	155.6	131.6	-100.1	158.1	-174	179.1	0	113.7
868	Q	28.3	Very low	31.7	Very low	181 Å²	181	137.5 Å²	137.5	85%	0.846	75%	0.746	S	S	*	*			trans	-98.4	-158.5	164.9	-48.3	177.8	-20.7	0	0	108.3
869	P	37.2	Very low	31.7	Very low	95 Å²	95	139.3 Å²	139.3	62%	0.617	75%	0.75	S	S	*	*			cis	-138.3	-171.6	-13.8	31.4	-8	0	0	0	114.7
870	T	29.8	Very low	31.5	Very low	128 Å²	128	144 Å²	144	79%	0.785	76%	0.758	S	S	*	*			trans	63.2	163.4	148.8	39.8	0	0	0	0	119.4
871	V	26.3	Very low	31.6	Very low	118 Å²	118	146.3 Å²	146.3	72%	0.715	77%	0.765	S	S	*	*			cis	-169.2	156.5	-38.7	117.1	0	0	0	0	107.2
872	V	28.8	Very low	31.4	Very low	132 Å²	132	143.2 Å²	143.2	80%	0.8	76%	0.764	S	S	*	*			trans	67	151.8	169.7	150.3	0	0	0	0	115.2
873	T	28	Very low	31.3	Very low	113 Å²	113	146.4 Å²	146.4	69%	0.693	77%	0.772	S	S	*	*			cis	-167	-171.9	-26.1	-76.6	0	0	0	0	106.6
874	S	31.5	Very low	31.3	Very low	103 Å²	103	145.8 Å²	145.8	72%	0.72	77%	0.769	S	S	*	*			trans	78	92.7	160.5	37.9	0	0	0	0	120.9
875	I	31.6	Very low	31.5	Very low	161 Å²	161	145.1 Å²	145.1	83%	0.826	77%	0.766	S	S	*	*				-25.8	160.9	122.1	30.1	169.6	0	0	0	115.4
876	P	34.7	Very low	31	Very low	107 Å²	107	146.4 Å²	146.4	70%	0.695	77%	0.769	S	S	*	*			cis	-149.5	-171.6	25.7	44.4	-23.7	0	0	0	119
877	S	29.7	Very low	31.2	Very low	97 Å²	97	141 Å²	141	68%	0.678	77%	0.765	S	S	*	*			trans	85.6	111.2	136.3	-72.4	0	0	0	0	124.9
878	T	28.7	Very low	31	Very low	121 Å²	121	138.1 Å²	138.1	74%	0.742	77%	0.765	S	S	*	*			trans	54	131.7	131	59.1	0	0	0	0	123.6
879	I	32.9	Very low	31.1	Very low	158 Å²	158	133 Å²	133	81%	0.81	76%	0.76	S	S	*	*				-168	110.7	118.9	-92.5	147.4	0	0	0	106.2
880	R	28.2	Very low	30.9	Very low	219 Å²	219	135.4 Å²	135.4	83%	0.826	77%	0.767	S	S	*	*				60.7	106.1	82.3	-91.5	-165.9	177.4	-172.7	2.1	115.8
881	H	35.6	Very low	30.9	Very low	183 Å²	183	138 Å²	138	85%	0.847	77%	0.767	S	S	*	*			trans	-174.9	95.6	136.9	-95.1	-71.3	0	0	0	106.6
882	N	28.6	Very low	31.2	Very low	143 Å²	143	138.8 Å²	138.8	77%	0.765	77%	0.768	S	S	*	*				47.5	97.5	77.3	-92.2	22.7	0	0	0	115.1
883	F	33.9	Very low	31.6	Very low	211 Å²	211	137 Å²	137	93%	0.925	76%	0.759	S	S	*	*			trans	-148	155.2	136	-103.3	-74	0	0	0	111
884	N	29.6	Very low	31.5	Very low	142 Å²	142	138.7 Å²	138.7	76%	0.759	76%	0.764	S	S	*	*			trans	-162.7	179.2	-165.8	-157.5	24.4	0	0	0	105.8
885	P	38	Very low	31.6	Very low	86 Å²	86	139.1 Å²	139.1	56%	0.558	77%	0.773	S	S	*	*			cis	-126.3	-171.3	-28.8	21.6	3.2	0	0	0	112.8
886	N	26.7	Very low	31.8	Very low	152 Å²	152	142.3 Å²	142.3	81%	0.813	78%	0.775	S	S	*	*			trans	46.3	116.2	143.9	-62.4	-10.1	0	0	0	123.1
887	S	32.2	Very low	31.8	Very low	110 Å²	110	142.9 Å²	142.9	77%	0.769	78%	0.779	S	S	*	*			trans	-160.6	94	138.1	52.6	0	0	0	0	111.1
888	T	30.4	Very low	32	Very low	141 Å²	141	141.9 Å²	141.9	87%	0.865	78%	0.776	S	S	*	*				72.6	110.9	91.5	57.2	0	0	0	0	117.3
889	G	31.7	Very low	32.1	Very low	72 Å²	72	146.1 Å²	146.1	74%	0.742	78%	0.78	S	S	*	*			trans	112.2	154.6	152.9	0	0	0	0	0	117
890	L	31	Very low	32.2	Very low	146 Å²	146	143.2 Å²	143.2	76%	0.764	77%	0.769	S	S	*	*			cis	-161.1	159.1	-8.9	-109.6	175.5	0	0	0	110.8
891	F	31.5	Very low	32.4	Very low	182 Å²	182	138.7 Å²	138.7	80%	0.798	76%	0.762	S	S	*	*			trans	59.7	105.8	163	-63.8	-60.2	0	0	0	123.2
892	N	32.1	Very low	32.2	Very low	136 Å²	136	136.9 Å²	136.9	73%	0.727	75%	0.753	S	S	*	*				-71.4	162.7	124.8	-155.9	32.9	0	0	0	107.8
893	P	36	Very low	32.6	Very low	94 Å²	94	137.7 Å²	137.7	61%	0.61	75%	0.75	S	S	*	*			cis	-151.8	-176.2	27.2	45.9	-24.1	0	0	0	119.2
894	N	27.4	Very low	32.4	Very low	149 Å²	149	135.8 Å²	135.8	80%	0.797	74%	0.744	S	S	*	*			trans	30.9	121	143.8	-60.6	-16.2	0	0	0	122.4
895	A	33.9	Very low	32.3	Very low	111 Å²	111	134.2 Å²	134.2	92%	0.917	74%	0.736	S	S	*	*			trans	-155.8	155.1	141.9	0	0	0	0	0	112.5
896	R	33.9	Very low	32.2	Very low	229 Å²	229	138.4 Å²	138.4	86%	0.864	75%	0.745	S	S	*	*			trans	-137	154.8	-179.7	-156	-167.5	-177.4	-166.9	1.9	108.5
897	P	36.3	Very low	32.4	Very low	119 Å²	119	137.4 Å²	137.4	77%	0.773	74%	0.74	S	S	*	*				-134.4	153	98.3	7.4	16.6	0	0	0	112.9
898	A	32.5	Very low	32.2	Very low	75 Å²	75	139.2 Å²	139.2	62%	0.62	74%	0.741	S	S	*	*				62.1	132.1	85.8	0	0	0	0	0	113.4
899	Y	32.2	Very low	32.1	Very low	210 Å²	210	141.9 Å²	141.9	82%	0.824	74%	0.741	S	S	*	*			cis	-146.4	134.9	47.1	-146.7	-127.3	0	0	0	109.9
900	V	34.6	Very low	31.9	Very low	97 Å²	97	142.7 Å²	142.7	59%	0.588	74%	0.74	S	S	*	*				75.3	130	109.6	165	0	0	0	0	114.6
901	D	33.1	Very low	31.8	Very low	125 Å²	125	145.2 Å²	145.2	67%	0.668	75%	0.746	S	S	*	*			cis	-146.5	154.9	13.3	-125.9	-10.4	0	0	0	115.9
902	E	31.1	Very low	31.6	Very low	144 Å²	144	143.4 Å²	143.4	67%	0.673	74%	0.744	S	S	*	*			trans	22.8	143	134.4	-80.2	-157.4	137.8	0	0	122.7
903	K	36	Very low	31.6	Very low	160 Å²	160	144.9 Å²	144.9	70%	0.696	74%	0.744	S	S	*	*			cis	-143.7	150.9	6.8	-53.5	-175.5	169.3	164.2	0	108.5
904	Q	29.5	Very low	31.3	Very low	171 Å²	171	147.5 Å²	147.5	80%	0.799	75%	0.749	S	S	*	*				54.6	135.6	57.2	-71.5	-114.6	6.7	0	0	113.5
905	N	29.1	Very low	31.3	Very low	109 Å²	109	144.9 Å²	144.9	58%	0.583	74%	0.742	S	S	*	*			cis	-176.1	143.2	-3.7	177.6	-2.4	0	0	0	108.6
906	K	34.1	Very low	31.1	Very low	174 Å²	174	149.4 Å²	149.4	76%	0.757	74%	0.741	S	S	*	*				156.2	131.7	126.5	-82.9	165.9	-172.7	175.5	0	116
907	N	32.1	Very low	30.7	Very low	131 Å²	131	146 Å²	146	70%	0.701	74%	0.74	S	S	*	*			trans	42.3	117.9	133.4	-53.4	-8.3	0	0	0	119.7
908	N	26.8	Very low	30.5	Very low	148 Å²	148	146.9 Å²	146.9	79%	0.791	74%	0.738	S	S	*	*				56.6	110.1	80	-81.3	-10.7	0	0	0	115.2
909	F	29.4	Very low	30.4	Very low	197 Å²	197	150.1 Å²	150.1	86%	0.864	74%	0.744	S	S	*	*				-156.7	147.6	123.5	-113.2	-73.9	0	0	0	110.6	F911	F909-F911 HydrophobicContact CD1-CD2 4.48Å; F909-F911 HydrophobicContact CD1-CE2 4.45Å; F909-F911 HydrophobicContact CE1-CE2 4.44Å
910	A	26.9	Very low	30.3	Very low	89 Å²	89	144.4 Å²	144.4	74%	0.736	74%	0.735	S	S	*	*			trans	-131.5	141.8	172	0	0	0	0	0	109.1
911	F	30.2	Very low	30	Very low	199 Å²	199	147 Å²	147	87%	0.873	75%	0.746	S	S	*	*			trans	-132	164.7	167.7	-106.3	-89.9	0	0	0	110.8	F909	F909-F911 HydrophobicContact CD1-CD2 4.48Å; F909-F911 HydrophobicContact CD1-CE2 4.45Å; F909-F911 HydrophobicContact CE1-CE2 4.44Å
912	N	26	Very low	29.9	Very low	144 Å²	144	147 Å²	147	77%	0.77	75%	0.75	S	S	*	*			trans	-145	175.3	-152.3	-170.8	1	0	0	0	109.3
913	K	32.3	Very low	29.9	Very low	168 Å²	168	146.5 Å²	146.5	73%	0.73	75%	0.752	S	S	*	*			trans	83.8	153.4	178.1	-56.6	172	151.9	-161.2	0	115.3
914	Q	30.8	Very low	29.5	Very low	149 Å²	149	146.2 Å²	146.2	70%	0.696	76%	0.757	S	S	*	*			cis	-148.3	148.4	-15.9	-119.5	161.9	-53.3	0	0	112.4
915	S	27	Very low	29.7	Very low	93 Å²	93	146.4 Å²	146.4	65%	0.65	76%	0.755	S	S	*	*			trans	-50.3	150.1	169.1	50.6	0	0	0	0	117.2
916	F	29.4	Very low	29.7	Very low	207 Å²	207	150.9 Å²	150.9	91%	0.908	77%	0.765	S	S	*	*			trans	-138.3	151.2	141.8	-94	-79.6	0	0	0	110.1
917	N	25.4	Very low	29.4	Very low	156 Å²	156	149.6 Å²	149.6	83%	0.834	77%	0.767	S	S	*	*			trans	-156.3	126.6	-169.6	-146.5	20.5	0	0	0	109.8
918	L	31.6	Very low	29.4	Very low	139 Å²	139	152.2 Å²	152.2	73%	0.728	78%	0.775	S	S	*	*			trans	-149.6	117.1	168.7	-85.6	104.2	0	0	0	105.7
919	D	31.4	Very low	29.5	Very low	142 Å²	142	153 Å²	153	76%	0.759	78%	0.778	S	S	*	*				83.5	148.5	86.5	-68.6	-27.7	0	0	0	113.6
920	S	29.3	Very low	29.5	Very low	90 Å²	90	150.7 Å²	150.7	63%	0.629	78%	0.775	S	S	*	*			cis	-163.7	155.5	-32.4	65.4	0	0	0	0	109.6
921	N	28.3	Very low	29.7	Very low	152 Å²	152	151.4 Å²	151.4	81%	0.813	77%	0.773	S	S	*	*			trans	56.8	146.3	160.4	-64.7	-39.8	0	0	0	122.3
922	V	32.3	Very low	29.8	Very low	125 Å²	125	149.5 Å²	149.5	76%	0.758	77%	0.772	S	S	*	*				171.4	118.6	119.6	155.8	0	0	0	0	110.1
923	D	30.6	Very low	30	Very low	134 Å²	134	146.7 Å²	146.7	72%	0.717	77%	0.769	S	S	*	*			trans	35.3	139.3	148.4	-53.3	-24.3	0	0	0	122.8
924	L	28.2	Very low	30.1	Very low	153 Å²	153	148.1 Å²	148.1	80%	0.801	78%	0.775	S	S	*	*			cis	108.5	105.8	22.6	-82.9	171.9	0	0	0	114.7
925	K	32	Very low	30	Very low	175 Å²	175	152.2 Å²	152.2	76%	0.761	78%	0.784	S	S	*	*			trans	176.1	144.1	154.8	-104.5	165.2	-178.3	177.8	0	108.1
926	Y	30.8	Very low	30.3	Very low	204 Å²	204	154 Å²	154	80%	0.8	79%	0.792	S	S	*	*			cis	-125.6	174.4	7	-96.5	-87.1	0	0	0	112.2
927	N	27.1	Very low	30.3	Very low	147 Å²	147	148.6 Å²	148.6	79%	0.786	78%	0.779	S	S	*	*			trans	-107.4	-163.1	-171.9	-76.1	-22.8	0	0	0	113.8
928	E	30.8	Very low	30.7	Very low	185 Å²	185	147.8 Å²	147.8	86%	0.864	78%	0.775	S	S	*	*			trans	75.1	99	172.3	-61.4	169.8	-178.8	0	0	114
929	L	29	Very low	30.8	Very low	166 Å²	166	151.1 Å²	151.1	87%	0.869	78%	0.778	S	S	*	*			cis	72.6	115.3	13.6	-122.2	-174.9	0	0	0	115.7
930	D	30.7	Very low	30.7	Very low	148 Å²	148	151.5 Å²	151.5	79%	0.791	78%	0.78	S	S	*	*			trans	-158.1	164.8	163.2	-154.8	-11.9	0	0	0	110.6
931	C	31.6	Very low	30.8	Very low	104 Å²	104	153.1 Å²	153.1	70%	0.703	79%	0.791	S	S	*	*	S	Bend	trans	73.2	82.6	169.7	-60.9	0	0	0	0	120.2
932	D	32	Very low	30.9	Very low	159 Å²	159	155.6 Å²	155.6	85%	0.85	80%	0.795	S	S	*	*			trans	55	90.6	132.3	-66.8	-35.8	0	0	0	124.8
933	A	29.8	Very low	30.9	Very low	85 Å²	85	156.3 Å²	156.3	70%	0.702	80%	0.799	S	S	*	*				35	111.3	112.6	0	0	0	0	0	123.4
934	K	33.8	Very low	30.9	Very low	197 Å²	197	155.3 Å²	155.3	86%	0.857	80%	0.8	S	S	*	*				-178.5	123.2	121.1	-92.2	146.1	-170.4	168.8	0	109
935	R	29.4	Very low	30.8	Very low	236 Å²	236	154.2 Å²	154.2	89%	0.891	80%	0.804	S	S	*	*				56.9	127.5	81.5	-77.9	-169.1	-178.8	-170.7	2.4	112.7
936	T	33.8	Very low	30.7	Very low	131 Å²	131	149.5 Å²	149.5	80%	0.804	81%	0.805	S	S	*	*			cis	-145.4	168.5	15.4	36.3	0	0	0	0	115.4
937	S	28.9	Very low	30.7	Very low	93 Å²	93	147.2 Å²	147.2	65%	0.65	81%	0.806	S	S	*	*			trans	-59.8	154.5	175.8	49.5	0	0	0	0	118.9
938	D	34.2	Very low	30.9	Very low	139 Å²	139	148 Å²	148	74%	0.743	81%	0.81	S	S	*	*				170.1	168.1	120.3	-90.9	-16.1	0	0	0	111.8
939	R	32	Very low	30.8	Very low	208 Å²	208	146.6 Å²	146.6	79%	0.785	81%	0.809	S	S	*	*				-163.9	133.4	-55.4	-124.4	-179.9	177.2	-179.2	-0.5	109
940	N	29.9	Very low	30.8	Very low	150 Å²	150	146.6 Å²	146.6	80%	0.802	80%	0.804	S	S	*	*			trans	53.5	114.4	157.9	-58.7	-13.4	0	0	0	122.1
941	S	32.4	Very low	30.7	Very low	125 Å²	125	150.5 Å²	150.5	87%	0.874	81%	0.808	S	S	*	*			trans	-147.9	147.4	134.5	74.3	0	0	0	0	112.3
942	K	30.6	Very low	30.4	Very low	203 Å²	203	156 Å²	156	88%	0.883	82%	0.821	S	S	*	*			trans	-71.8	150.4	-168.6	-61.7	165.7	175.3	172.6	0	114.1
943	V	32.3	Very low	30.1	Very low	141 Å²	141	152 Å²	152	86%	0.855	82%	0.816	S	S	*	*				-170.1	142	124.8	146.7	0	0	0	0	108
944	P	30.6	Very low	30.1	Very low	112 Å²	112	153.7 Å²	153.7	73%	0.727	82%	0.818	S	S	*	*			trans	-99.1	155.9	-163.6	37.2	-36.9	0	0	0	117.3
945	C	25.6	Very low	30	Very low	131 Å²	131	152.3 Å²	152.3	89%	0.885	82%	0.819	S	S	*	*			trans	23	117.6	150.8	-54.9	0	0	0	0	120.8
946	G	29.8	Very low	30.1	Very low	75 Å²	75	144 Å²	144	77%	0.773	81%	0.806	S	S	*	*			trans	-133.1	121	151.7	0	0	0	0	0	110.4
947	N	30.2	Very low	29.8	Very low	157 Å²	157	146 Å²	146	84%	0.84	81%	0.811	S	S	*	*			trans	-68.5	134.5	175.8	-75.7	-10.4	0	0	0	110.6
948	N	30.8	Very low	29.8	Very low	163 Å²	163	146.1 Å²	146.1	87%	0.872	81%	0.812	S	S	*	*			trans	-162.9	132.3	142.6	-102.7	-40.5	0	0	0	111.1	E950	N948-E950 PolarHBondContact O-N 3.32Å
949	N	30.4	Very low	29.8	Very low	155 Å²	155	149.2 Å²	149.2	83%	0.829	82%	0.819	S	S	*	*			trans	-75.6	117.3	179.4	-67.3	-11.1	0	0	0	110.4
950	E	28.2	Very low	29.7	Very low	166 Å²	166	150 Å²	150	78%	0.776	82%	0.822	S	S	*	*	S	Bend		44.5	125.1	125.2	-67.4	-144.8	116.8	0	0	120.2	N948	N948-E950 PolarHBondContact O-N 3.32Å
