A0A087XEJ2_POEFO Loading...

Importin 9

AlphaFold DB , UniProt , Accession A0A087XEJ2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,042 aa.

						>A0A087XEJ2_POEFO|A0A087XEJ2
MSAAGDGRAVPAVGPVQQGLKEALIETLTAILSPVQEVRAAAEEQIKVLEVTEEFGVHLAELTVDPQGALAIRQLASVILKQYVETHWCAHSEKFRPPETTDQAKAAIRELLPSGLRESISKVRSSVAYAVSAIAHWDWPEAWPQLFTLLMEMLVSGDVNAVHGAMRVLTEFTREVTDTQMPLVAPVILPEMYKIFTMAEVYSIRTRSRAVEIFTTCANLICAIEELEKGAAKALIFPVVQQFTEAFVQALQMPDGPTSDSGLKMEVLKAVTALVKNFPKPMVSSMQQILPIVWNTLTESAAFYVRTEVNYTEEVDDPIDSDGEVLGFENLVFSIFEFVHTLLENNKFKSTVRKALPELIYYIILYMQITEDQVKVWTANPQQFVEDEDDDTFSYSVRISAQDLLLAVAAEFQNESAAALAAAATRHLQEAEQAKNGGSEHWWKIHEACMLALGSVKTIITENVKNGRVQFDMHGFLAGVILADLNLTAASPFLLGRALWAASRFTAAMSPELIQQFLQATVSGLHDSQPPSVRISAVRAIWGYCDQLKLSESTHILQPFLPSILEGLVQLAAQFSSEVLTLVMETLCIVCTVDPAFTTSAENKICPLTIAIFLKYNNDPVVAALAQDIFKELAQIEGCQGPMQMRLIPTLISIMQAPPDKIPSGLCATSIDILATVVRNTKPPLSELLVCQAFPVVAQCTLRTDDHTIMQNGGECLRAYVSVALEQIAQWRDEQGNSGLWYVMQVVNQLLDPRTSESTAVFVGRLVSTLISRAGTELGDQLDHILRAILSKMQQAEALSVMQSLIMVFAHLVHSQLEPLLEFLCSLPGPTGKPALEFVMTEWMSRQHLFYGQYEGKVSTVALCKLLQHGINADDKRLQDIMVKGEEIYNLEDGIRTRSKSAKNPERWTNIPLLVKIFKLIINELSTVVEANASRANAADWSHDPSGMWDDQEDGEGEDDDEDEGLAGQLLSDLISSNKYDDDYYEDDEEDDPDALKDPIYLIDLQAYLTDFLTQFAQQPCYSMFSNHLNNAERQTLQSIGL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.2	Very low	32.8	Very low	253 Å²	253	134.4 Å²	134.4	100%	1.246	86%	0.859	S	S	*	*				0	134.6	0	-88.3	173.3	166.9	0	0	107.6
2	S	33.7	Very low	33.5	Very low	120 Å²	120	131.6 Å²	131.6	84%	0.839	86%	0.857	S	S	*	*			trans	-80.1	138	-166	157.8	0	0	0	0	113
3	A	28.6	Very low	34.9	Very low	95 Å²	95	127.2 Å²	127.2	79%	0.785	83%	0.826	S	S	*	*			trans	-163.2	83.5	148.8	0	0	0	0	0	105.9
4	A	32.1	Very low	36.6	Very low	98 Å²	98	119.9 Å²	119.9	81%	0.81	79%	0.785	S	S	*	*				53.8	105.6	97.4	0	0	0	0	0	112.1
5	G	36.7	Very low	38.6	Very low	78 Å²	78	119.3 Å²	119.3	80%	0.804	78%	0.781	S	S	*	*			trans	-84.3	154.6	-175	0	0	0	0	0	113.7
6	D	27.9	Very low	40.6	Very low	168 Å²	168	118.7 Å²	118.7	90%	0.898	77%	0.774	S	S	*	*			trans	-114.6	106.5	164.1	-93.9	-25.7	0	0	0	107.8	R8	D6-R8 PolarHBondContact O-N 2.7Å
7	G	31.6	Very low	42.3	Very low	80 Å²	80	115.2 Å²	115.2	83%	0.825	75%	0.745	S	S	*	*			trans	-67.7	114.4	165.8	0	0	0	0	0	108.9	A9	G7-A9 PolarHBondContact O-N 3.25Å
8	R	30.6	Very low	44.2	Very low	248 Å²	248	114.9 Å²	114.9	94%	0.936	73%	0.732	S	S	*	*			trans	-70.7	111.5	164.2	-85.4	-177.6	172	177.8	-2.8	108.2	D6	D6-R8 PolarHBondContact O-N 2.7Å