951	W	28.1	Very low	29.5	Very low	231 Å²	231	149.8 Å²	149.8	88%	0.875	82%	0.821	S	S	*	*	S	Bend	trans	76.6	56.6	160.2	-70.4	60.3	0	0	0	118.9
952	F	26.4	Very low	29.4	Very low	219 Å²	219	152.2 Å²	152.2	96%	0.961	82%	0.818	S	S	*	*			trans	46.1	75.2	138.7	-75.5	-80.2	0	0	0	118
953	G	25.6	Very low	29.3	Very low	74 Å²	74	147.9 Å²	147.9	76%	0.763	81%	0.805	S	S	*	*			trans	-139.3	115.9	161.2	0	0	0	0	0	111.1
954	T	28.9	Very low	29	Very low	121 Å²	121	146.2 Å²	146.2	74%	0.742	80%	0.8	S	S	*	*			trans	-153.9	115.8	-173.8	-45.4	0	0	0	0	111.6
955	I	32.2	Very low	28.9	Very low	168 Å²	168	146.5 Å²	146.5	86%	0.862	80%	0.799	S	S	*	*			trans	44.3	136.9	143.5	-49.6	171.8	0	0	0	118.8
956	G	30.3	Very low	29.2	Very low	61 Å²	61	147.2 Å²	147.2	63%	0.629	79%	0.792	S	S	*	*			cis	155.9	149.1	-4.5	0	0	0	0	0	113.5
957	L	29.5	Very low	29.1	Very low	173 Å²	173	150.9 Å²	150.9	91%	0.906	79%	0.789	S	S	*	*			trans	47.8	114.8	151.6	-56.9	178.3	0	0	0	122.8
958	S	27.8	Very low	29	Very low	97 Å²	97	148.4 Å²	148.4	68%	0.678	78%	0.776	S	S	*	*				74.8	105.9	119.6	-160.3	0	0	0	0	122.7
959	K	34.8	Very low	29	Very low	203 Å²	203	150.2 Å²	150.2	88%	0.883	77%	0.772	S	S	*	*			trans	175.5	112.6	133.2	-95.3	164.3	-177.2	-177.6	0	105.8
960	R	28.5	Very low	28.9	Very low	224 Å²	224	151.1 Å²	151.1	85%	0.845	77%	0.771	S	S	*	*				78.5	120.3	52.9	-161	-171.7	-69.9	-173.6	-0.5	112.1
961	N	26.4	Very low	28.9	Very low	147 Å²	147	149 Å²	149	79%	0.786	77%	0.769	S	S	*	*			trans	-35.3	151.8	-168.7	-48.4	4.9	0	0	0	118.5
962	Q	30.3	Very low	28.9	Very low	175 Å²	175	144.9 Å²	144.9	82%	0.818	76%	0.764	S	S	*	*				166.5	153.5	128.2	-82.7	-160.3	-74.3	0	0	107.6
963	D	28.1	Very low	28.9	Very low	112 Å²	112	139.3 Å²	139.3	60%	0.599	75%	0.748	S	S	*	*			cis	-165.5	138.2	-29.3	-97.7	-20.2	0	0	0	108.2
964	S	26.1	Very low	29.1	Very low	107 Å²	107	144.4 Å²	144.4	75%	0.748	75%	0.75	S	S	*	*			trans	66.9	170.2	146.3	80.7	0	0	0	0	122.9
965	V	30.1	Very low	29	Very low	118 Å²	118	145.8 Å²	145.8	72%	0.715	75%	0.753	S	S	*	*			trans	84.4	123.4	143.9	159.9	0	0	0	0	121.6
966	I	30	Very low	28.8	Very low	145 Å²	145	143.2 Å²	143.2	74%	0.744	75%	0.748	S	S	*	*			trans	64.3	129	157.5	-75.5	167.3	0	0	0	117.1
967	H	28.6	Very low	28.9	Very low	152 Å²	152	146.6 Å²	146.6	70%	0.704	75%	0.747	S	S	*	*			cis	114.7	134.6	26.8	-111.9	-69	0	0	0	110.7
968	N	28.6	Very low	28.9	Very low	106 Å²	106	144.5 Å²	144.5	57%	0.567	75%	0.747	S	S	*	*			trans	82	154	143.9	-68.1	-13.2	0	0	0	123.5
969	Y	30	Very low	29	Very low	200 Å²	200	147 Å²	147	78%	0.784	75%	0.749	S	S	*	*			trans	49.9	98.8	164.5	-55.4	-55.7	0	0	0	117.6
970	H	28.6	Very low	28.7	Very low	174 Å²	174	142.8 Å²	142.8	81%	0.806	74%	0.743	S	S	*	*				57.3	146.4	56.3	-151.2	-77.7	0	0	0	114.1
971	V	28.8	Very low	28.8	Very low	121 Å²	121	140.5 Å²	140.5	73%	0.733	74%	0.739	S	S	*	*			trans	95	123	172.8	-172	0	0	0	0	115.7
972	N	26.7	Very low	29	Very low	145 Å²	145	138.7 Å²	138.7	78%	0.775	73%	0.73	S	S	*	*			trans	-67.4	-179	173.4	-57	-47.3	0	0	0	110.2
973	T	27	Very low	29	Very low	102 Å²	102	137.8 Å²	137.8	63%	0.626	73%	0.725	S	S	*	*				175.7	177.4	53.6	-31.8	0	0	0	0	110.4
974	F	29.4	Very low	29.2	Very low	181 Å²	181	138.1 Å²	138.1	79%	0.794	73%	0.732	S	S	*	*			trans	83.2	97.8	154.7	-68.4	-60.9	0	0	0	120.7
975	N	28.2	Very low	29.4	Very low	151 Å²	151	138.5 Å²	138.5	81%	0.807	73%	0.725	S	S	*	*				13.2	121.5	117.3	-79.9	-0.8	0	0	0	118.3
976	C	27.3	Very low	29.6	Very low	113 Å²	113	139.7 Å²	139.7	76%	0.764	72%	0.723	S	S	*	*			trans	-151.6	150.5	143.6	-83.3	0	0	0	0	106.5
977	H	31.7	Very low	29.8	Very low	132 Å²	132	140.5 Å²	140.5	61%	0.611	72%	0.723	S	S	*	*			cis	-158.6	152.4	-3	-130.6	47.4	0	0	0	107.9	Q979	H977-Q979 VanDerWaalsContact CD2-CG 3.42Å; H977-Q979 WeakPolarHBondContact CD2-CG 3.4Å; H977-Q979 PolarHBondContact CD2-OE1 2.93Å
978	S	30	Very low	30.1	Very low	130 Å²	130	138.5 Å²	138.5	91%	0.909	72%	0.724	S	S	*	*			trans	-151.7	107.1	151.2	-156.5	0	0	0	0	108.3
979	Q	30.3	Very low	30.7	Very low	150 Å²	150	139 Å²	139	70%	0.701	73%	0.732	S	S	*	*			trans	-96.8	147.3	-177.7	-65.7	162.9	-63.3	0	0	110.5	H977	H977-Q979 VanDerWaalsContact CD2-CG 3.42Å; H977-Q979 WeakPolarHBondContact CD2-CG 3.4Å; H977-Q979 PolarHBondContact CD2-OE1 2.93Å
980	C	28.4	Very low	31	Very low	113 Å²	113	135.3 Å²	135.3	76%	0.764	73%	0.731	S	S	*	*			trans	177.6	125.7	156	-91.2	0	0	0	0	105.6
981	F	30.6	Very low	31.3	Very low	176 Å²	176	134.9 Å²	134.9	77%	0.772	73%	0.729	S	S	*	*			cis	-152.7	152.3	0.3	-119.3	-91.4	0	0	0	109.1
982	N	30.9	Very low	31.6	Very low	110 Å²	110	134.9 Å²	134.9	59%	0.588	73%	0.725	S	S	*	*			trans	60	127.6	151.8	-79.6	25.8	0	0	0	122.4
983	E	28.5	Very low	32.1	Very low	155 Å²	155	131.7 Å²	131.7	72%	0.724	72%	0.719	S	S	*	*				75.4	141.5	71.3	-69.4	-179.7	165	0	0	113.1
984	T	32.9	Very low	32.5	Very low	120 Å²	120	134.2 Å²	134.2	74%	0.736	73%	0.728	S	S	*	*			cis	-157	-173.3	-7.9	30.6	0	0	0	0	107
985	N	30.4	Very low	33.2	Very low	114 Å²	114	130.6 Å²	130.6	61%	0.61	72%	0.723	S	S	*	*			cis	-157.5	175	-0	-145.7	-32.5	0	0	0	110.7
986	H	34.4	Very low	33.6	Very low	143 Å²	143	129.7 Å²	129.7	66%	0.662	72%	0.723	S	S	*	*			trans	59	167.6	157.6	-59.4	-45.5	0	0	0	119.1
987	H	35	Very low	34	Very low	163 Å²	163	128.6 Å²	128.6	76%	0.755	72%	0.716	S	S	*	*			cis	-150.8	172.4	-48.1	-111.3	-33.8	0	0	0	107.8
988	P	35.2	Very low	34.2	Very low	110 Å²	110	127.7 Å²	127.7	71%	0.714	72%	0.72	S	S	*	*			trans	-120	-128	-148.7	26.7	-0.1	0	0	0	114.4
989	P	40.8	Very low	34.5	Very low	115 Å²	115	129 Å²	129	75%	0.747	71%	0.711	S	S	*	*				-115.4	-171.6	-104.8	40.6	-26	0	0	0	112.8
990	V	35.3	Very low	34.7	Very low	123 Å²	123	129 Å²	129	75%	0.745	71%	0.713	S	S	*	*			trans	-167.9	133	150.5	125.3	0	0	0	0	112.4
991	E	34.7	Very low	34.8	Very low	166 Å²	166	128.1 Å²	128.1	78%	0.776	71%	0.708	S	S	*	*			trans	51.7	160.2	150.2	-62.3	-174.3	170.5	0	0	121.7
992	N	35.5	Very low	35	Very low	120 Å²	120	125.4 Å²	125.4	64%	0.642	71%	0.706	S	S	*	*			cis	-152.6	179.5	-10.1	-125.4	-51	0	0	0	106.5
993	A	37.1	Very low	34.9	Very low	79 Å²	79	130.8 Å²	130.8	65%	0.653	72%	0.718	S	S	*	*			cis	-153.8	139.7	0.3	0	0	0	0	0	106.4
994	L	36.1	Very low	35.2	Very low	155 Å²	155	130.5 Å²	130.5	81%	0.812	72%	0.721	S	S	*	*				76.8	147.6	82	-95.4	81.6	0	0	0	116.6
995	P	42.7	Very low	35	Very low	105 Å²	105	133.2 Å²	133.2	68%	0.682	72%	0.723	S	S	*	*				-146.3	-127.1	-119.3	43.9	-20.6	0	0	0	115
996	T	37.1	Very low	35	Very low	132 Å²	132	134.4 Å²	134.4	81%	0.81	73%	0.729	S	S	*	*			trans	87.7	149.3	177.7	77.9	0	0	0	0	115.6
997	S	35.7	Very low	34.7	Very low	89 Å²	89	132 Å²	132	62%	0.622	73%	0.729	S	S	*	*			cis	-153.9	136.6	9.8	-159	0	0	0	0	115.1
998	T	36.4	Very low	34.6	Very low	114 Å²	114	130.4 Å²	130.4	70%	0.699	73%	0.73	S	S	*	*			trans	59.6	159.3	140.3	51.9	0	0	0	0	122
999	H	36.2	Very low	34.3	Very low	157 Å²	157	130.9 Å²	130.9	73%	0.727	73%	0.731	S	S	*	*			cis	-152.8	146.1	1.9	-132.7	-75.6	0	0	0	111.7
1000	M	33.9	Very low	33.8	Very low	150 Å²	150	136.7 Å²	136.7	74%	0.739	74%	0.738	S	S	*	*			trans	29.6	125	149.1	-66.8	-69.2	173.5	0	0	121.8
1001	S	31.4	Very low	33.6	Very low	94 Å²	94	135.6 Å²	135.6	66%	0.657	74%	0.736	S	S	*	*				78.3	154.2	83.5	-53.5	0	0	0	0	114.9
1002	T	34.4	Very low	33.6	Very low	120 Å²	120	134.8 Å²	134.8	74%	0.736	74%	0.737	S	S	*	*			cis	-156.8	171.9	15.7	-21	0	0	0	0	113.1
1003	R	29.9	Very low	33.3	Very low	222 Å²	222	139.5 Å²	139.5	84%	0.838	75%	0.746	S	S	*	*			trans	-29.9	155.5	159.7	-50.6	160.2	-173.5	173.2	-0.2	115
1004	L	33.2	Very low	33	Very low	150 Å²	150	142 Å²	142	79%	0.785	75%	0.747	S	S	*	*				-156.6	146.2	51.6	-74.8	162.5	0	0	0	109.5
1005	F	29.2	Very low	32.8	Very low	176 Å²	176	140.3 Å²	140.3	77%	0.772	74%	0.744	S	S	*	*				76.1	137.9	73.8	-119.4	-82.1	0	0	0	116
1006	D	30.1	Very low	32.2	Very low	139 Å²	139	140.6 Å²	140.6	74%	0.743	75%	0.748	S	S	*	*			trans	64.7	156.5	174.3	-65.6	-41.8	0	0	0	119.8
1007	S	29.1	Very low	31.9	Very low	94 Å²	94	138.2 Å²	138.2	66%	0.657	75%	0.75	S	S	*	*			cis	-167.9	-161.6	-35.4	62.8	0	0	0	0	109.4
1008	V	32.2	Very low	31.6	Very low	129 Å²	129	144.4 Å²	144.4	78%	0.782	77%	0.766	S	S	*	*			trans	78.9	125.5	166.5	-162.1	0	0	0	0	119.1
1009	T	30	Very low	31.4	Very low	119 Å²	119	144.7 Å²	144.7	73%	0.73	77%	0.773	S	S	*	*			trans	-48	164.4	166.8	65.9	0	0	0	0	115.1
1010	R	30.4	Very low	31	Very low	238 Å²	238	142 Å²	142	90%	0.898	77%	0.771	S	S	*	*				-169.8	168.3	74.3	-142.6	168.9	-177.9	171.5	0.1	114.8
1011	S	30.4	Very low	31.1	Very low	99 Å²	99	140 Å²	140	69%	0.692	77%	0.769	S	S	*	*			trans	-77.4	164.5	-170.3	-42.4	0	0	0	0	116.6
1012	N	33.9	Very low	30.9	Very low	150 Å²	150	142.3 Å²	142.3	80%	0.802	77%	0.773	S	S	*	*			trans	129.4	111.2	148.5	-64.3	-17.9	0	0	0	110.3
1013	R	29.8	Very low	30.6	Very low	219 Å²	219	146 Å²	146	83%	0.826	77%	0.773	S	S	*	*			cis	66	102.8	39.1	-160.9	-152.1	-122	-138.1	3.2	113
1014	L	31.3	Very low	30.5	Very low	131 Å²	131	141.6 Å²	141.6	69%	0.686	76%	0.762	S	S	*	*				171.1	141.8	115.4	-90.2	169.7	0	0	0	111.3
1015	T	31	Very low	30.4	Very low	120 Å²	120	140.6 Å²	140.6	74%	0.736	75%	0.754	S	S	*	*			trans	55.2	158	147.5	51.4	0	0	0	0	121.1
1016	S	29.6	Very low	30.5	Very low	111 Å²	111	137.5 Å²	137.5	78%	0.776	75%	0.745	S	S	*	*			cis	-177.5	135	-33.8	52.7	0	0	0	0	107.2
1017	G	32.3	Very low	30.6	Very low	81 Å²	81	139.1 Å²	139.1	84%	0.835	75%	0.746	S	S	*	*			trans	-175.2	132.1	175.2	0	0	0	0	0	113.7
1018	F	29.2	Very low	30.7	Very low	220 Å²	220	142.1 Å²	142.1	97%	0.965	75%	0.753	S	S	*	*			trans	-85.8	132.8	168.6	-73.5	-109.7	0	0	0	109.4
1019	S	32.6	Very low	30.7	Very low	120 Å²	120	139.4 Å²	139.4	84%	0.839	75%	0.751	S	S	*	*				174.4	145.6	123.6	-168.8	0	0	0	0	111.1
1020	S	27.2	Very low	30.9	Very low	100 Å²	100	139 Å²	139	70%	0.699	76%	0.759	S	S	*	*			trans	-80.7	-179.4	162.8	-25.5	0	0	0	0	110.3
1021	P	35.2	Very low	31	Very low	108 Å²	108	137.6 Å²	137.6	70%	0.701	76%	0.76	S	S	*	*			cis	-133.6	-149.6	-13.8	24.8	1.7	0	0	0	111.4
1022	I	27.9	Very low	31.2	Very low	143 Å²	143	137.7 Å²	137.7	73%	0.733	77%	0.767	S	S	*	*			trans	93.2	105.8	149.7	-67.6	165.3	0	0	0	119.6
1023	R	27.5	Very low	31.3	Very low	197 Å²	197	135.2 Å²	135.2	74%	0.743	76%	0.759	S	S	*	*			trans	67	144.5	135.1	-85.9	173.1	152.7	-128.6	6.5	124.1
1024	Q	29.3	Very low	31.4	Very low	129 Å²	129	134.2 Å²	134.2	60%	0.603	76%	0.756	S	S	*	*			trans	67.9	140	143.5	-67	169.9	-84.3	0	0	117.2
1025	E	29.2	Very low	31.6	Very low	129 Å²	129	136.9 Å²	136.9	60%	0.603	76%	0.763	S	S	*	*			cis	-164.6	167.2	-1.9	-125.4	170.7	-127.2	0	0	111.1
1026	N	31.5	Very low	31.6	Very low	111 Å²	111	135.9 Å²	135.9	59%	0.594	76%	0.761	S	S	*	*			trans	46.4	135.3	151.3	-49.1	-28.9	0	0	0	120
1027	F	33.6	Very low	32.3	Very low	174 Å²	174	136.5 Å²	136.5	76%	0.763	76%	0.762	S	S	*	*				-163.7	139.9	68.1	-111.8	-94.3	0	0	0	114.3
1028	I	29.9	Very low	32.7	Very low	156 Å²	156	137.5 Å²	137.5	80%	0.8	75%	0.754	S	S	*	*			trans	9	130.4	145.3	-48.2	178.4	0	0	0	118.5
1029	G	32.3	Very low	32.7	Very low	73 Å²	73	133 Å²	133	75%	0.753	75%	0.747	S	S	*	*			trans	-169.9	84.9	168.4	0	0	0	0	0	118.6
1030	A	34.8	Very low	32.8	Very low	109 Å²	109	134.8 Å²	134.8	90%	0.901	75%	0.746	S	S	*	*			trans	61.6	146.8	153.8	0	0	0	0	0	122.3
1031	K	32.4	Very low	33	Very low	210 Å²	210	134.9 Å²	134.9	91%	0.913	75%	0.747	S	S	*	*			trans	-95.6	152.4	177.5	-56.1	168.3	179.2	175.5	0	111.6
1032	A	33.8	Very low	32.6	Very low	100 Å²	100	134.7 Å²	134.7	83%	0.826	75%	0.748	S	S	*	*			trans	-152.7	137.4	149.6	0	0	0	0	0	110.6
1033	P	36.1	Very low	32.8	Very low	99 Å²	99	133.6 Å²	133.6	64%	0.643	75%	0.753	S	S	*	*			trans	-118.8	-174.1	-174.3	21.2	2.8	0	0	0	114.6
1034	Y	33	Very low	33	Very low	197 Å²	197	133.9 Å²	133.9	77%	0.773	76%	0.76	S	S	*	*			trans	71.9	161.3	174.5	-45	-81.5	0	0	0	115.1
1035	F	34.6	Very low	33.1	Very low	187 Å²	187	133.4 Å²	133.4	82%	0.82	77%	0.771	S	S	*	*			cis	-130.7	154.1	5.6	-101.2	-79.3	0	0	0	112.2