9	A	30.5	Very low	46.4	Very low	95 Å²	95	110.7 Å²	110.7	79%	0.785	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-61.1	138.5	171.3	0	0	0	0	0	110.9	G7	G7-A9 PolarHBondContact O-N 3.25Å
10	V	35.2	Very low	48.4	Very low	129 Å²	129	108.2 Å²	108.2	78%	0.782	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-52.9	137.2	165.5	179.8	0	0	0	0	108.9	A12	V10-A12 PolarHBondContact O-N 2.67Å
11	P	38.8	Very low	50.3	Low	114 Å²	114	106 Å²	106	74%	0.74	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-65.3	128.1	175.1	1.7	11	0	0	0	108.9	V13	P11-V13 PolarHBondContact O-N 2.93Å
12	A	40.8	Very low	53	Low	101 Å²	101	100 Å²	100	84%	0.835	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-67.9	118.8	174.8	0	0	0	0	0	109.8	V10 G14	V10-A12 PolarHBondContact O-N 2.67Å; A12-G14 PolarHBondContact O-N 3.44Å
13	V	52.5	Low	55.7	Low	74 Å²	74	95.9 Å²	95.9	45%	0.448	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-53.4	130.7	170.8	-178.8	0	0	0	0	109.3	P11 Q17 Q18	P11-V13 PolarHBondContact O-N 2.93Å; V13-Q17 HydrophobicContact CG1-CB 3.68Å; V13-Q18 HydrophobicContact CG1-CG 3.98Å
14	G	58.9	Low	58.8	Low	25 Å²	25	91.5 Å²	91.5	26%	0.258	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-67.8	153	-176.5	0	0	0	0	0	112.7	A12 V16 Q17 Q18	A12-G14 PolarHBondContact O-N 3.44Å; G14-V16 PolarHBondContact O-N 2.93Å; G14-V16 VanDerWaalsContact O-N 3.15Å; G14-Q17 WeakPolarHBondContact O-CB 3.5Å; G14-Q17 PolarHBondContact O-N 2.79Å; G14-Q18 PolarHBondContact O-N 2.87Å
15	P	65.4	Low	61.7	Low	112 Å²	112	89.9 Å²	89.9	73%	0.727	56%	0.555	S	S	*	*	H	α-helix	trans	-62.1	-24.6	-178	23.5	-32.9	0	0	0	113.9	G19	P15-G19 PolarHBondContact O-N 3.04Å
16	V	71.9	Confident	64.4	Low	109 Å²	109	92.9 Å²	92.9	66%	0.661	55%	0.548	S	S	*	.	H	α-helix	trans	-72.5	-37.9	175.4	178.3	0	0	0	0	111.5	G14 G19 L20	G14-V16 PolarHBondContact O-N 2.93Å; G14-V16 VanDerWaalsContact O-N 3.15Å; V16-G19 PolarHBondContact O-N 3.05Å; V16-L20 HydrophobicContact CG1-CD1 4.5Å; V16-L20 WeakPolarHBondContact O-CG 3.43Å; V16-L20 PolarHBondContact O-N 3.12Å
17	Q	69.5	Low	67.6	Low	60 Å²	60	85 Å²	85	28%	0.28	51%	0.506	S	S	.	.	H	α-helix	trans	-70.4	-39.7	-179.4	-63.8	174.5	-39.6	0	0	111.1	V13 G14 G19 L20 K21 E54 H58	V13-Q17 HydrophobicContact CG1-CB 3.68Å; G14-Q17 WeakPolarHBondContact O-CB 3.5Å; G14-Q17 PolarHBondContact O-N 2.79Å; Q17-G19 VanDerWaalsContact C-N 3.31Å; Q17-G19 PolarHBondContact O-N 2.92Å; Q17-L20 PolarHBondContact O-N 2.98Å; Q17-K21 PolarHBondContact O-N 3.06Å; Q17-E54 VanDerWaalsContact CB-OE2 3.3Å; Q17-E54 WeakPolarHBondContact CB-OE2 3.47Å; Q17-E54 WeakPolarHBondContact CG-OE2 3.44Å; Q17-E54 PolarHBondContact NE2-OE1 3.41Å; Q17-E54 PolarHBondContact NE2-OE2 3.1Å; Q17-E54 VanDerWaalsContact NE2-OE2 3.15Å; Q17-H58 PolarHBondContact O-NE2 3.2Å
18	Q	76.3	Confident	70.7	Confident	110 Å²	110	81.2 Å²	81.2	51%	0.514	47%	0.467	S	S	.	.	H	α-helix	trans	-60	-41.3	172	-69.6	178.7	-8.1	0	0	111.9	V13 G14 K21 E22	V13-Q18 HydrophobicContact CG1-CG 3.98Å; G14-Q18 PolarHBondContact O-N 2.87Å; Q18-K21 PolarHBondContact O-N 3.02Å; Q18-E22 WeakPolarHBondContact O-CG 3.33Å; Q18-E22 PolarHBondContact O-N 2.75Å
19	G	84.8	Confident	73.7	Confident	35 Å²	35	73.1 Å²	73.1	36%	0.361	45%	0.445	S	S	.	.	H	α-helix	trans	-65.8	-35.2	175.4	0	0	0	0	0	114.1	P15 V16 Q17 A23	P15-G19 PolarHBondContact O-N 3.04Å; V16-G19 PolarHBondContact O-N 3.05Å; Q17-G19 VanDerWaalsContact C-N 3.31Å; Q17-G19 PolarHBondContact O-N 2.92Å; G19-A23 WeakPolarHBondContact O-CB 3.47Å; G19-A23 PolarHBondContact O-N 3.27Å
20	L	86.9	Confident	76.7	Confident	60 Å²	60	69.6 Å²	69.6	31%	0.314	42%	0.416	S	S	.	.	H	α-helix	trans	-70.3	-37.5	175.5	-72.7	173.7	0	0	0	112.3	V16 Q17 A23 L24 L49	V16-L20 HydrophobicContact CG1-CD1 4.5Å; V16-L20 WeakPolarHBondContact O-CG 3.43Å; V16-L20 PolarHBondContact O-N 3.12Å; Q17-L20 PolarHBondContact O-N 2.98Å; L20-A23 PolarHBondContact O-N 3.15Å; L20-L24 PolarHBondContact O-N 3.13Å; L20-L49 HydrophobicContact CD2-CD2 4.39Å
21	K	89.6	Confident	79.5	Confident	63 Å²	63	64.9 Å²	64.9	27%	0.274	39%	0.386	S	S	.	.	H	α-helix	trans	-64.7	-42.6	173.2	-174.6	174.3	-179.7	170	0	112.2	Q17 Q18 L24 I25 H58 E61	Q17-K21 PolarHBondContact O-N 3.06Å; Q18-K21 PolarHBondContact O-N 3.02Å; K21-L24 PolarHBondContact O-N 2.93Å; K21-I25 HydrophobicContact CG-CD1 4.49Å; K21-I25 WeakPolarHBondContact O-CG1 3.29Å; K21-I25 PolarHBondContact O-N 3.18Å; K21-H58 HydrophobicContact CG-CB 4.32Å; K21-E61 WeakPolarHBondContact CD-OE2 3.45Å; K21-E61 VanDerWaalsContact CE-OE2 3.29Å; K21-E61 WeakPolarHBondContact CE-OE2 3.47Å; K21-E61 IonicContact NZ-OE2 2.68Å; K21-E61 PolarHBondContact NZ-OE2 3Å
22	E	90.6	Very high	82.1	Confident	126 Å²	126	63.5 Å²	63.5	59%	0.589	37%	0.372	S	S	*	.	H	α-helix	trans	-61	-45.2	173.9	-74.2	176.7	178.4	0	0	111.3	Q18 L24 I25 E26	Q18-E22 WeakPolarHBondContact O-CG 3.33Å; Q18-E22 PolarHBondContact O-N 2.75Å; E22-L24 VanDerWaalsContact C-N 3.32Å; E22-L24 PolarHBondContact O-N 2.89Å; E22-I25 PolarHBondContact O-N 3.38Å; E22-I25 VanDerWaalsContact O-N 3.17Å; E22-E26 WeakPolarHBondContact O-CG 3.35Å; E22-E26 PolarHBondContact O-N 3.11Å