1036	S	32.7	Very low	33.2	Very low	100 Å²	100	133 Å²	133	70%	0.699	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-81.9	151.3	166.5	39.4	0	0	0	0	112
1037	P	44.1	Very low	33.6	Very low	123 Å²	123	133 Å²	133	80%	0.799	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-76.9	137	176.4	31.1	-33.8	0	0	0	111.6
1038	P	39.3	Very low	33.6	Very low	103 Å²	103	134.9 Å²	134.9	67%	0.669	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-82	147.3	-179.6	32.7	-35.1	0	0	0	112.6
1039	P	30.7	Very low	33.7	Very low	125 Å²	125	134.3 Å²	134.3	81%	0.812	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-81.8	121.9	164.5	32.7	-29.7	0	0	0	109.6
1040	L	33.6	Very low	33.8	Very low	158 Å²	158	138.7 Å²	138.7	83%	0.827	80%	0.796	S	S	*	*			trans	-131.8	110.5	170.9	-77	177.2	0	0	0	111.6
1041	S	30.8	Very low	33.7	Very low	101 Å²	101	141.4 Å²	141.4	71%	0.706	79%	0.79	S	S	*	*			trans	-69.5	150.6	160.9	51	0	0	0	0	111
1042	S	28.7	Very low	33.8	Very low	104 Å²	104	135.6 Å²	135.6	73%	0.727	78%	0.781	S	S	*	*			trans	34.8	104.2	148.5	61.1	0	0	0	0	118.6
1043	S	30.7	Very low	33.9	Very low	121 Å²	121	137.2 Å²	137.2	85%	0.846	78%	0.776	S	S	*	*				-171.9	156.3	113.5	38.3	0	0	0	0	113.2
1044	F	31.6	Very low	34	Very low	202 Å²	202	139.2 Å²	139.2	89%	0.886	78%	0.78	S	S	*	*			trans	-65.4	132.5	176.7	-65.5	-109.1	0	0	0	111.5
1045	S	31.4	Very low	34	Very low	120 Å²	120	134 Å²	134	84%	0.839	77%	0.772	S	S	*	*				-174.8	145.7	106.5	-79.3	0	0	0	0	112.1
1046	S	32.6	Very low	33.9	Very low	119 Å²	119	132 Å²	132	83%	0.832	77%	0.77	S	S	*	*			trans	-100.2	170.4	-173.3	-56.6	0	0	0	0	111.7
1047	P	38.9	Very low	33.9	Very low	111 Å²	111	134.8 Å²	134.8	72%	0.721	77%	0.772	S	S	*	*			trans	-114.6	-166.7	-142	42.4	-35.1	0	0	0	113.8
1048	K	33.4	Very low	33.5	Very low	215 Å²	215	134.3 Å²	134.3	94%	0.935	77%	0.767	S	S	*	*			trans	-150.6	148.2	150.9	-112.7	159.3	-173.4	177.4	0	112.9
1049	I	32.7	Very low	33.2	Very low	143 Å²	143	134.3 Å²	134.3	73%	0.733	77%	0.767	S	S	*	*			trans	-142.2	134.8	-176.1	-60.4	169.7	0	0	0	108.1
1050	M	34	Very low	33.1	Very low	166 Å²	166	136.9 Å²	136.9	82%	0.818	77%	0.773	S	S	*	*			trans	-148.1	134.9	150.3	-65.7	-161.9	79.8	0	0	107
1051	Q	32.2	Very low	32.9	Very low	166 Å²	166	134 Å²	134	78%	0.776	77%	0.766	S	S	*	*			cis	91.8	159	38.7	-76.5	-163.8	-19.3	0	0	114.9
1052	A	35.4	Very low	33.1	Very low	87 Å²	87	134.2 Å²	134.2	72%	0.719	76%	0.763	S	S	*	*			trans	82	140.2	-172.3	0	0	0	0	0	114.8
1053	N	36	Very low	33.4	Very low	135 Å²	135	135.9 Å²	135.9	72%	0.722	76%	0.764	S	S	*	*			cis	-163.6	154.3	-1.9	-121.5	-6.3	0	0	0	113.4
1054	I	37.8	Very low	33.9	Very low	141 Å²	141	134.9 Å²	134.9	72%	0.723	75%	0.753	S	S	*	*			trans	64	134.3	139.8	-68.9	169.4	0	0	0	118.2
1055	S	33.2	Very low	34.6	Very low	87 Å²	87	129.7 Å²	129.7	61%	0.608	74%	0.737	S	S	*	*			cis	-164.1	165.1	3.9	-130.4	0	0	0	0	113.3
1056	N	33.3	Very low	35.1	Very low	144 Å²	144	127 Å²	127	77%	0.77	72%	0.722	S	S	*	*			trans	64.7	145.9	153.3	-56.2	6.1	0	0	0	118.1
1057	E	32.6	Very low	35.6	Very low	159 Å²	159	125 Å²	125	74%	0.743	70%	0.702	S	S	*	*			cis	-169.4	162.6	-12.8	-106.4	-67.5	65.4	0	0	106.3
1058	V	34.2	Very low	36	Very low	113 Å²	113	122.9 Å²	122.9	69%	0.685	68%	0.684	S	S	*	*			cis	-152.9	150.1	-2.4	64.3	0	0	0	0	108.2
1059	P	33.1	Very low	36.6	Very low	104 Å²	104	120.8 Å²	120.8	68%	0.675	67%	0.674	S	S	*	*			trans	-100.8	166	-166.7	38	-35.9	0	0	0	116.2
1060	L	28.3	Very low	36.9	Very low	178 Å²	178	120.9 Å²	120.9	93%	0.932	68%	0.676	S	S	*	*			trans	-130.7	70.4	178.9	-160.3	81.5	0	0	0	113.4
1061	S	31.1	Very low	37.5	Very low	98 Å²	98	117.6 Å²	117.6	69%	0.685	66%	0.655	S	S	*	*			trans	-150.5	51.7	-174.7	53.2	0	0	0	0	115.5
1062	T	33.2	Very low	38.2	Very low	105 Å²	105	118.6 Å²	118.6	64%	0.644	65%	0.651	S	S	*	*			trans	-118.7	-12.7	-171.5	46.2	0	0	0	0	117
1063	N	35.6	Very low	38.4	Very low	140 Å²	140	124.4 Å²	124.4	75%	0.749	66%	0.655	S	S	*	*	H	α-helix	trans	-75.6	-30.5	-166.3	-74.2	-15.4	0	0	0	115.9
1064	T	40.8	Very low	38.6	Very low	99 Å²	99	124.4 Å²	124.4	61%	0.607	65%	0.654	S	S	*	*	H	α-helix	trans	-71.2	-43.6	-175.4	44.1	0	0	0	0	112.6	A1066 L1067	T1064-A1066 VanDerWaalsContact C-N 3.29Å; T1064-A1066 PolarHBondContact O-N 2.92Å; T1064-L1067 PolarHBondContact O-N 2.64Å
1065	T	47.4	Very low	38.7	Very low	93 Å²	93	119.8 Å²	119.8	57%	0.571	63%	0.63	S	S	*	*	H	α-helix	trans	-69	-27	-178.6	-30.4	0	0	0	0	112.9
1066	A	41	Very low	38.9	Very low	63 Å²	63	119.9 Å²	119.9	52%	0.521	62%	0.624	S	S	.	*	H	α-helix	trans	-68.2	-41.8	176.6	0	0	0	0	0	112	T1064 M1068 K1069	T1064-A1066 VanDerWaalsContact C-N 3.29Å; T1064-A1066 PolarHBondContact O-N 2.92Å; A1066-M1068 VanDerWaalsContact C-N 3.26Å; A1066-M1068 PolarHBondContact O-N 2.92Å; A1066-K1069 PolarHBondContact O-N 3.43Å
1067	L	43.9	Very low	39.1	Very low	77 Å²	77	118.9 Å²	118.9	40%	0.403	62%	0.624	S	S	.	*	H	α-helix	trans	-60.3	-35.6	-177.4	-150	72.3	0	0	0	112.3	T1064 K1069 E1135	T1064-L1067 PolarHBondContact O-N 2.64Å; L1067-K1069 PolarHBondContact O-N 2.98Å; L1067-E1135 WeakPolarHBondContact CD2-OE2 3.27Å
1068	M	47.4	Very low	39.5	Very low	68 Å²	68	113.5 Å²	113.5	34%	0.335	60%	0.604	S	S	.	*	H	α-helix	trans	-66.8	-32	-178.5	-62.1	-172.4	117.6	0	0	114.1	A1066 N1070 C1151	A1066-M1068 VanDerWaalsContact C-N 3.26Å; A1066-M1068 PolarHBondContact O-N 2.92Å; M1068-N1070 VanDerWaalsContact C-N 3.32Å; M1068-N1070 PolarHBondContact O-N 3.19Å; M1068-C1151 HydrophobicContact CE-CB 3.53Å; M1068-C1151 WeakPolarHBondContact CE-O 3.42Å; M1068-C1151 HydrophobicContact SD-CB 4.47Å
1069	K	46	Very low	39.7	Very low	171 Å²	171	114.2 Å²	114.2	74%	0.743	60%	0.599	S	S	*	*	H	α-helix	trans	-70.5	-25.7	-174.8	-75.6	-173.8	175.4	-180	0	113.5	A1066 L1067	A1066-K1069 PolarHBondContact O-N 3.43Å; L1067-K1069 PolarHBondContact O-N 2.98Å
1070	N	39.4	Very low	39.8	Very low	144 Å²	144	114.8 Å²	114.8	77%	0.77	60%	0.597	S	S	*	*	H	α-helix	trans	-84.7	-21.4	180	-90.4	-10.8	0	0	0	114.4	M1068	M1068-N1070 VanDerWaalsContact C-N 3.32Å; M1068-N1070 PolarHBondContact O-N 3.19Å
1071	R	46.6	Very low	40.1	Very low	98 Å²	98	109.7 Å²	109.7	37%	0.37	58%	0.58	S	S	.	*	H	α-helix	trans	-87.5	-26.5	-174.1	-94.7	-170.2	173.4	152.4	5.4	116.2	R1073 L1074 E1135	R1071-R1073 VanDerWaalsContact C-N 3.29Å; R1071-R1073 PolarHBondContact O-N 3.3Å; R1071-L1074 PolarHBondContact O-N 3.14Å; R1071-L1074 VanDerWaalsContact O-N 3.09Å; R1071-E1135 IonicContact CZ-OE1 3.26Å; R1071-E1135 VanDerWaalsContact CZ-OE1 3.26Å; R1071-E1135 IonicContact CZ-OE2 3.25Å; R1071-E1135 VanDerWaalsContact CZ-OE2 3.25Å; R1071-E1135 VanDerWaalsContact NH1-CD 3.26Å; R1071-E1135 IonicContact NH1-OE1 3.94Å; R1071-E1135 PolarHBondContact NH1-OE1 2.96Å; R1071-E1135 IonicContact NH1-OE2 2.76Å; R1071-E1135 PolarHBondContact NH1-OE2 3.1Å; R1071-E1135 VanDerWaalsContact NH2-CD 3.28Å; R1071-E1135 IonicContact NH2-OE1 2.94Å; R1071-E1135 PolarHBondContact NH2-OE1 3.46Å; R1071-E1135 IonicContact NH2-OE2 2.69Å; R1071-E1135 PolarHBondContact NH2-OE2 3.13Å
1072	R	45.4	Very low	40.4	Very low	187 Å²	187	110.3 Å²	110.3	71%	0.706	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-57.5	-40.7	-175.9	-70.5	-169.4	176.5	-172.5	-2.2	112.9	L1074 L1075 D1076	R1072-L1074 PolarHBondContact O-N 2.77Å; R1072-L1075 PolarHBondContact O-N 3.06Å; R1072-D1076 VanDerWaalsContact O-OD1 3.09Å
1073	R	39.2	Very low	40.7	Very low	209 Å²	209	110.2 Å²	110.2	79%	0.789	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-57.9	-3.6	176.1	-63.9	-173.9	-178.8	-177.8	0.8	116.1	R1071 D1076	R1071-R1073 VanDerWaalsContact C-N 3.29Å; R1071-R1073 PolarHBondContact O-N 3.3Å; R1073-D1076 WeakPolarHBondContact CA-OD2 3.36Å
1074	L	40.7	Very low	40.6	Very low	135 Å²	135	108.6 Å²	108.6	71%	0.707	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-109.6	2.4	176.2	-130.3	90.4	0	0	0	114.1	R1071 R1072	R1071-L1074 PolarHBondContact O-N 3.14Å; R1071-L1074 VanDerWaalsContact O-N 3.09Å; R1072-L1074 PolarHBondContact O-N 2.77Å
1075	L	40.8	Very low	40.4	Very low	43 Å²	43	109 Å²	109	23%	0.225	57%	0.568	C	S	.	*	T	Hydrogen-bonded Turn	trans	-116.6	-22.6	178.3	-68.7	173.4	0	0	0	113.1	R1072 T1077 S1078 T1128	R1072-L1075 PolarHBondContact O-N 3.06Å; L1075-T1077 PolarHBondContact O-N 3.36Å; L1075-S1078 WeakPolarHBondContact O-CB 3.43Å; L1075-S1078 PolarHBondContact O-N 3.43Å; L1075-S1078 PolarHBondContact O-OG 2.96Å; L1075-T1128 HydrophobicContact CD1-CG2 4.4Å
1076	D	37.2	Very low	39.5	Very low	90 Å²	90	111.5 Å²	111.5	48%	0.481	58%	0.577	S	S	.	*	H	α-helix	trans	-52.2	-25.2	175	-49.3	-21.5	0	0	0	113	R1072 R1073 S1078	R1072-D1076 VanDerWaalsContact O-OD1 3.09Å; R1073-D1076 WeakPolarHBondContact CA-OD2 3.36Å; D1076-S1078 PolarHBondContact O-N 3.48Å
1077	T	37.5	Very low	38.8	Very low	123 Å²	123	112.9 Å²	112.9	76%	0.755	58%	0.583	S	S	*	*	H	α-helix	trans	-74.9	-0.4	174.5	49.1	0	0	0	0	114.9	L1075	L1075-T1077 PolarHBondContact O-N 3.36Å
1078	S	41.5	Very low	37.9	Very low	46 Å²	46	116.9 Å²	116.9	32%	0.322	61%	0.605	S	S	.	*	H	α-helix	trans	-114.7	-18	-177.2	67.7	0	0	0	0	115.4	L1075 D1076 N1080 A1081	L1075-S1078 WeakPolarHBondContact O-CB 3.43Å; L1075-S1078 PolarHBondContact O-N 3.43Å; L1075-S1078 PolarHBondContact O-OG 2.96Å; D1076-S1078 PolarHBondContact O-N 3.48Å; S1078-N1080 VanDerWaalsContact C-N 3.3Å; S1078-N1080 PolarHBondContact O-N 2.96Å; S1078-A1081 WeakPolarHBondContact O-CB 3.42Å; S1078-A1081 PolarHBondContact O-N 3.33Å; S1078-A1081 VanDerWaalsContact O-N 3.12Å
1079	E	38.4	Very low	37	Very low	127 Å²	127	120.9 Å²	120.9	59%	0.593	63%	0.627	S	S	*	*	H	α-helix	trans	-63.9	-36.3	178.1	-62.4	-170	130	0	0	112	A1081 I1082 N1083	E1079-A1081 PolarHBondContact O-N 3.2Å; E1079-I1082 PolarHBondContact O-N 2.97Å; E1079-I1082 VanDerWaalsContact O-N 3.16Å; E1079-N1083 PolarHBondContact O-N 3.2Å
1080	N	33.5	Very low	36.1	Very low	117 Å²	117	121.9 Å²	121.9	63%	0.626	63%	0.631	S	S	*	*	H	α-helix	trans	-60.7	-24.9	175.4	-70.8	-19.8	0	0	0	113.3	S1078 I1082 T1084	S1078-N1080 VanDerWaalsContact C-N 3.3Å; S1078-N1080 PolarHBondContact O-N 2.96Å; N1080-I1082 VanDerWaalsContact C-N 3.29Å; N1080-I1082 PolarHBondContact O-N 2.78Å; N1080-T1084 PolarHBondContact O-OG1 3.32Å
1081	A	34.7	Very low	35.4	Very low	71 Å²	71	120.2 Å²	120.2	59%	0.587	63%	0.63	S	S	*	*	H	α-helix	trans	-77.5	-13.1	-179.8	0	0	0	0	0	114	S1078 E1079	S1078-A1081 WeakPolarHBondContact O-CB 3.42Å; S1078-A1081 PolarHBondContact O-N 3.33Å; S1078-A1081 VanDerWaalsContact O-N 3.12Å; E1079-A1081 PolarHBondContact O-N 3.2Å
1082	I	39	Very low	34.3	Very low	110 Å²	110	121.6 Å²	121.6	56%	0.564	65%	0.65	S	S	*	*	H	α-helix	trans	-101.3	-30.9	-178.2	-63.2	177.5	0	0	0	111.1	E1079 N1080	E1079-I1082 PolarHBondContact O-N 2.97Å; E1079-I1082 VanDerWaalsContact O-N 3.16Å; N1080-I1082 VanDerWaalsContact C-N 3.29Å; N1080-I1082 PolarHBondContact O-N 2.78Å
1083	N	38.2	Very low	33.4	Very low	103 Å²	103	119.6 Å²	119.6	55%	0.551	65%	0.653	S	S	*	*	H	α-helix	trans	-79.2	-30.9	-179.1	-64.6	-25.3	0	0	0	113.4	E1079 V1085 L1086	E1079-N1083 PolarHBondContact O-N 3.2Å; N1083-V1085 PolarHBondContact O-N 2.99Å; N1083-L1086 PolarHBondContact O-N 2.93Å; N1083-L1086 VanDerWaalsContact O-N 3.07Å
1084	T	33.7	Very low	32.9	Very low	106 Å²	106	115.6 Å²	115.6	65%	0.65	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	14.5	-172.9	-52.9	0	0	0	0	115.6	N1080	N1080-T1084 PolarHBondContact O-OG1 3.32Å
1085	V	37	Very low	32.4	Very low	108 Å²	108	115 Å²	115	66%	0.655	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.6	-9.1	170.5	-177.8	0	0	0	0	111.8	N1083	N1083-V1085 PolarHBondContact O-N 2.99Å
1086	L	29.1	Very low	32	Very low	146 Å²	146	121.1 Å²	121.1	76%	0.764	69%	0.691	S	S	*	*			trans	-110	90.2	166	-90.3	73.6	0	0	0	108.9	N1083	N1083-L1086 PolarHBondContact O-N 2.93Å; N1083-L1086 VanDerWaalsContact O-N 3.07Å
1087	S	24.7	Very low	31.8	Very low	92 Å²	92	121.5 Å²	121.5	64%	0.643	71%	0.707	S	S	*	*			trans	-136.7	76.4	173.9	-60.7	0	0	0	0	110.1
1088	N	26.4	Very low	31.9	Very low	161 Å²	161	119.6 Å²	119.6	86%	0.861	69%	0.692	S	S	*	*	S	Bend	trans	-155.4	123.3	153.9	-98	-32.5	0	0	0	107.2
1089	D	27.7	Very low	31.8	Very low	151 Å²	151	120.4 Å²	120.4	81%	0.807	70%	0.697	S	S	*	*			trans	-74.8	128.6	-161.1	-56.1	-80.1	0	0	0	114.3
1090	K	28.1	Very low	32.2	Very low	192 Å²	192	119.8 Å²	119.8	84%	0.835	71%	0.707	S	S	*	*				-176.7	121.3	110.1	-95.7	154	-173.1	174.2	0	114.1
1091	C	23.7	Very low	33.2	Very low	110 Å²	110	117 Å²	117	74%	0.743	70%	0.697	S	S	*	*			trans	50.3	131.9	145.3	-67.2	0	0	0	0	122.8
1092	T	24.7	Very low	34.4	Very low	127 Å²	127	117.7 Å²	117.7	78%	0.779	69%	0.691	S	S	*	*			trans	77.2	131.3	141.9	48.1	0	0	0	0	120.8
1093	D	25.4	Very low	35.6	Very low	144 Å²	144	113.7 Å²	113.7	77%	0.77	67%	0.67	S	S	*	*			trans	43.6	72.9	162.6	-64.9	-8.1	0	0	0	118.8	S1095	D1093-S1095 PolarHBondContact O-N 3.41Å
1094	S	29.3	Very low	36.9	Very low	125 Å²	125	112.5 Å²	112.5	87%	0.874	67%	0.67	S	S	*	*			trans	-71.2	47.8	169.4	-48.1	0	0	0	0	114.6	Q1096	S1094-Q1096 PolarHBondContact O-N 3.34Å
1095	S	30.5	Very low	38.8	Very low	122 Å²	122	111.9 Å²	111.9	85%	0.853	67%	0.67	S	S	*	*			trans	-91.3	35.7	163.2	-69.1	0	0	0	0	111.8	D1093	D1093-S1095 PolarHBondContact O-N 3.41Å
1096	Q	32.4	Very low	40.7	Very low	172 Å²	172	110.1 Å²	110.1	80%	0.804	65%	0.651	S	S	*	*	S	Bend	trans	-110.5	133.1	175.9	-67	-170.2	-4.4	0	0	110.7	S1094 I1098	S1094-Q1096 PolarHBondContact O-N 3.34Å; Q1096-I1098 PolarHBondContact O-N 3.01Å
1097	A	32.2	Very low	43.3	Very low	99 Å²	99	105.7 Å²	105.7	82%	0.818	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-67.8	125.8	166.1	0	0	0	0	0	108.1	S1099	A1097-S1099 PolarHBondContact O-N 3.1Å
1098	I	40.3	Very low	46.1	Very low	83 Å²	83	104.5 Å²	104.5	43%	0.426	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-57	116.6	174.6	-63	174	0	0	0	107.8	Q1096 D1102 R1165	Q1096-I1098 PolarHBondContact O-N 3.01Å; I1098-D1102 HydrophobicContact CG2-CB 4.05Å; I1098-R1165 VanDerWaalsContact CD1-CZ 3.49Å; I1098-R1165 VanDerWaalsContact CD1-NH2 3.28Å
1099	S	38.8	Very low	48.9	Very low	62 Å²	62	99.4 Å²	99.4	43%	0.434	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-63.1	150.6	178.7	171.7	0	0	0	0	110	A1097 S1101 D1102	A1097-S1099 PolarHBondContact O-N 3.1Å; S1099-S1101 WeakPolarHBondContact CB-OG 3.43Å; S1099-S1101 PolarHBondContact O-N 3.15Å; S1099-S1101 VanDerWaalsContact O-N 3.12Å; S1099-S1101 PolarHBondContact OG-N 3.31Å; S1099-S1101 PolarHBondContact OG-OG 2.87Å; S1099-D1102 PolarHBondContact O-N 3.5Å
1100	S	47.8	Very low	51.7	Low	114 Å²	114	96.1 Å²	96.1	80%	0.797	59%	0.585	S	S	*	*	H	α-helix	trans	-61.6	-17.5	174.2	45.8	0	0	0	0	113	D1102	S1100-D1102 VanDerWaalsContact C-N 3.34Å; S1100-D1102 PolarHBondContact O-N 3.28Å
1101	S	52.6	Low	54.5	Low	60 Å²	60	87 Å²	87	42%	0.42	55%	0.545	S	S	.	.	H	α-helix	trans	-53.2	-47.3	171.4	48.6	0	0	0	0	112.7	S1099 L1103 S1104	S1099-S1101 WeakPolarHBondContact CB-OG 3.43Å; S1099-S1101 PolarHBondContact O-N 3.15Å; S1099-S1101 VanDerWaalsContact O-N 3.12Å; S1099-S1101 PolarHBondContact OG-N 3.31Å; S1099-S1101 PolarHBondContact OG-OG 2.87Å; S1101-L1103 PolarHBondContact O-N 3.25Å; S1101-S1104 WeakPolarHBondContact O-CB 3.46Å; S1101-S1104 PolarHBondContact O-N 3.26Å; S1101-S1104 PolarHBondContact O-OG 3.48Å
1102	D	60.5	Low	57.6	Low	85 Å²	85	86.8 Å²	86.8	46%	0.455	53%	0.531	S	S	.	.	H	α-helix	trans	-73.4	-34.7	-164	-55.9	-0.4	0	0	0	111.2	I1098 S1099 S1100 S1104 S1105	I1098-D1102 HydrophobicContact CG2-CB 4.05Å; S1099-D1102 PolarHBondContact O-N 3.5Å; S1100-D1102 VanDerWaalsContact C-N 3.34Å; S1100-D1102 PolarHBondContact O-N 3.28Å; D1102-S1104 PolarHBondContact O-N 3.35Å; D1102-S1105 PolarHBondContact O-N 3.01Å; D1102-S1105 PolarHBondContact O-OG 2.89Å
1103	L	64.4	Low	60.6	Low	26 Å²	26	83.7 Å²	83.7	14%	0.136	51%	0.512	C	S	.	.	H	α-helix	trans	-64.2	-25.7	178.4	-123.1	69.3	0	0	0	112.6	S1101 S1105 L1169 E1172 R1176	S1101-L1103 PolarHBondContact O-N 3.25Å; L1103-S1105 VanDerWaalsContact C-N 3.26Å; L1103-S1105 PolarHBondContact O-N 3.41Å; L1103-L1169 HydrophobicContact CD1-CD2 4.3Å; L1103-L1169 HydrophobicContact CD2-CD2 4.21Å; L1103-L1169 HydrophobicContact CG-CD2 4.31Å; L1103-E1172 HydrophobicContact CD2-CB 3.98Å; L1103-E1172 HydrophobicContact CD2-CG 4.04Å; L1103-E1172 HydrophobicContact CG-CG 4.38Å; L1103-R1176 PolarHBondContact O-NH2 3.05Å
1104	S	65.2	Low	63.5	Low	77 Å²	77	77.6 Å²	77.6	54%	0.538	48%	0.482	S	S	.	.	H	α-helix	trans	-61.6	-32.8	178.4	73.5	0	0	0	0	112.8	S1101 D1102 W1106 R1176	S1101-S1104 WeakPolarHBondContact O-CB 3.46Å; S1101-S1104 PolarHBondContact O-N 3.26Å; S1101-S1104 PolarHBondContact O-OG 3.48Å; D1102-S1104 PolarHBondContact O-N 3.35Å; S1104-W1106 PolarHBondContact O-N 3.15Å; S1104-R1176 VanDerWaalsContact CA-NH2 3.31Å; S1104-R1176 PolarHBondContact O-NH2 2.99Å
1105	S	73.3	Confident	66.3	Low	94 Å²	94	71.9 Å²	71.9	66%	0.657	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-17.4	-172.3	66.4	0	0	0	0	115.6	D1102 L1103	D1102-S1105 PolarHBondContact O-N 3.01Å; D1102-S1105 PolarHBondContact O-OG 2.89Å; L1103-S1105 VanDerWaalsContact C-N 3.26Å; L1103-S1105 PolarHBondContact O-N 3.41Å
1106	W	77.8	Confident	69	Low	70 Å²	70	73.3 Å²	73.3	27%	0.265	43%	0.428	S	S	.	.			trans	-76.8	144.5	-170.9	-73.2	23.9	0	0	0	112.2	S1104 D1110 L1111 A1114 R1176	S1104-W1106 PolarHBondContact O-N 3.15Å; W1106-D1110 HydrophobicContact CB-CB 4.49Å; W1106-D1110 HydrophobicContact CE3-CB 4.4Å; W1106-L1111 HydrophobicContact CB-CD1 4.43Å; W1106-A1114 HydrophobicContact CH2-CB 4.43Å; W1106-A1114 HydrophobicContact CZ3-CB 3.63Å; W1106-R1176 PolarHBondContact O-NH1 3.3Å
1107	S	83.4	Confident	71.7	Confident	53 Å²	53	68.8 Å²	68.8	37%	0.371	41%	0.412	S	S	.	.			trans	-74.6	159.4	172.6	83.6	0	0	0	0	111.2	A1109 D1110 L1111	S1107-A1109 PolarHBondContact O-N 3.43Å; S1107-A1109 PolarHBondContact OG-N 3.27Å; S1107-D1110 WeakPolarHBondContact CB-OD2 3.44Å; S1107-D1110 PolarHBondContact N-OD2 2.91Å; S1107-D1110 PolarHBondContact O-N 3.3Å; S1107-D1110 VanDerWaalsContact O-N 3.16Å; S1107-D1110 PolarHBondContact OG-N 2.95Å; S1107-D1110 VanDerWaalsContact OG-N 3.17Å; S1107-D1110 PolarHBondContact OG-OD2 3.38Å; S1107-L1111 WeakPolarHBondContact O-CB 3.4Å; S1107-L1111 PolarHBondContact O-N 3.39Å
1108	T	83	Confident	74.4	Confident	67 Å²	67	65.3 Å²	65.3	41%	0.411	38%	0.38	S	S	.	.	H	α-helix	trans	-64.6	-19.9	175.5	63.1	0	0	0	0	112.7	K1112	T1108-K1112 WeakPolarHBondContact O-CB 3.35Å; T1108-K1112 WeakPolarHBondContact O-CD 3.33Å; T1108-K1112 WeakPolarHBondContact O-CG 3.11Å; T1108-K1112 PolarHBondContact O-N 3.23Å; T1108-K1112 VanDerWaalsContact O-N 3.14Å
1109	A	86	Confident	76.8	Confident	54 Å²	54	66.5 Å²	66.5	45%	0.446	38%	0.379	S	S	.	.	H	α-helix	trans	-75.6	-42.7	173	0	0	0	0	0	111.9	S1107 K1112 T1113	S1107-A1109 PolarHBondContact O-N 3.43Å; S1107-A1109 PolarHBondContact OG-N 3.27Å; A1109-K1112 PolarHBondContact O-N 2.72Å; A1109-T1113 WeakPolarHBondContact O-CB 3.33Å; A1109-T1113 PolarHBondContact O-N 2.87Å; A1109-T1113 PolarHBondContact O-OG1 3.19Å
1110	D	87.1	Confident	79.3	Confident	83 Å²	83	68.4 Å²	68.4	44%	0.444	38%	0.381	S	S	.	.	H	α-helix	trans	-64.3	-45.3	176	-52.8	-47.8	0	0	0	110.3	W1106 S1107 K1112 T1113 A1114	W1106-D1110 HydrophobicContact CB-CB 4.49Å; W1106-D1110 HydrophobicContact CE3-CB 4.4Å; S1107-D1110 WeakPolarHBondContact CB-OD2 3.44Å; S1107-D1110 PolarHBondContact N-OD2 2.91Å; S1107-D1110 PolarHBondContact O-N 3.3Å; S1107-D1110 VanDerWaalsContact O-N 3.16Å; S1107-D1110 PolarHBondContact OG-N 2.95Å; S1107-D1110 VanDerWaalsContact OG-N 3.17Å; S1107-D1110 PolarHBondContact OG-OD2 3.38Å; D1110-K1112 PolarHBondContact O-N 2.84Å; D1110-T1113 CarbonylContact O-C 3.56Å; D1110-T1113 WeakPolarHBondContact O-CA 3.43Å; D1110-T1113 WeakPolarHBondContact O-CB 3.38Å; D1110-T1113 PolarHBondContact O-N 2.87Å; D1110-A1114 PolarHBondContact O-N 2.89Å
1111	L	86.2	Confident	81	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-60.3	-42.8	177.2	-125.8	150.5	0	0	0	112	W1106 S1107 T1113 L1115 L1169 E1172 L1173	W1106-L1111 HydrophobicContact CB-CD1 4.43Å; S1107-L1111 WeakPolarHBondContact O-CB 3.4Å; S1107-L1111 PolarHBondContact O-N 3.39Å; L1111-T1113 VanDerWaalsContact C-N 3.27Å; L1111-T1113 PolarHBondContact O-N 2.92Å; L1111-L1115 HydrophobicContact CD2-CD1 4.34Å; L1111-L1115 VanDerWaalsContact O-CB 3.26Å; L1111-L1115 WeakPolarHBondContact O-CB 3.47Å; L1111-L1115 WeakPolarHBondContact O-CD1 3.38Å; L1111-L1115 VanDerWaalsContact O-CG 3.24Å; L1111-L1115 WeakPolarHBondContact O-CG 3.5Å; L1111-L1115 PolarHBondContact O-N 2.93Å; L1111-L1169 HydrophobicContact CD2-CB 3.98Å; L1111-L1169 HydrophobicContact CD2-CD2 3.56Å; L1111-L1169 HydrophobicContact CD2-CG 4.38Å; L1111-L1169 WeakPolarHBondContact CD2-O 3.46Å; L1111-L1169 HydrophobicContact CG-CD2 3.91Å; L1111-E1172 HydrophobicContact CD1-CB 4.33Å; L1111-E1172 HydrophobicContact CD1-CG 3.57Å; L1111-E1172 HydrophobicContact CD2-CB 4.24Å; L1111-E1172 HydrophobicContact CD2-CG 4.37Å; L1111-L1173 HydrophobicContact CB-CD1 4.06Å; L1111-L1173 HydrophobicContact CD2-CB 4.05Å; L1111-L1173 HydrophobicContact CD2-CD1 4.13Å
1112	K	87.9	Confident	82.9	Confident	106 Å²	106	64.3 Å²	64.3	46%	0.461	35%	0.345	S	S	.	.	H	α-helix	trans	-66.9	-23.5	171.5	-76.5	169.7	-175.3	172.3	0	113.5	T1108 A1109 D1110 R1116 L1173	T1108-K1112 WeakPolarHBondContact O-CB 3.35Å; T1108-K1112 WeakPolarHBondContact O-CD 3.33Å; T1108-K1112 WeakPolarHBondContact O-CG 3.11Å; T1108-K1112 PolarHBondContact O-N 3.23Å; T1108-K1112 VanDerWaalsContact O-N 3.14Å; A1109-K1112 PolarHBondContact O-N 2.72Å; D1110-K1112 PolarHBondContact O-N 2.84Å; K1112-R1116 WeakPolarHBondContact O-CG 3.42Å; K1112-R1116 PolarHBondContact O-N 3.37Å; K1112-R1116 PolarHBondContact O-NE 2.98Å; K1112-L1173 HydrophobicContact CG-CD1 4Å; K1112-L1173 HydrophobicContact CG-CD2 4.29Å
1113	T	88.6	Confident	84.3	Confident	62 Å²	62	67.6 Å²	67.6	38%	0.38	35%	0.351	S	S	.	.	H	α-helix	trans	-87.6	-44.7	-178.7	-59.4	0	0	0	0	111.2	A1109 D1110 L1111 L1115 R1116 T1117	A1109-T1113 WeakPolarHBondContact O-CB 3.33Å; A1109-T1113 PolarHBondContact O-N 2.87Å; A1109-T1113 PolarHBondContact O-OG1 3.19Å; D1110-T1113 CarbonylContact O-C 3.56Å; D1110-T1113 WeakPolarHBondContact O-CA 3.43Å; D1110-T1113 WeakPolarHBondContact O-CB 3.38Å; D1110-T1113 PolarHBondContact O-N 2.87Å; L1111-T1113 VanDerWaalsContact C-N 3.27Å; L1111-T1113 PolarHBondContact O-N 2.92Å; T1113-L1115 VanDerWaalsContact C-N 3.29Å; T1113-L1115 PolarHBondContact O-N 2.93Å; T1113-R1116 WeakPolarHBondContact O-CA 3.47Å; T1113-R1116 WeakPolarHBondContact O-CB 3.46Å; T1113-R1116 PolarHBondContact O-N 3.49Å; T1113-R1116 PolarHBondContact OG1-NH2 3.46Å; T1113-T1117 PolarHBondContact O-N 3.11Å
1114	A	85.3	Confident	85.6	Confident	16 Å²	16	70.2 Å²	70.2	13%	0.132	36%	0.363	C	S	.	.	H	α-helix	trans	-62	-35.4	169.1	0	0	0	0	0	112.5	W1106 D1110 R1116 T1117 L1118 L1169	W1106-A1114 HydrophobicContact CH2-CB 4.43Å; W1106-A1114 HydrophobicContact CZ3-CB 3.63Å; D1110-A1114 PolarHBondContact O-N 2.89Å; A1114-R1116 PolarHBondContact O-N 3.23Å; A1114-T1117 WeakPolarHBondContact CA-OG1 3.37Å; A1114-T1117 PolarHBondContact O-N 3.33Å; A1114-T1117 PolarHBondContact O-OG1 3.38Å; A1114-L1118 VanDerWaalsContact O-CB 3.27Å; A1114-L1118 WeakPolarHBondContact O-CB 3.4Å; A1114-L1118 VanDerWaalsContact O-CG 3.3Å; A1114-L1118 WeakPolarHBondContact O-CG 3.3Å; A1114-L1118 PolarHBondContact O-N 3.5Å; A1114-L1169 HydrophobicContact CB-CD1 4.24Å
1115	L	88.2	Confident	86.7	Confident	4 Å²	4	67.3 Å²	67.3	2%	0.021	34%	0.341	C	S	.	.	H	α-helix	trans	-62.5	-29.7	169.9	-83.7	169.5	0	0	0	113.1	L1111 T1113 R1119 L1166 L1169 E1170 L1173	L1111-L1115 HydrophobicContact CD2-CD1 4.34Å; L1111-L1115 VanDerWaalsContact O-CB 3.26Å; L1111-L1115 WeakPolarHBondContact O-CB 3.47Å; L1111-L1115 WeakPolarHBondContact O-CD1 3.38Å; L1111-L1115 VanDerWaalsContact O-CG 3.24Å; L1111-L1115 WeakPolarHBondContact O-CG 3.5Å; L1111-L1115 PolarHBondContact O-N 2.93Å; T1113-L1115 VanDerWaalsContact C-N 3.29Å; T1113-L1115 PolarHBondContact O-N 2.93Å; L1115-R1119 VanDerWaalsContact O-CB 3.23Å; L1115-R1119 WeakPolarHBondContact O-CB 3.34Å; L1115-R1119 WeakPolarHBondContact O-CD 3.19Å; L1115-R1119 WeakPolarHBondContact O-CG 3.49Å; L1115-R1119 PolarHBondContact O-N 3.18Å; L1115-L1166 HydrophobicContact CD2-CD2 3.9Å; L1115-L1169 HydrophobicContact CD2-CB 3.74Å; L1115-L1169 HydrophobicContact CG-CB 3.93Å; L1115-E1170 HydrophobicContact CD2-CG 3.55Å; L1115-L1173 HydrophobicContact CD1-CB 4.08Å; L1115-L1173 HydrophobicContact CD1-CD2 3.78Å; L1115-L1173 HydrophobicContact CD1-CG 4.36Å
1116	R	88.8	Confident	87.6	Confident	153 Å²	153	67.7 Å²	67.7	58%	0.577	33%	0.332	S	S	*	.	H	α-helix	trans	-73.9	-53.8	173.1	-77.5	175.3	-82.7	172.6	-1.1	110.7	K1112 T1113 A1114 L1118 R1119 E1120	K1112-R1116 WeakPolarHBondContact O-CG 3.42Å; K1112-R1116 PolarHBondContact O-N 3.37Å; K1112-R1116 PolarHBondContact O-NE 2.98Å; T1113-R1116 WeakPolarHBondContact O-CA 3.47Å; T1113-R1116 WeakPolarHBondContact O-CB 3.46Å; T1113-R1116 PolarHBondContact O-N 3.49Å; T1113-R1116 PolarHBondContact OG1-NH2 3.46Å; A1114-R1116 PolarHBondContact O-N 3.23Å; R1116-L1118 PolarHBondContact O-N 2.91Å; R1116-R1119 PolarHBondContact O-N 3.12Å; R1116-R1119 VanDerWaalsContact O-N 3.17Å; R1116-E1120 PolarHBondContact O-N 3.19Å
1117	T	88	Confident	88.2	Confident	76 Å²	76	70 Å²	70	47%	0.466	34%	0.344	S	S	.	.	H	α-helix	trans	-60.3	-46.8	-177.6	58.2	0	0	0	0	112.3	T1113 A1114 R1119 E1120 S1121	T1113-T1117 PolarHBondContact O-N 3.11Å; A1114-T1117 WeakPolarHBondContact CA-OG1 3.37Å; A1114-T1117 PolarHBondContact O-N 3.33Å; A1114-T1117 PolarHBondContact O-OG1 3.38Å; T1117-R1119 VanDerWaalsContact C-N 3.33Å; T1117-R1119 PolarHBondContact O-N 2.91Å; T1117-E1120 WeakPolarHBondContact O-CA 3.46Å; T1117-E1120 VanDerWaalsContact O-CB 3.28Å; T1117-E1120 WeakPolarHBondContact O-CB 3.26Å; T1117-E1120 PolarHBondContact O-N 3.29Å; T1117-S1121 PolarHBondContact O-N 3.23Å; T1117-S1121 PolarHBondContact O-OG 2.75Å
1118	L	89.3	Confident	88.6	Confident	27 Å²	27	68.5 Å²	68.5	14%	0.141	33%	0.333	C	S	.	.	H	α-helix	trans	-67.5	-30.6	178.3	-65.3	167.5	0	0	0	112.6	A1114 R1116 E1120 K1122 L1162 R1165 L1166 L1169	A1114-L1118 VanDerWaalsContact O-CB 3.27Å; A1114-L1118 WeakPolarHBondContact O-CB 3.4Å; A1114-L1118 VanDerWaalsContact O-CG 3.3Å; A1114-L1118 WeakPolarHBondContact O-CG 3.3Å; A1114-L1118 PolarHBondContact O-N 3.5Å; R1116-L1118 PolarHBondContact O-N 2.91Å; L1118-E1120 VanDerWaalsContact C-N 3.31Å; L1118-K1122 VanDerWaalsContact O-CB 3.23Å; L1118-K1122 WeakPolarHBondContact O-CB 3.15Å; L1118-K1122 PolarHBondContact O-N 3.42Å; L1118-L1162 HydrophobicContact CB-CD2 3.88Å; L1118-L1162 HydrophobicContact CD2-CD2 3.56Å; L1118-L1162 HydrophobicContact CG-CD2 4.33Å; L1118-L1162 WeakPolarHBondContact O-CD2 3.1Å; L1118-R1165 HydrophobicContact CD1-CG 4.28Å; L1118-L1166 HydrophobicContact CB-CD1 4.46Å; L1118-L1166 HydrophobicContact CB-CD2 3.54Å; L1118-L1166 HydrophobicContact CB-CG 3.84Å; L1118-L1169 HydrophobicContact CD1-CD1 3.35Å
1119	R	90.8	Very high	88.9	Confident	107 Å²	107	65.9 Å²	65.9	40%	0.404	32%	0.316	S	S	.	.	H	α-helix	trans	-66.9	-34.6	170.9	-79.3	172.5	-177.7	160.7	-2.7	111.1	L1115 R1116 T1117 R1123 L1166 E1170	L1115-R1119 VanDerWaalsContact O-CB 3.23Å; L1115-R1119 WeakPolarHBondContact O-CB 3.34Å; L1115-R1119 WeakPolarHBondContact O-CD 3.19Å; L1115-R1119 WeakPolarHBondContact O-CG 3.49Å; L1115-R1119 PolarHBondContact O-N 3.18Å; R1116-R1119 PolarHBondContact O-N 3.12Å; R1116-R1119 VanDerWaalsContact O-N 3.17Å; T1117-R1119 VanDerWaalsContact C-N 3.33Å; T1117-R1119 PolarHBondContact O-N 2.91Å; R1119-R1123 VanDerWaalsContact O-CG 3.27Å; R1119-R1123 WeakPolarHBondContact O-CG 3.18Å; R1119-R1123 PolarHBondContact O-N 2.92Å; R1119-L1166 HydrophobicContact CG-CD1 4.33Å; R1119-L1166 HydrophobicContact CG-CD2 3.81Å; R1119-E1170 IonicContact CZ-OE1 3.06Å; R1119-E1170 IonicContact NE-OE1 3.32Å; R1119-E1170 PolarHBondContact NE-OE1 3.44Å; R1119-E1170 IonicContact NH2-OE1 2.91Å; R1119-E1170 PolarHBondContact NH2-OE1 3.49Å
1120	E	90.3	Very high	89.1	Confident	103 Å²	103	69.9 Å²	69.9	48%	0.481	32%	0.324	S	S	.	.	H	α-helix	trans	-67.6	-52	173.8	-136.1	60.3	-100.8	0	0	111.9	R1116 T1117 L1118 K1122 R1123 Q1124	R1116-E1120 PolarHBondContact O-N 3.19Å; T1117-E1120 WeakPolarHBondContact O-CA 3.46Å; T1117-E1120 VanDerWaalsContact O-CB 3.28Å; T1117-E1120 WeakPolarHBondContact O-CB 3.26Å; T1117-E1120 PolarHBondContact O-N 3.29Å; L1118-E1120 VanDerWaalsContact C-N 3.31Å; E1120-K1122 VanDerWaalsContact C-N 3.27Å; E1120-K1122 PolarHBondContact O-N 3.41Å; E1120-R1123 WeakPolarHBondContact O-CA 3.25Å; E1120-R1123 WeakPolarHBondContact O-CB 3.45Å; E1120-R1123 PolarHBondContact O-N 2.95Å; E1120-R1123 WeakPolarHBondContact OE1-CD 3.16Å; E1120-R1123 IonicContact OE1-CZ 2.94Å; E1120-R1123 IonicContact OE1-NE 3.63Å; E1120-R1123 IonicContact OE1-NH1 2.91Å; E1120-R1123 PolarHBondContact OE1-NH1 3.27Å; E1120-R1123 IonicContact OE2-NH1 3.29Å; E1120-R1123 PolarHBondContact OE2-NH1 3.35Å; E1120-Q1124 PolarHBondContact O-N 2.94Å
1121	S	84.8	Confident	89.3	Confident	29 Å²	29	68.6 Å²	68.6	20%	0.203	32%	0.317	C	S	.	.	H	α-helix	trans	-58.3	-39.4	176.2	-50	0	0	0	0	112.1	T1117 Q1124 L1125	T1117-S1121 PolarHBondContact O-N 3.23Å; T1117-S1121 PolarHBondContact O-OG 2.75Å; S1121-Q1124 PolarHBondContact O-N 3.43Å; S1121-L1125 PolarHBondContact O-N 2.93Å
1122	K	91.7	Very high	89.4	Confident	59 Å²	59	69.7 Å²	69.7	26%	0.257	32%	0.321	S	S	.	.	H	α-helix	trans	-63.5	-40.6	173.3	176.9	-178.2	160.9	-167.4	0	112.5	L1118 E1120 Q1124 Q1126 Y1159 L1162 L1166	L1118-K1122 VanDerWaalsContact O-CB 3.23Å; L1118-K1122 WeakPolarHBondContact O-CB 3.15Å; L1118-K1122 PolarHBondContact O-N 3.42Å; E1120-K1122 VanDerWaalsContact C-N 3.27Å; E1120-K1122 PolarHBondContact O-N 3.41Å; K1122-Q1124 VanDerWaalsContact C-N 3.35Å; K1122-Q1126 WeakPolarHBondContact O-CB 3.33Å; K1122-Q1126 PolarHBondContact O-N 3.01Å; K1122-Y1159 HydrophobicContact CG-CD2 4.25Å; K1122-Y1159 HydrophobicContact CG-CE2 3.74Å; K1122-L1162 HydrophobicContact CB-CD2 4.42Å; K1122-L1166 HydrophobicContact CB-CD1 3.83Å; K1122-L1166 HydrophobicContact CD-CD1 3.32Å; K1122-L1166 HydrophobicContact CG-CD1 4.19Å
1123	R	90.8	Very high	89.4	Confident	153 Å²	153	67.5 Å²	67.5	58%	0.577	31%	0.313	S	S	*	.	H	α-helix	trans	-62	-44.2	174.7	-75.9	161.5	173.4	171.5	0.5	110.6	R1119 E1120 Q1126 K1127	R1119-R1123 VanDerWaalsContact O-CG 3.27Å; R1119-R1123 WeakPolarHBondContact O-CG 3.18Å; R1119-R1123 PolarHBondContact O-N 2.92Å; E1120-R1123 WeakPolarHBondContact O-CA 3.25Å; E1120-R1123 WeakPolarHBondContact O-CB 3.45Å; E1120-R1123 PolarHBondContact O-N 2.95Å; E1120-R1123 WeakPolarHBondContact OE1-CD 3.16Å; E1120-R1123 IonicContact OE1-CZ 2.94Å; E1120-R1123 IonicContact OE1-NE 3.63Å; E1120-R1123 IonicContact OE1-NH1 2.91Å; E1120-R1123 PolarHBondContact OE1-NH1 3.27Å; E1120-R1123 IonicContact OE2-NH1 3.29Å; E1120-R1123 PolarHBondContact OE2-NH1 3.35Å; R1123-Q1126 PolarHBondContact O-N 2.64Å; R1123-K1127 WeakPolarHBondContact O-CB 3.17Å; R1123-K1127 PolarHBondContact O-N 2.98Å
1124	Q	91	Very high	89.4	Confident	82 Å²	82	69.9 Å²	69.9	38%	0.383	32%	0.32	S	S	.	.	H	α-helix	trans	-63.1	-51.3	-179.8	-172	68.2	-8.8	0	0	111.6	E1120 S1121 K1122 Q1126 K1127 T1128	E1120-Q1124 PolarHBondContact O-N 2.94Å; S1121-Q1124 PolarHBondContact O-N 3.43Å; K1122-Q1124 VanDerWaalsContact C-N 3.35Å; Q1124-Q1126 VanDerWaalsContact C-N 3.34Å; Q1124-Q1126 PolarHBondContact O-N 2.88Å; Q1124-K1127 WeakPolarHBondContact O-CA 3.37Å; Q1124-K1127 WeakPolarHBondContact O-CB 3.32Å; Q1124-K1127 PolarHBondContact O-N 3.42Å; Q1124-K1127 VanDerWaalsContact O-N 3.08Å; Q1124-T1128 PolarHBondContact O-N 2.83Å; Q1124-T1128 PolarHBondContact O-OG1 2.93Å
1125	L	89.4	Confident	89.4	Confident	16 Å²	16	71.4 Å²	71.4	8%	0.084	32%	0.324	C	S	.	.	H	α-helix	trans	-64.4	-36.6	175.7	-103.3	65.1	0	0	0	112.9	S1121 K1127 T1128 L1129 E1158 Y1159 L1162	S1121-L1125 PolarHBondContact O-N 2.93Å; L1125-K1127 PolarHBondContact O-N 3.09Å; L1125-T1128 PolarHBondContact O-N 2.91Å; L1125-L1129 WeakPolarHBondContact O-CB 3.29Å; L1125-L1129 WeakPolarHBondContact O-CG 3.39Å; L1125-L1129 PolarHBondContact O-N 3.36Å; L1125-E1158 HydrophobicContact CD2-CB 3.43Å; L1125-E1158 VanDerWaalsContact CD2-CB 3.43Å; L1125-Y1159 HydrophobicContact CB-CD2 4.37Å; L1125-L1162 HydrophobicContact CD2-CD1 4.37Å
1126	Q	90.7	Very high	89.3	Confident	101 Å²	101	72.3 Å²	72.3	47%	0.472	33%	0.328	S	S	.	.	H	α-helix	trans	-64.8	-29.7	174.3	-172	173	-2.3	0	0	112.1	K1122 R1123 Q1124 K1130 Y1159	K1122-Q1126 WeakPolarHBondContact O-CB 3.33Å; K1122-Q1126 PolarHBondContact O-N 3.01Å; R1123-Q1126 PolarHBondContact O-N 2.64Å; Q1124-Q1126 VanDerWaalsContact C-N 3.34Å; Q1124-Q1126 PolarHBondContact O-N 2.88Å; Q1126-K1130 VanDerWaalsContact O-CB 3.25Å; Q1126-K1130 WeakPolarHBondContact O-CB 3.37Å; Q1126-K1130 PolarHBondContact O-N 3.08Å; Q1126-Y1159 HydrophobicContact CB-CD2 4.48Å; Q1126-Y1159 HydrophobicContact CB-CE2 3.91Å; Q1126-Y1159 HydrophobicContact CG-CE2 4.38Å
1127	K	92.1	Very high	89.1	Confident	119 Å²	119	68.9 Å²	68.9	52%	0.517	32%	0.32	S	S	.	.	H	α-helix	trans	-69.8	-55.6	170.1	-175.3	-174.7	172.9	-168.9	0	110.3	R1123 Q1124 L1125 L1129 K1130 D1131	R1123-K1127 WeakPolarHBondContact O-CB 3.17Å; R1123-K1127 PolarHBondContact O-N 2.98Å; Q1124-K1127 WeakPolarHBondContact O-CA 3.37Å; Q1124-K1127 WeakPolarHBondContact O-CB 3.32Å; Q1124-K1127 PolarHBondContact O-N 3.42Å; Q1124-K1127 VanDerWaalsContact O-N 3.08Å; L1125-K1127 PolarHBondContact O-N 3.09Å; K1127-L1129 VanDerWaalsContact C-N 3.32Å; K1127-L1129 PolarHBondContact O-N 2.94Å; K1127-K1130 CarbonylContact O-C 3.55Å; K1127-K1130 WeakPolarHBondContact O-CA 3.13Å; K1127-K1130 PolarHBondContact O-N 3.43Å; K1127-D1131 VanDerWaalsContact CE-OD2 3.3Å; K1127-D1131 WeakPolarHBondContact CE-OD2 3.16Å; K1127-D1131 WeakPolarHBondContact CG-OD2 3.3Å; K1127-D1131 PolarHBondContact O-N 3.43Å
1128	T	89.8	Confident	88.9	Confident	21 Å²	21	71.5 Å²	71.5	13%	0.129	33%	0.327	C	S	.	.	H	α-helix	trans	-51.8	-47.4	179.5	-52.4	0	0	0	0	112.6	L1075 Q1124 L1125 K1130 D1131 F1132 M1152	L1075-T1128 HydrophobicContact CD1-CG2 4.4Å; Q1124-T1128 PolarHBondContact O-N 2.83Å; Q1124-T1128 PolarHBondContact O-OG1 2.93Å; L1125-T1128 PolarHBondContact O-N 2.91Å; T1128-K1130 VanDerWaalsContact C-N 3.32Å; T1128-K1130 PolarHBondContact O-N 2.97Å; T1128-D1131 PolarHBondContact O-N 3.06Å; T1128-F1132 PolarHBondContact O-N 2.86Å; T1128-M1152 HydrophobicContact CG2-CE 4.02Å
1129	L	90.8	Very high	88.6	Confident	12 Å²	12	75.4 Å²	75.4	6%	0.063	35%	0.348	C	S	.	.	H	α-helix	trans	-66.6	-30.5	178.5	-69.5	173.1	0	0	0	113.3	L1125 K1127 E1133 M1152 E1155 Y1156 Y1159	L1125-L1129 WeakPolarHBondContact O-CB 3.29Å; L1125-L1129 WeakPolarHBondContact O-CG 3.39Å; L1125-L1129 PolarHBondContact O-N 3.36Å; K1127-L1129 VanDerWaalsContact C-N 3.32Å; K1127-L1129 PolarHBondContact O-N 2.94Å; L1129-E1133 PolarHBondContact O-N 3.39Å; L1129-M1152 HydrophobicContact CD2-CB 4.23Å; L1129-M1152 HydrophobicContact CD2-CE 4.41Å; L1129-E1155 HydrophobicContact CD2-CB 3.82Å; L1129-E1155 HydrophobicContact CG-CB 4.38Å; L1129-Y1156 HydrophobicContact CD1-CD1 3.8Å; L1129-Y1156 HydrophobicContact CD1-CE1 3.97Å; L1129-Y1156 HydrophobicContact CD1-CG 4.38Å; L1129-Y1156 HydrophobicContact CD2-CD1 3.96Å; L1129-Y1156 HydrophobicContact CD2-CD2 3.83Å; L1129-Y1156 HydrophobicContact CD2-CE1 3.96Å; L1129-Y1156 HydrophobicContact CD2-CE2 3.84Å; L1129-Y1156 HydrophobicContact CD2-CG 3.88Å; L1129-Y1156 HydrophobicContact CG-CD1 4.5Å; L1129-Y1156 HydrophobicContact CG-CE1 4.43Å; L1129-Y1159 HydrophobicContact CD1-CD1 4.29Å; L1129-Y1159 HydrophobicContact CD1-CG 3.98Å
1130	K	90.5	Very high	88.1	Confident	139 Å²	139	73.1 Å²	73.1	60%	0.604	35%	0.346	S	S	*	.	H	α-helix	trans	-80	-37.8	177.3	-171.9	-165.5	172.1	-147.9	0	111.8	Q1126 K1127 T1128 F1132 E1133 H1134	Q1126-K1130 VanDerWaalsContact O-CB 3.25Å; Q1126-K1130 WeakPolarHBondContact O-CB 3.37Å; Q1126-K1130 PolarHBondContact O-N 3.08Å; K1127-K1130 CarbonylContact O-C 3.55Å; K1127-K1130 WeakPolarHBondContact O-CA 3.13Å; K1127-K1130 PolarHBondContact O-N 3.43Å; T1128-K1130 VanDerWaalsContact C-N 3.32Å; T1128-K1130 PolarHBondContact O-N 2.97Å; K1130-F1132 VanDerWaalsContact C-N 3.26Å; K1130-F1132 PolarHBondContact O-N 3.28Å; K1130-E1133 PolarHBondContact O-N 3.18Å; K1130-H1134 WeakPolarHBondContact O-CB 3.48Å; K1130-H1134 PolarHBondContact O-N 3.1Å
1131	D	89.8	Confident	87.7	Confident	56 Å²	56	71.4 Å²	71.4	30%	0.299	36%	0.356	S	S	.	.	H	α-helix	trans	-66.1	-33.4	175.2	-65.4	-5.7	0	0	0	109.8	K1127 T1128 E1135	K1127-D1131 VanDerWaalsContact CE-OD2 3.3Å; K1127-D1131 WeakPolarHBondContact CE-OD2 3.16Å; K1127-D1131 WeakPolarHBondContact CG-OD2 3.3Å; K1127-D1131 PolarHBondContact O-N 3.43Å; T1128-D1131 PolarHBondContact O-N 3.06Å; D1131-E1135 PolarHBondContact O-N 3.07Å
1132	F	90	Very high	87.3	Confident	22 Å²	22	76.3 Å²	76.3	10%	0.096	38%	0.376	C	S	.	.	H	α-helix	trans	-68.2	-48.8	166	175.5	-94.9	0	0	0	113.6	T1128 K1130 H1134 E1135 F1136 V1144 C1151 M1152	T1128-F1132 PolarHBondContact O-N 2.86Å; K1130-F1132 VanDerWaalsContact C-N 3.26Å; K1130-F1132 PolarHBondContact O-N 3.28Å; F1132-H1134 PolarHBondContact O-N 2.69Å; F1132-H1134 VanDerWaalsContact O-N 3.11Å; F1132-E1135 PolarHBondContact O-N 2.99Å; F1132-F1136 HydrophobicContact CZ-CB 4.5Å; F1132-F1136 HydrophobicContact CZ-CD2 4.19Å; F1132-F1136 WeakPolarHBondContact O-CB 3.42Å; F1132-F1136 PolarHBondContact O-N 2.73Å; F1132-V1144 HydrophobicContact CE1-CG1 3.88Å; F1132-V1144 HydrophobicContact CE1-CG2 4.09Å; F1132-C1151 VanDerWaalsContact CE2-SG 3.57Å; F1132-C1151 WeakPolarHBondContact CZ-SG 3.41Å; F1132-M1152 HydrophobicContact CB-CE 4.35Å; F1132-M1152 HydrophobicContact CB-CG 4.25Å; F1132-M1152 HydrophobicContact CB-SD 4.41Å; F1132-M1152 HydrophobicContact CD1-CG 3.6Å; F1132-M1152 HydrophobicContact CD2-CG 3.57Å; F1132-M1152 HydrophobicContact CD2-SD 3.78Å; F1132-M1152 HydrophobicContact CE1-CG 3.75Å; F1132-M1152 HydrophobicContact CE2-CG 3.73Å; F1132-M1152 HydrophobicContact CE2-SD 4.25Å; F1132-M1152 HydrophobicContact CG-CG 3.5Å; F1132-M1152 HydrophobicContact CG-SD 4.04Å; F1132-M1152 HydrophobicContact CZ-CG 3.82Å
1133	E	87.2	Confident	86.8	Confident	60 Å²	60	78.4 Å²	78.4	28%	0.28	39%	0.385	S	S	.	.	H	α-helix	trans	-54.3	-31.3	174.1	-83.8	-171.5	171	0	0	110.8	K8 L1129 K1130 I1137 V1144	K8-E1133 IonicContact NZ-OE1 3.74Å; K8-E1133 PolarHBondContact NZ-OE1 3.33Å; K8-E1133 VanDerWaalsContact NZ-OE1 3.09Å; L1129-E1133 PolarHBondContact O-N 3.39Å; K1130-E1133 PolarHBondContact O-N 3.18Å; E1133-I1137 VanDerWaalsContact O-CD1 3.23Å; E1133-I1137 WeakPolarHBondContact O-CD1 3.5Å; E1133-I1137 WeakPolarHBondContact O-CG1 3.48Å; E1133-V1144 HydrophobicContact CG-CG2 4.29Å
1134	H	87.6	Confident	86.5	Confident	113 Å²	113	71.6 Å²	71.6	52%	0.523	36%	0.36	S	S	.	.	H	α-helix	trans	-78.5	-51.5	177.6	-161.8	-86.8	0	0	0	113.7	K1130 F1132 F1136 I1137 Q1138	K1130-H1134 WeakPolarHBondContact O-CB 3.48Å; K1130-H1134 PolarHBondContact O-N 3.1Å; F1132-H1134 PolarHBondContact O-N 2.69Å; F1132-H1134 VanDerWaalsContact O-N 3.11Å; H1134-F1136 VanDerWaalsContact C-N 3.3Å; H1134-F1136 PolarHBondContact O-N 3.49Å; H1134-I1137 PolarHBondContact O-N 3.05Å; H1134-Q1138 VanDerWaalsContact CE1-CD 3.42Å; H1134-Q1138 PolarHBondContact CE1-OE1 3.19Å; H1134-Q1138 VanDerWaalsContact CE1-OE1 3.3Å; H1134-Q1138 VanDerWaalsContact ND1-CD 3.34Å; H1134-Q1138 PolarHBondContact ND1-OE1 3.39Å; H1134-Q1138 WeakPolarHBondContact O-CG 3.25Å; H1134-Q1138 PolarHBondContact O-N 3.31Å
1135	E	85.8	Confident	86	Confident	48 Å²	48	73.3 Å²	73.3	22%	0.224	37%	0.368	C	S	.	.	H	α-helix	trans	-60	-39.3	177.4	-89.5	176.2	-176.8	0	0	112.4	L1067 R1071 D1131 F1132 Q1138 N1139	L1067-E1135 WeakPolarHBondContact CD2-OE2 3.27Å; R1071-E1135 IonicContact CZ-OE1 3.26Å; R1071-E1135 VanDerWaalsContact CZ-OE1 3.26Å; R1071-E1135 IonicContact CZ-OE2 3.25Å; R1071-E1135 VanDerWaalsContact CZ-OE2 3.25Å; R1071-E1135 VanDerWaalsContact NH1-CD 3.26Å; R1071-E1135 IonicContact NH1-OE1 3.94Å; R1071-E1135 PolarHBondContact NH1-OE1 2.96Å; R1071-E1135 IonicContact NH1-OE2 2.76Å; R1071-E1135 PolarHBondContact NH1-OE2 3.1Å; R1071-E1135 VanDerWaalsContact NH2-CD 3.28Å; R1071-E1135 IonicContact NH2-OE1 2.94Å; R1071-E1135 PolarHBondContact NH2-OE1 3.46Å; R1071-E1135 IonicContact NH2-OE2 2.69Å; R1071-E1135 PolarHBondContact NH2-OE2 3.13Å; D1131-E1135 PolarHBondContact O-N 3.07Å; F1132-E1135 PolarHBondContact O-N 2.99Å; E1135-Q1138 PolarHBondContact O-N 2.7Å; E1135-N1139 VanDerWaalsContact O-CB 3.27Å; E1135-N1139 WeakPolarHBondContact O-CB 3.34Å; E1135-N1139 PolarHBondContact O-N 2.9Å; E1135-N1139 PolarHBondContact O-ND2 2.99Å
1136	F	86.9	Confident	85.3	Confident	23 Å²	23	81.7 Å²	81.7	10%	0.101	40%	0.399	C	S	.	.	H	α-helix	trans	-61.1	-48.4	176.7	-173.2	-83.8	0	0	0	111.1	F1132 H1134 Q1138 N1139 T1140 Q1142 V1144 D1148	F1132-F1136 HydrophobicContact CZ-CB 4.5Å; F1132-F1136 HydrophobicContact CZ-CD2 4.19Å; F1132-F1136 WeakPolarHBondContact O-CB 3.42Å; F1132-F1136 PolarHBondContact O-N 2.73Å; H1134-F1136 VanDerWaalsContact C-N 3.3Å; H1134-F1136 PolarHBondContact O-N 3.49Å; F1136-Q1138 VanDerWaalsContact C-N 3.29Å; F1136-Q1138 PolarHBondContact O-N 3.01Å; F1136-N1139 PolarHBondContact O-N 3.24Å; F1136-T1140 HydrophobicContact CD1-CG2 4.28Å; F1136-T1140 WeakPolarHBondContact CD1-OG1 3.2Å; F1136-T1140 HydrophobicContact CD2-CG2 4.23Å; F1136-T1140 HydrophobicContact CE1-CG2 3.99Å; F1136-T1140 WeakPolarHBondContact CE1-OG1 3.41Å; F1136-T1140 HydrophobicContact CE2-CG2 3.92Å; F1136-T1140 HydrophobicContact CG-CG2 4.4Å; F1136-T1140 HydrophobicContact CZ-CG2 3.79Å; F1136-T1140 PolarHBondContact O-N 3.23Å; F1136-T1140 PolarHBondContact O-OG1 3.35Å; F1136-Q1142 HydrophobicContact CE1-CB 4.39Å; F1136-V1144 HydrophobicContact CB-CG2 3.7Å; F1136-V1144 HydrophobicContact CD1-CB 4.32Å; F1136-V1144 HydrophobicContact CD1-CG2 3.61Å; F1136-V1144 HydrophobicContact CD2-CG2 4.45Å; F1136-V1144 HydrophobicContact CE1-CG2 4.35Å; F1136-V1144 HydrophobicContact CG-CG2 3.66Å; F1136-D1148 HydrophobicContact CD2-CB 4.45Å; F1136-D1148 HydrophobicContact CE2-CB 3.78Å; F1136-D1148 VanDerWaalsContact CE2-CG 3.41Å; F1136-D1148 WeakPolarHBondContact CE2-OD1 3.03Å; F1136-D1148 HydrophobicContact CZ-CB 3.99Å; F1136-D1148 VanDerWaalsContact CZ-OD1 3.28Å; F1136-D1148 WeakPolarHBondContact CZ-OD1 3.47Å; F1136-D1148 WeakPolarHBondContact CZ-OD2 3.27Å
1137	I	84.4	Confident	84.4	Confident	80 Å²	80	82 Å²	82	41%	0.41	40%	0.4	S	S	.	.	H	α-helix	trans	-62.5	-36.4	177.8	-68.9	168.8	0	0	0	111.4	E1133 H1134 G1141 Q1142	E1133-I1137 VanDerWaalsContact O-CD1 3.23Å; E1133-I1137 WeakPolarHBondContact O-CD1 3.5Å; E1133-I1137 WeakPolarHBondContact O-CG1 3.48Å; H1134-I1137 PolarHBondContact O-N 3.05Å; I1137-G1141 VanDerWaalsContact O-CA 3.28Å; I1137-G1141 WeakPolarHBondContact O-CA 3.14Å; I1137-G1141 PolarHBondContact O-N 3.38Å; I1137-Q1142 WeakPolarHBondContact CA-O 3.36Å; I1137-Q1142 WeakPolarHBondContact CG1-O 3.38Å
1138	Q	84.1	Confident	83.7	Confident	131 Å²	131	78.8 Å²	78.8	61%	0.612	39%	0.388	S	S	*	.	H	α-helix	trans	-69.3	-37.4	175.3	-72.1	-178	-70.4	0	0	113	H1134 E1135 F1136	H1134-Q1138 VanDerWaalsContact CE1-CD 3.42Å; H1134-Q1138 PolarHBondContact CE1-OE1 3.19Å; H1134-Q1138 VanDerWaalsContact CE1-OE1 3.3Å; H1134-Q1138 VanDerWaalsContact ND1-CD 3.34Å; H1134-Q1138 PolarHBondContact ND1-OE1 3.39Å; H1134-Q1138 WeakPolarHBondContact O-CG 3.25Å; H1134-Q1138 PolarHBondContact O-N 3.31Å; E1135-Q1138 PolarHBondContact O-N 2.7Å; F1136-Q1138 VanDerWaalsContact C-N 3.29Å; F1136-Q1138 PolarHBondContact O-N 3.01Å
1139	N	82.3	Confident	83.2	Confident	109 Å²	109	82.1 Å²	82.1	58%	0.583	40%	0.399	S	S	*	.	H	α-helix	trans	-87.5	-28.1	-173.6	-68.9	-19.6	0	0	0	113.9	E1135 F1136	E1135-N1139 VanDerWaalsContact O-CB 3.27Å; E1135-N1139 WeakPolarHBondContact O-CB 3.34Å; E1135-N1139 PolarHBondContact O-N 2.9Å; E1135-N1139 PolarHBondContact O-ND2 2.99Å; F1136-N1139 PolarHBondContact O-N 3.24Å
1140	T	81.1	Confident	82.5	Confident	60 Å²	60	86.8 Å²	86.8	37%	0.368	42%	0.423	S	S	.	.	H	α-helix	trans	-110.9	-18.7	-178.4	70.4	0	0	0	0	113.7	F1136 Q1142	F1136-T1140 HydrophobicContact CD1-CG2 4.28Å; F1136-T1140 WeakPolarHBondContact CD1-OG1 3.2Å; F1136-T1140 HydrophobicContact CD2-CG2 4.23Å; F1136-T1140 HydrophobicContact CE1-CG2 3.99Å; F1136-T1140 WeakPolarHBondContact CE1-OG1 3.41Å; F1136-T1140 HydrophobicContact CE2-CG2 3.92Å; F1136-T1140 HydrophobicContact CG-CG2 4.4Å; F1136-T1140 HydrophobicContact CZ-CG2 3.79Å; F1136-T1140 PolarHBondContact O-N 3.23Å; F1136-T1140 PolarHBondContact O-OG1 3.35Å; T1140-Q1142 PolarHBondContact O-N 3.19Å; T1140-Q1142 VanDerWaalsContact O-N 3.14Å; T1140-Q1142 PolarHBondContact OG1-N 2.88Å; T1140-Q1142 PolarHBondContact OG1-O 3.39Å
1141	G	80.6	Confident	81.8	Confident	67 Å²	67	83 Å²	83	69%	0.691	41%	0.414	S	S	*	.	S	Bend	trans	69	-5.1	-167.4	0	0	0	0	0	114.3	I1137	I1137-G1141 VanDerWaalsContact O-CA 3.28Å; I1137-G1141 WeakPolarHBondContact O-CA 3.14Å; I1137-G1141 PolarHBondContact O-N 3.38Å
1142	Q	76.8	Confident	81.5	Confident	131 Å²	131	81.2 Å²	81.2	61%	0.612	40%	0.404	S	S	*	.	S	Bend	trans	-102.3	166.4	-177.8	-58.5	-173.7	29.8	0	0	110.7	F1136 I1137 T1140	F1136-Q1142 HydrophobicContact CE1-CB 4.39Å; I1137-Q1142 WeakPolarHBondContact CA-O 3.36Å; I1137-Q1142 WeakPolarHBondContact CG1-O 3.38Å; T1140-Q1142 PolarHBondContact O-N 3.19Å; T1140-Q1142 VanDerWaalsContact O-N 3.14Å; T1140-Q1142 PolarHBondContact OG1-N 2.88Å; T1140-Q1142 PolarHBondContact OG1-O 3.39Å
1143	K	82.1	Confident	81.1	Confident	104 Å²	104	88 Å²	88	45%	0.452	43%	0.428	S	S	.	.			trans	-88.9	144.1	171.7	-72.7	-174.1	172.5	-171.9	0	109.9	E4 E1145	E4-K1143 IonicContact OE1-NZ 2.81Å; E4-K1143 PolarHBondContact OE1-NZ 3.44Å; E4-K1143 IonicContact OE2-NZ 2.78Å; E4-K1143 PolarHBondContact OE2-NZ 2.91Å; K1143-E1145 PolarHBondContact O-N 3.31Å
1144	V	83.4	Confident	80.7	Confident	9 Å²	9	88.5 Å²	88.5	6%	0.055	44%	0.439	C	S	.	.			trans	-54.5	108.6	171.9	-170.2	0	0	0	0	109.7	F1132 E1133 F1136 D1148 R1149	F1132-V1144 HydrophobicContact CE1-CG1 3.88Å; F1132-V1144 HydrophobicContact CE1-CG2 4.09Å; E1133-V1144 HydrophobicContact CG-CG2 4.29Å; F1136-V1144 HydrophobicContact CB-CG2 3.7Å; F1136-V1144 HydrophobicContact CD1-CB 4.32Å; F1136-V1144 HydrophobicContact CD1-CG2 3.61Å; F1136-V1144 HydrophobicContact CD2-CG2 4.45Å; F1136-V1144 HydrophobicContact CE1-CG2 4.35Å; F1136-V1144 HydrophobicContact CG-CG2 3.66Å; V1144-D1148 HydrophobicContact CG1-CB 3.66Å; V1144-R1149 HydrophobicContact CG1-CG 3.4Å; V1144-R1149 PolarHBondContact O-NH2 3.24Å
1145	E	79.8	Confident	80.8	Confident	118 Å²	118	84.9 Å²	84.9	55%	0.551	42%	0.422	S	S	*	.			trans	-71.9	-157.9	176.9	-72.9	-79.5	97.6	0	0	110.1	K1143 D1148 R1149	K1143-E1145 PolarHBondContact O-N 3.31Å; E1145-D1148 WeakPolarHBondContact CB-OD2 3.33Å; E1145-D1148 PolarHBondContact N-OD2 3.42Å; E1145-R1149 WeakPolarHBondContact O-CD 3.38Å; E1145-R1149 WeakPolarHBondContact O-CG 3.23Å; E1145-R1149 PolarHBondContact O-NE 2.98Å; E1145-R1149 PolarHBondContact O-NH2 3.09Å
1146	R	74.6	Confident	80.8	Confident	192 Å²	192	85.5 Å²	85.5	73%	0.725	42%	0.423	S	S	*	.	S	Bend	trans	-82.6	-31.1	172.7	173.9	-170.6	-77.2	116	-12	110.7	R1149	R1146-R1149 PolarHBondContact O-N 2.75Å
1147	E	72.8	Confident	80.7	Confident	108 Å²	108	88 Å²	88	51%	0.505	44%	0.442	S	S	.	.	S	Bend	trans	-78.2	-42.4	-170.5	-67.4	55.4	-127.1	0	0	110.3	R1149 L1150	E1147-R1149 PolarHBondContact O-N 2.92Å; E1147-R1149 VanDerWaalsContact O-N 3.15Å; E1147-L1150 WeakPolarHBondContact O-CB 3.39Å; E1147-L1150 WeakPolarHBondContact O-CD1 3.48Å; E1147-L1150 WeakPolarHBondContact O-CG 3.26Å; E1147-L1150 PolarHBondContact O-N 2.8Å
1148	D	77.1	Confident	80.7	Confident	51 Å²	51	88.1 Å²	88.1	27%	0.273	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-56.6	-31.4	172.6	-57.7	-52.8	0	0	0	112.9	F1136 V1144 E1145 L1150 C1151	F1136-D1148 HydrophobicContact CD2-CB 4.45Å; F1136-D1148 HydrophobicContact CE2-CB 3.78Å; F1136-D1148 VanDerWaalsContact CE2-CG 3.41Å; F1136-D1148 WeakPolarHBondContact CE2-OD1 3.03Å; F1136-D1148 HydrophobicContact CZ-CB 3.99Å; F1136-D1148 VanDerWaalsContact CZ-OD1 3.28Å; F1136-D1148 WeakPolarHBondContact CZ-OD1 3.47Å; F1136-D1148 WeakPolarHBondContact CZ-OD2 3.27Å; V1144-D1148 HydrophobicContact CG1-CB 3.66Å; E1145-D1148 WeakPolarHBondContact CB-OD2 3.33Å; E1145-D1148 PolarHBondContact N-OD2 3.42Å; D1148-L1150 PolarHBondContact O-N 3.05Å; D1148-C1151 PolarHBondContact O-N 3.4Å; D1148-C1151 PolarHBondContact O-SG 2.92Å
1149	R	78.7	Confident	81	Confident	92 Å²	92	84.5 Å²	84.5	35%	0.347	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-72.9	-10.1	-179.7	-58.5	-178.3	-159.2	154	15.8	113.1	V1144 E1145 R1146 E1147 C1151 M1152 R1153 Y1156	V1144-R1149 HydrophobicContact CG1-CG 3.4Å; V1144-R1149 PolarHBondContact O-NH2 3.24Å; E1145-R1149 WeakPolarHBondContact O-CD 3.38Å; E1145-R1149 WeakPolarHBondContact O-CG 3.23Å; E1145-R1149 PolarHBondContact O-NE 2.98Å; E1145-R1149 PolarHBondContact O-NH2 3.09Å; R1146-R1149 PolarHBondContact O-N 2.75Å; E1147-R1149 PolarHBondContact O-N 2.92Å; E1147-R1149 VanDerWaalsContact O-N 3.15Å; R1149-C1151 PolarHBondContact O-N 3.41Å; R1149-M1152 CarbonylContact O-C 3.59Å; R1149-M1152 PolarHBondContact O-N 3.44Å; R1149-R1153 PolarHBondContact O-N 3.03Å; R1149-Y1156 HydrophobicContact CB-CD2 4.05Å; R1149-Y1156 HydrophobicContact CB-CE2 3.75Å; R1149-Y1156 HydrophobicContact CG-CD2 4.48Å; R1149-Y1156 HydrophobicContact CG-CE2 3.71Å
1150	L	77.4	Confident	81.2	Confident	110 Å²	110	86.4 Å²	86.4	58%	0.576	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-62.2	-27.9	171.6	-63.6	172.3	0	0	0	111.5	E1147 D1148 R1153	E1147-L1150 WeakPolarHBondContact O-CB 3.39Å; E1147-L1150 WeakPolarHBondContact O-CD1 3.48Å; E1147-L1150 WeakPolarHBondContact O-CG 3.26Å; E1147-L1150 PolarHBondContact O-N 2.8Å; D1148-L1150 PolarHBondContact O-N 3.05Å; L1150-R1153 VanDerWaalsContact O-CB 3.25Å; L1150-R1153 WeakPolarHBondContact O-CB 3.3Å
1151	C	76.1	Confident	81.4	Confident	60 Å²	60	86.5 Å²	86.5	41%	0.405	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-32.2	177.7	81.4	0	0	0	0	112.9	M1068 F1132 D1148 R1149	M1068-C1151 HydrophobicContact CE-CB 3.53Å; M1068-C1151 WeakPolarHBondContact CE-O 3.42Å; M1068-C1151 HydrophobicContact SD-CB 4.47Å; F1132-C1151 VanDerWaalsContact CE2-SG 3.57Å; F1132-C1151 WeakPolarHBondContact CZ-SG 3.41Å; D1148-C1151 PolarHBondContact O-N 3.4Å; D1148-C1151 PolarHBondContact O-SG 2.92Å; R1149-C1151 PolarHBondContact O-N 3.41Å
1152	M	82.5	Confident	81.8	Confident	17 Å²	17	84.2 Å²	84.2	8%	0.084	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	29.8	174.4	-61.4	-60.7	-63.2	0	0	112.6	T1128 L1129 F1132 R1149 S1154 E1155 Y1156	T1128-M1152 HydrophobicContact CG2-CE 4.02Å; L1129-M1152 HydrophobicContact CD2-CB 4.23Å; L1129-M1152 HydrophobicContact CD2-CE 4.41Å; F1132-M1152 HydrophobicContact CB-CE 4.35Å; F1132-M1152 HydrophobicContact CB-CG 4.25Å; F1132-M1152 HydrophobicContact CB-SD 4.41Å; F1132-M1152 HydrophobicContact CD1-CG 3.6Å; F1132-M1152 HydrophobicContact CD2-CG 3.57Å; F1132-M1152 HydrophobicContact CD2-SD 3.78Å; F1132-M1152 HydrophobicContact CE1-CG 3.75Å; F1132-M1152 HydrophobicContact CE2-CG 3.73Å; F1132-M1152 HydrophobicContact CE2-SD 4.25Å; F1132-M1152 HydrophobicContact CG-CG 3.5Å; F1132-M1152 HydrophobicContact CG-SD 4.04Å; F1132-M1152 HydrophobicContact CZ-CG 3.82Å; R1149-M1152 CarbonylContact O-C 3.59Å; R1149-M1152 PolarHBondContact O-N 3.44Å; M1152-S1154 VanDerWaalsContact C-N 3.34Å; M1152-S1154 PolarHBondContact O-N 3.4Å; M1152-E1155 WeakPolarHBondContact CA-OE2 3.47Å; M1152-E1155 HydrophobicContact CE-CB 4.17Å; M1152-E1155 VanDerWaalsContact CE-CD 3.49Å; M1152-E1155 HydrophobicContact CE-CG 3.81Å; M1152-E1155 WeakPolarHBondContact CE-OE1 3.43Å; M1152-Y1156 HydrophobicContact CB-CD2 4.01Å; M1152-Y1156 HydrophobicContact CB-CE2 4.14Å; M1152-Y1156 VanDerWaalsContact O-CD2 3.27Å; M1152-Y1156 WeakPolarHBondContact O-CD2 3.44Å; M1152-Y1156 PolarHBondContact O-N 3.11Å; M1152-Y1156 VanDerWaalsContact O-N 3.07Å
1153	R	81.2	Confident	82.4	Confident	164 Å²	164	82.5 Å²	82.5	62%	0.619	39%	0.394	S	S	*	.	H	α-helix	trans	-67.8	-31.3	-168.8	180	173.3	174.8	175.5	-3.2	113.2	R1149 L1150 C1157	R1149-R1153 PolarHBondContact O-N 3.03Å; L1150-R1153 VanDerWaalsContact O-CB 3.25Å; L1150-R1153 WeakPolarHBondContact O-CB 3.3Å; R1153-C1157 WeakPolarHBondContact O-CB 3.33Å; R1153-C1157 PolarHBondContact O-N 2.7Å; R1153-C1157 VanDerWaalsContact O-N 3.12Å
1154	S	79.2	Confident	82.6	Confident	71 Å²	71	81.2 Å²	81.2	50%	0.497	40%	0.395	S	S	.	.	H	α-helix	trans	-67.6	-53.5	178.6	-157.8	0	0	0	0	109.8	M1152 Y1156 C1157 E1158	M1152-S1154 VanDerWaalsContact C-N 3.34Å; M1152-S1154 PolarHBondContact O-N 3.4Å; S1154-Y1156 VanDerWaalsContact C-N 3.29Å; S1154-Y1156 PolarHBondContact O-N 2.8Å; S1154-C1157 CarbonylContact O-C 3.55Å; S1154-C1157 WeakPolarHBondContact O-CA 3.47Å; S1154-C1157 WeakPolarHBondContact O-CB 3.38Å; S1154-C1157 PolarHBondContact O-N 2.8Å; S1154-E1158 VanDerWaalsContact CB-OE1 3.26Å; S1154-E1158 WeakPolarHBondContact CB-OE1 3.48Å; S1154-E1158 WeakPolarHBondContact O-CG 3.38Å; S1154-E1158 PolarHBondContact O-N 3.23Å; S1154-E1158 PolarHBondContact OG-OE1 3Å
1155	E	89	Confident	82.6	Confident	38 Å²	38	85.2 Å²	85.2	18%	0.178	41%	0.41	C	S	.	.	H	α-helix	trans	-61.7	-36.3	-177.8	-56.2	90.4	150.8	0	0	111.5	L1129 M1152 Y1159	L1129-E1155 HydrophobicContact CD2-CB 3.82Å; L1129-E1155 HydrophobicContact CG-CB 4.38Å; M1152-E1155 WeakPolarHBondContact CA-OE2 3.47Å; M1152-E1155 HydrophobicContact CE-CB 4.17Å; M1152-E1155 VanDerWaalsContact CE-CD 3.49Å; M1152-E1155 HydrophobicContact CE-CG 3.81Å; M1152-E1155 WeakPolarHBondContact CE-OE1 3.43Å; E1155-Y1159 WeakPolarHBondContact O-CB 3.2Å; E1155-Y1159 PolarHBondContact O-N 3.46Å
1156	Y	87.7	Confident	83.2	Confident	61 Å²	61	79.7 Å²	79.7	24%	0.239	38%	0.384	C	S	.	.	H	α-helix	trans	-69.2	-36.5	171.5	-87.5	-60.4	0	0	0	113.5	L1129 R1149 M1152 S1154 K1160	L1129-Y1156 HydrophobicContact CD1-CD1 3.8Å; L1129-Y1156 HydrophobicContact CD1-CE1 3.97Å; L1129-Y1156 HydrophobicContact CD1-CG 4.38Å; L1129-Y1156 HydrophobicContact CD2-CD1 3.96Å; L1129-Y1156 HydrophobicContact CD2-CD2 3.83Å; L1129-Y1156 HydrophobicContact CD2-CE1 3.96Å; L1129-Y1156 HydrophobicContact CD2-CE2 3.84Å; L1129-Y1156 HydrophobicContact CD2-CG 3.88Å; L1129-Y1156 HydrophobicContact CG-CD1 4.5Å; L1129-Y1156 HydrophobicContact CG-CE1 4.43Å; R1149-Y1156 HydrophobicContact CB-CD2 4.05Å; R1149-Y1156 HydrophobicContact CB-CE2 3.75Å; R1149-Y1156 HydrophobicContact CG-CD2 4.48Å; R1149-Y1156 HydrophobicContact CG-CE2 3.71Å; M1152-Y1156 HydrophobicContact CB-CD2 4.01Å; M1152-Y1156 HydrophobicContact CB-CE2 4.14Å; M1152-Y1156 VanDerWaalsContact O-CD2 3.27Å; M1152-Y1156 WeakPolarHBondContact O-CD2 3.44Å; M1152-Y1156 PolarHBondContact O-N 3.11Å; M1152-Y1156 VanDerWaalsContact O-N 3.07Å; S1154-Y1156 VanDerWaalsContact C-N 3.29Å; S1154-Y1156 PolarHBondContact O-N 2.8Å; Y1156-K1160 WeakPolarHBondContact O-CB 3.47Å; Y1156-K1160 PolarHBondContact O-N 2.83Å
1157	C	83.7	Confident	83.9	Confident	75 Å²	75	75.5 Å²	75.5	51%	0.507	37%	0.371	S	S	.	.	H	α-helix	trans	-69.7	-47.9	174.6	-86.8	0	0	0	0	111.7	R1153 S1154 K1160 A1161	R1153-C1157 WeakPolarHBondContact O-CB 3.33Å; R1153-C1157 PolarHBondContact O-N 2.7Å; R1153-C1157 VanDerWaalsContact O-N 3.12Å; S1154-C1157 CarbonylContact O-C 3.55Å; S1154-C1157 WeakPolarHBondContact O-CA 3.47Å; S1154-C1157 WeakPolarHBondContact O-CB 3.38Å; S1154-C1157 PolarHBondContact O-N 2.8Å; C1157-K1160 WeakPolarHBondContact O-CB 3.44Å; C1157-K1160 PolarHBondContact O-N 2.96Å; C1157-K1160 VanDerWaalsContact O-N 3.15Å; C1157-A1161 PolarHBondContact O-N 3.03Å
1158	E	83.7	Confident	84.6	Confident	83 Å²	83	74.6 Å²	74.6	39%	0.388	37%	0.367	S	S	.	.	H	α-helix	trans	-57.9	-49	175.5	-71	158.1	-128.6	0	0	111.2	L1125 S1154 K1160 A1161 L1162	L1125-E1158 HydrophobicContact CD2-CB 3.43Å; L1125-E1158 VanDerWaalsContact CD2-CB 3.43Å; S1154-E1158 VanDerWaalsContact CB-OE1 3.26Å; S1154-E1158 WeakPolarHBondContact CB-OE1 3.48Å; S1154-E1158 WeakPolarHBondContact O-CG 3.38Å; S1154-E1158 PolarHBondContact O-N 3.23Å; S1154-E1158 PolarHBondContact OG-OE1 3Å; E1158-K1160 PolarHBondContact O-N 3.36Å; E1158-A1161 PolarHBondContact O-N 2.8Å; E1158-A1161 VanDerWaalsContact O-N 3.1Å; E1158-L1162 WeakPolarHBondContact O-CB 3.45Å; E1158-L1162 PolarHBondContact O-N 2.63Å
1159	Y	90.4	Very high	85.1	Confident	55 Å²	55	72.3 Å²	72.3	22%	0.216	36%	0.355	C	S	.	.	H	α-helix	trans	-59.1	-35.5	176.6	176.6	-102.1	0	0	0	112.3	K1122 L1125 Q1126 L1129 E1155 K1163	K1122-Y1159 HydrophobicContact CG-CD2 4.25Å; K1122-Y1159 HydrophobicContact CG-CE2 3.74Å; L1125-Y1159 HydrophobicContact CB-CD2 4.37Å; Q1126-Y1159 HydrophobicContact CB-CD2 4.48Å; Q1126-Y1159 HydrophobicContact CB-CE2 3.91Å; Q1126-Y1159 HydrophobicContact CG-CE2 4.38Å; L1129-Y1159 HydrophobicContact CD1-CD1 4.29Å; L1129-Y1159 HydrophobicContact CD1-CG 3.98Å; E1155-Y1159 WeakPolarHBondContact O-CB 3.2Å; E1155-Y1159 PolarHBondContact O-N 3.46Å; Y1159-K1163 WeakPolarHBondContact O-CB 3.38Å; Y1159-K1163 PolarHBondContact O-N 3.24Å
1160	K	87.4	Confident	85.5	Confident	149 Å²	149	71.6 Å²	71.6	65%	0.648	36%	0.355	S	S	*	.	H	α-helix	trans	-68.8	-43.7	175	-171.9	-175.2	176.6	-168.3	0	111.4	Y1156 C1157 E1158 K1163 T1164	Y1156-K1160 WeakPolarHBondContact O-CB 3.47Å; Y1156-K1160 PolarHBondContact O-N 2.83Å; C1157-K1160 WeakPolarHBondContact O-CB 3.44Å; C1157-K1160 PolarHBondContact O-N 2.96Å; C1157-K1160 VanDerWaalsContact O-N 3.15Å; E1158-K1160 PolarHBondContact O-N 3.36Å; K1160-K1163 PolarHBondContact O-N 2.68Å; K1160-T1164 PolarHBondContact O-N 3.43Å; K1160-T1164 VanDerWaalsContact O-N 3.09Å; K1160-T1164 PolarHBondContact O-OG1 3.05Å
1161	A	85.7	Confident	86	Confident	61 Å²	61	67.6 Å²	67.6	50%	0.504	34%	0.335	S	S	.	.	H	α-helix	trans	-63.8	-47.4	175.7	0	0	0	0	0	111.9	C1157 E1158 K1163 T1164 R1165	C1157-A1161 PolarHBondContact O-N 3.03Å; E1158-A1161 PolarHBondContact O-N 2.8Å; E1158-A1161 VanDerWaalsContact O-N 3.1Å; A1161-K1163 VanDerWaalsContact C-N 3.29Å; A1161-K1163 PolarHBondContact O-N 2.95Å; A1161-T1164 PolarHBondContact O-N 2.74Å; A1161-R1165 PolarHBondContact O-N 3.07Å
1162	L	89.4	Confident	86.4	Confident	20 Å²	20	67 Å²	67	11%	0.105	33%	0.326	C	S	.	.	H	α-helix	trans	-54.9	-42.6	173.1	-106	161.1	0	0	0	112.2	L1118 K1122 L1125 E1158 R1165 L1166	L1118-L1162 HydrophobicContact CB-CD2 3.88Å; L1118-L1162 HydrophobicContact CD2-CD2 3.56Å; L1118-L1162 HydrophobicContact CG-CD2 4.33Å; L1118-L1162 WeakPolarHBondContact O-CD2 3.1Å; K1122-L1162 HydrophobicContact CB-CD2 4.42Å; L1125-L1162 HydrophobicContact CD2-CD1 4.37Å; E1158-L1162 WeakPolarHBondContact O-CB 3.45Å; E1158-L1162 PolarHBondContact O-N 2.63Å; L1162-R1165 PolarHBondContact O-N 3.17Å; L1162-L1166 VanDerWaalsContact O-CB 3.26Å; L1162-L1166 WeakPolarHBondContact O-CB 3.26Å; L1162-L1166 WeakPolarHBondContact O-CG 3.5Å; L1162-L1166 PolarHBondContact O-N 2.76Å
1163	K	89.2	Confident	86.6	Confident	94 Å²	94	67.9 Å²	67.9	41%	0.409	33%	0.331	S	S	.	.	H	α-helix	trans	-65	-39.1	176.3	-169.4	-169.1	173.5	-158.9	0	112.1	Y1159 K1160 A1161 F1167	Y1159-K1163 WeakPolarHBondContact O-CB 3.38Å; Y1159-K1163 PolarHBondContact O-N 3.24Å; K1160-K1163 PolarHBondContact O-N 2.68Å; A1161-K1163 VanDerWaalsContact C-N 3.29Å; A1161-K1163 PolarHBondContact O-N 2.95Å; K1163-F1167 WeakPolarHBondContact O-CB 3.47Å; K1163-F1167 PolarHBondContact O-N 3Å
1164	T	85.8	Confident	86.7	Confident	77 Å²	77	64 Å²	64	47%	0.472	32%	0.319	S	S	.	.	H	α-helix	trans	-67.8	-46.1	175.6	-57.1	0	0	0	0	111.6	K1160 A1161 F1167 Q1168	K1160-T1164 PolarHBondContact O-N 3.43Å; K1160-T1164 VanDerWaalsContact O-N 3.09Å; K1160-T1164 PolarHBondContact O-OG1 3.05Å; A1161-T1164 PolarHBondContact O-N 2.74Å; T1164-F1167 WeakPolarHBondContact O-CA 3.4Å; T1164-F1167 WeakPolarHBondContact O-CB 3.47Å; T1164-F1167 PolarHBondContact O-N 3.14Å; T1164-F1167 VanDerWaalsContact O-N 3.11Å; T1164-Q1168 WeakPolarHBondContact O-CG 3.36Å; T1164-Q1168 PolarHBondContact O-N 3.26Å
1165	R	84.1	Confident	86.8	Confident	94 Å²	94	62.1 Å²	62.1	36%	0.355	31%	0.311	S	S	.	.	H	α-helix	trans	-68.6	-35.6	-179.3	-163.5	168.7	-175.7	161.1	-0.2	112.6	I1098 L1118 A1161 L1162 Q1168 L1169	I1098-R1165 VanDerWaalsContact CD1-CZ 3.49Å; I1098-R1165 VanDerWaalsContact CD1-NH2 3.28Å; L1118-R1165 HydrophobicContact CD1-CG 4.28Å; A1161-R1165 PolarHBondContact O-N 3.07Å; L1162-R1165 PolarHBondContact O-N 3.17Å; R1165-Q1168 PolarHBondContact O-N 2.95Å; R1165-L1169 HydrophobicContact CG-CD1 4.48Å; R1165-L1169 WeakPolarHBondContact O-CG 3.44Å; R1165-L1169 PolarHBondContact O-N 3.42Å
1166	L	90.9	Very high	86.4	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-63.2	-42.3	167.7	-83.1	171.5	0	0	0	112.3	L1115 L1118 R1119 K1122 L1162 L1169 E1170	L1115-L1166 HydrophobicContact CD2-CD2 3.9Å; L1118-L1166 HydrophobicContact CB-CD1 4.46Å; L1118-L1166 HydrophobicContact CB-CD2 3.54Å; L1118-L1166 HydrophobicContact CB-CG 3.84Å; R1119-L1166 HydrophobicContact CG-CD1 4.33Å; R1119-L1166 HydrophobicContact CG-CD2 3.81Å; K1122-L1166 HydrophobicContact CB-CD1 3.83Å; K1122-L1166 HydrophobicContact CD-CD1 3.32Å; K1122-L1166 HydrophobicContact CG-CD1 4.19Å; L1162-L1166 VanDerWaalsContact O-CB 3.26Å; L1162-L1166 WeakPolarHBondContact O-CB 3.26Å; L1162-L1166 WeakPolarHBondContact O-CG 3.5Å; L1162-L1166 PolarHBondContact O-N 2.76Å; L1166-L1169 PolarHBondContact O-N 2.76Å; L1166-E1170 WeakPolarHBondContact O-CB 3.36Å; L1166-E1170 VanDerWaalsContact O-CG 3.31Å; L1166-E1170 WeakPolarHBondContact O-CG 3.29Å; L1166-E1170 PolarHBondContact O-N 3.06Å
1167	F	89.4	Confident	85.7	Confident	103 Å²	103	65.7 Å²	65.7	45%	0.452	34%	0.336	S	S	.	.	H	α-helix	trans	-60	-47.6	174.3	-177.5	-103.5	0	0	0	110.3	N731 K1163 T1164 L1169 E1170 T1171	N731-F1167 HydrophobicContact CB-CZ 3.93Å; K1163-F1167 WeakPolarHBondContact O-CB 3.47Å; K1163-F1167 PolarHBondContact O-N 3Å; T1164-F1167 WeakPolarHBondContact O-CA 3.4Å; T1164-F1167 WeakPolarHBondContact O-CB 3.47Å; T1164-F1167 PolarHBondContact O-N 3.14Å; T1164-F1167 VanDerWaalsContact O-N 3.11Å; F1167-L1169 VanDerWaalsContact C-N 3.32Å; F1167-L1169 PolarHBondContact O-N 3.07Å; F1167-E1170 PolarHBondContact O-N 3.5Å; F1167-T1171 WeakPolarHBondContact O-CB 3.5Å; F1167-T1171 PolarHBondContact O-N 2.92Å; F1167-T1171 PolarHBondContact O-OG1 3.28Å
1168	Q	87.5	Confident	84.7	Confident	90 Å²	90	68.4 Å²	68.4	42%	0.421	36%	0.364	S	S	.	.	H	α-helix	trans	-57.8	-37.1	177.1	-72.2	169.5	-58.6	0	0	113.8	T1164 R1165 T1171 E1172	T1164-Q1168 WeakPolarHBondContact O-CG 3.36Å; T1164-Q1168 PolarHBondContact O-N 3.26Å; R1165-Q1168 PolarHBondContact O-N 2.95Å; Q1168-T1171 VanDerWaalsContact O-CB 3.25Å; Q1168-T1171 WeakPolarHBondContact O-CB 3.48Å; Q1168-E1172 WeakPolarHBondContact O-CB 3.18Å; Q1168-E1172 PolarHBondContact O-N 3.07Å
1169	L	87.6	Confident	84.7	Confident	3 Å²	3	67.7 Å²	67.7	2%	0.016	36%	0.363	C	S	.	.	H	α-helix	trans	-82.5	-33.7	177.6	-69.1	165.3	0	0	0	113.5	L1103 L1111 A1114 L1115 L1118 R1165 L1166 F1167 T1171 L1173	L1103-L1169 HydrophobicContact CD1-CD2 4.3Å; L1103-L1169 HydrophobicContact CD2-CD2 4.21Å; L1103-L1169 HydrophobicContact CG-CD2 4.31Å; L1111-L1169 HydrophobicContact CD2-CB 3.98Å; L1111-L1169 HydrophobicContact CD2-CD2 3.56Å; L1111-L1169 HydrophobicContact CD2-CG 4.38Å; L1111-L1169 WeakPolarHBondContact CD2-O 3.46Å; L1111-L1169 HydrophobicContact CG-CD2 3.91Å; A1114-L1169 HydrophobicContact CB-CD1 4.24Å; L1115-L1169 HydrophobicContact CD2-CB 3.74Å; L1115-L1169 HydrophobicContact CG-CB 3.93Å; L1118-L1169 HydrophobicContact CD1-CD1 3.35Å; R1165-L1169 HydrophobicContact CG-CD1 4.48Å; R1165-L1169 WeakPolarHBondContact O-CG 3.44Å; R1165-L1169 PolarHBondContact O-N 3.42Å; L1166-L1169 PolarHBondContact O-N 2.76Å; F1167-L1169 VanDerWaalsContact C-N 3.32Å; F1167-L1169 PolarHBondContact O-N 3.07Å; L1169-T1171 PolarHBondContact O-N 3.46Å; L1169-L1173 VanDerWaalsContact O-CB 3.29Å; L1169-L1173 WeakPolarHBondContact O-CB 3.4Å; L1169-L1173 PolarHBondContact O-N 3.24Å
1170	E	88.3	Confident	84.4	Confident	76 Å²	76	68.4 Å²	68.4	36%	0.355	37%	0.37	S	S	.	.	H	α-helix	trans	-66.4	-30.8	169.8	-70.7	-179.8	166.9	0	0	110.9	L1115 R1119 L1166 F1167 K1174	L1115-E1170 HydrophobicContact CD2-CG 3.55Å; R1119-E1170 IonicContact CZ-OE1 3.06Å; R1119-E1170 IonicContact NE-OE1 3.32Å; R1119-E1170 PolarHBondContact NE-OE1 3.44Å; R1119-E1170 IonicContact NH2-OE1 2.91Å; R1119-E1170 PolarHBondContact NH2-OE1 3.49Å; L1166-E1170 WeakPolarHBondContact O-CB 3.36Å; L1166-E1170 VanDerWaalsContact O-CG 3.31Å; L1166-E1170 WeakPolarHBondContact O-CG 3.29Å; L1166-E1170 PolarHBondContact O-N 3.06Å; F1167-E1170 PolarHBondContact O-N 3.5Å; E1170-K1174 WeakPolarHBondContact O-CG 3.39Å; E1170-K1174 PolarHBondContact O-N 3.1Å
1171	T	87.4	Confident	84.3	Confident	26 Å²	26	63.9 Å²	63.9	16%	0.16	36%	0.355	C	S	.	.	H	α-helix	trans	-63.1	-65.1	169.3	-82.1	0	0	0	0	110.1	L732 F1167 Q1168 L1169 L1173 K1174 G1175	L732-T1171 HydrophobicContact CD1-CG2 3.88Å; L732-T1171 VanDerWaalsContact CD2-C 3.47Å; L732-T1171 HydrophobicContact CD2-CG2 3.53Å; L732-T1171 WeakPolarHBondContact CD2-O 3.32Å; L732-T1171 HydrophobicContact CG-CG2 3.65Å; F1167-T1171 WeakPolarHBondContact O-CB 3.5Å; F1167-T1171 PolarHBondContact O-N 2.92Å; F1167-T1171 PolarHBondContact O-OG1 3.28Å; Q1168-T1171 VanDerWaalsContact O-CB 3.25Å; Q1168-T1171 WeakPolarHBondContact O-CB 3.48Å; L1169-T1171 PolarHBondContact O-N 3.46Å; T1171-L1173 VanDerWaalsContact C-N 3.29Å; T1171-L1173 PolarHBondContact O-N 3.41Å; T1171-K1174 WeakPolarHBondContact O-CA 3.42Å; T1171-K1174 WeakPolarHBondContact O-CB 3.3Å; T1171-K1174 PolarHBondContact O-N 3.19Å; T1171-G1175 PolarHBondContact O-N 2.95Å
1172	E	85.2	Confident	84.2	Confident	48 Å²	48	64.1 Å²	64.1	22%	0.224	35%	0.346	C	S	.	.	H	α-helix	trans	-56.5	-39.6	-178.3	-174.3	65.4	-165.4	0	0	112.7	L1103 L1111 Q1168 K1174 G1175 R1176	L1103-E1172 HydrophobicContact CD2-CB 3.98Å; L1103-E1172 HydrophobicContact CD2-CG 4.04Å; L1103-E1172 HydrophobicContact CG-CG 4.38Å; L1111-E1172 HydrophobicContact CD1-CB 4.33Å; L1111-E1172 HydrophobicContact CD1-CG 3.57Å; L1111-E1172 HydrophobicContact CD2-CB 4.24Å; L1111-E1172 HydrophobicContact CD2-CG 4.37Å; Q1168-E1172 WeakPolarHBondContact O-CB 3.18Å; Q1168-E1172 PolarHBondContact O-N 3.07Å; E1172-K1174 VanDerWaalsContact C-N 3.34Å; E1172-K1174 PolarHBondContact O-N 2.99Å; E1172-G1175 PolarHBondContact O-N 3.19Å; E1172-R1176 WeakPolarHBondContact O-CG 3.39Å; E1172-R1176 PolarHBondContact O-N 3.12Å; E1172-R1176 VanDerWaalsContact O-N 3.13Å; E1172-R1176 IonicContact OE1-CZ 3.45Å; E1172-R1176 VanDerWaalsContact OE1-CZ 3.29Å; E1172-R1176 IonicContact OE1-NE 2.64Å; E1172-R1176 PolarHBondContact OE1-NE 2.99Å; E1172-R1176 IonicContact OE1-NH2 3.45Å; E1172-R1176 PolarHBondContact OE1-NH2 2.76Å
1173	L	85	Confident	83.8	Confident	36 Å²	36	66.8 Å²	66.8	19%	0.188	36%	0.361	C	S	.	.	H	α-helix	trans	-66.3	-33	175.5	-160.3	81.3	0	0	0	112.8	L1111 K1112 L1115 L1169 T1171 C1177	L1111-L1173 HydrophobicContact CB-CD1 4.06Å; L1111-L1173 HydrophobicContact CD2-CB 4.05Å; L1111-L1173 HydrophobicContact CD2-CD1 4.13Å; K1112-L1173 HydrophobicContact CG-CD1 4Å; K1112-L1173 HydrophobicContact CG-CD2 4.29Å; L1115-L1173 HydrophobicContact CD1-CB 4.08Å; L1115-L1173 HydrophobicContact CD1-CD2 3.78Å; L1115-L1173 HydrophobicContact CD1-CG 4.36Å; L1169-L1173 VanDerWaalsContact O-CB 3.29Å; L1169-L1173 WeakPolarHBondContact O-CB 3.4Å; L1169-L1173 PolarHBondContact O-N 3.24Å; T1171-L1173 VanDerWaalsContact C-N 3.29Å; T1171-L1173 PolarHBondContact O-N 3.41Å; L1173-C1177 VanDerWaalsContact O-CB 3.31Å; L1173-C1177 WeakPolarHBondContact O-CB 3.4Å; L1173-C1177 PolarHBondContact O-N 3.39Å; L1173-C1177 PolarHBondContact O-SG 3.48Å
1174	K	84.2	Confident	83.5	Confident	81 Å²	81	65 Å²	65	35%	0.352	36%	0.358	S	S	.	.	H	α-helix	trans	-68.2	-42.4	172.2	-85.1	-173.8	177	-166.6	0	111.3	S728 N729 L732 E1170 T1171 E1172 R1176 C1177 A1178	S728-K1174 PolarHBondContact O-NZ 3.16Å; S728-K1174 PolarHBondContact OG-NZ 3.5Å; N729-K1174 PolarHBondContact OD1-NZ 3.45Å; L732-K1174 HydrophobicContact CD1-CB 4.37Å; E1170-K1174 WeakPolarHBondContact O-CG 3.39Å; E1170-K1174 PolarHBondContact O-N 3.1Å; T1171-K1174 WeakPolarHBondContact O-CA 3.42Å; T1171-K1174 WeakPolarHBondContact O-CB 3.3Å; T1171-K1174 PolarHBondContact O-N 3.19Å; E1172-K1174 VanDerWaalsContact C-N 3.34Å; E1172-K1174 PolarHBondContact O-N 2.99Å; K1174-R1176 PolarHBondContact O-N 2.68Å; K1174-C1177 PolarHBondContact O-N 3.32Å; K1174-A1178 WeakPolarHBondContact O-CB 3.46Å; K1174-A1178 PolarHBondContact O-N 3.22Å
1175	G	80.4	Confident	83.3	Confident	32 Å²	32	64.1 Å²	64.1	33%	0.33	35%	0.35	S	S	.	.	H	α-helix	trans	-63.2	-25.4	179	0	0	0	0	0	113.8	T1171 E1172	T1171-G1175 PolarHBondContact O-N 2.95Å; E1172-G1175 PolarHBondContact O-N 3.19Å
1176	R	80.6	Confident	83.3	Confident	80 Å²	80	61.8 Å²	61.8	30%	0.302	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	0.8	177.3	-64.6	171.1	178.2	-128.3	11.5	115	L1103 S1104 W1106 E1172 K1174	L1103-R1176 PolarHBondContact O-NH2 3.05Å; S1104-R1176 VanDerWaalsContact CA-NH2 3.31Å; S1104-R1176 PolarHBondContact O-NH2 2.99Å; W1106-R1176 PolarHBondContact O-NH1 3.3Å; E1172-R1176 WeakPolarHBondContact O-CG 3.39Å; E1172-R1176 PolarHBondContact O-N 3.12Å; E1172-R1176 VanDerWaalsContact O-N 3.13Å; E1172-R1176 IonicContact OE1-CZ 3.45Å; E1172-R1176 VanDerWaalsContact OE1-CZ 3.29Å; E1172-R1176 IonicContact OE1-NE 2.64Å; E1172-R1176 PolarHBondContact OE1-NE 2.99Å; E1172-R1176 IonicContact OE1-NH2 3.45Å; E1172-R1176 PolarHBondContact OE1-NH2 2.76Å; K1174-R1176 PolarHBondContact O-N 2.68Å
1177	C	72.8	Confident	82.6	Confident	94 Å²	94	66.8 Å²	66.8	64%	0.635	38%	0.378	S	S	*	.			trans	-123	11.6	178	-69.6	0	0	0	0	111.6	L1173 K1174	L1173-C1177 VanDerWaalsContact O-CB 3.31Å; L1173-C1177 WeakPolarHBondContact O-CB 3.4Å; L1173-C1177 PolarHBondContact O-N 3.39Å; L1173-C1177 PolarHBondContact O-SG 3.48Å; K1174-C1177 PolarHBondContact O-N 3.32Å
1178	A	63	Low	82	Confident	133 Å²	133	63.5 Å²	63.5	100%	1.099	37%	0.371	S	S	*	.			trans	-119.3	0	174.1	0	0	0	0	0	108.6	K1174	K1174-A1178 WeakPolarHBondContact O-CB 3.46Å; K1174-A1178 PolarHBondContact O-N 3.22Å

Retrieved 1,178 of 1,178 residues in 237.1 ms (Link to these results)

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