23	A	91.3	Very high	84.6	Confident	34 Å²	34	59.9 Å²	59.9	28%	0.281	34%	0.341	S	S	.	.	H	α-helix	trans	-58.7	-42.1	174.9	0	0	0	0	0	112.1	G19 L20 I25 E26 T27	G19-A23 WeakPolarHBondContact O-CB 3.47Å; G19-A23 PolarHBondContact O-N 3.27Å; L20-A23 PolarHBondContact O-N 3.15Å; A23-I25 PolarHBondContact O-N 3.32Å; A23-E26 PolarHBondContact O-N 2.98Å; A23-T27 WeakPolarHBondContact O-CB 2.91Å; A23-T27 PolarHBondContact O-N 3.43Å; A23-T27 PolarHBondContact O-OG1 3.02Å
24	L	93.6	Very high	86.5	Confident	3 Å²	3	62.4 Å²	62.4	2%	0.016	36%	0.359	C	S	.	.	H	α-helix	trans	-61.1	-43.8	175.6	-178.9	61.7	0	0	0	112	L20 K21 E22 E26 T27 L28 L49 F55 H58 L59 L62	L20-L24 PolarHBondContact O-N 3.13Å; K21-L24 PolarHBondContact O-N 2.93Å; E22-L24 VanDerWaalsContact C-N 3.32Å; E22-L24 PolarHBondContact O-N 2.89Å; L24-E26 VanDerWaalsContact C-N 3.35Å; L24-E26 PolarHBondContact O-N 3.38Å; L24-T27 PolarHBondContact O-N 2.83Å; L24-L28 HydrophobicContact CD1-CD1 4.29Å; L24-L28 HydrophobicContact CD1-CG 4.13Å; L24-L28 HydrophobicContact CG-CD1 4.12Å; L24-L28 HydrophobicContact CG-CG 4.37Å; L24-L28 WeakPolarHBondContact O-CB 3.17Å; L24-L28 VanDerWaalsContact O-CG 3.24Å; L24-L28 WeakPolarHBondContact O-CG 3.42Å; L24-L28 PolarHBondContact O-N 3.04Å; L24-L49 HydrophobicContact CB-CD1 4.33Å; L24-L49 HydrophobicContact CD1-CD1 4Å; L24-F55 HydrophobicContact CD1-CD2 4.26Å; L24-F55 HydrophobicContact CD1-CE2 3.72Å; L24-H58 HydrophobicContact CD2-CB 3.65Å; L24-L59 HydrophobicContact CD1-CD2 4.4Å; L24-L59 HydrophobicContact CD2-CD2 4.05Å; L24-L59 HydrophobicContact CD2-CG 4.1Å; L24-L62 HydrophobicContact CD2-CD1 3.87Å; L24-L62 HydrophobicContact CG-CD1 4.11Å
25	I	93.3	Very high	88.3	Confident	64 Å²	64	64.9 Å²	64.9	33%	0.328	37%	0.368	S	S	.	.	H	α-helix	trans	-62	-43.8	177.5	-66.1	166.8	0	0	0	111	K21 E22 A23 T29 L62	K21-I25 HydrophobicContact CG-CD1 4.49Å; K21-I25 WeakPolarHBondContact O-CG1 3.29Å; K21-I25 PolarHBondContact O-N 3.18Å; E22-I25 PolarHBondContact O-N 3.38Å; E22-I25 VanDerWaalsContact O-N 3.17Å; A23-I25 PolarHBondContact O-N 3.32Å; I25-T29 WeakPolarHBondContact O-CB 3.37Å; I25-T29 PolarHBondContact O-N 3.22Å; I25-T29 PolarHBondContact O-OG1 3.49Å; I25-L62 HydrophobicContact CD1-CD2 3.86Å; I25-L62 HydrophobicContact CG1-CD1 4.03Å; I25-L62 HydrophobicContact CG1-CD2 3.63Å; I25-L62 HydrophobicContact CG1-CG 4.47Å
26	E	93.5	Very high	89.7	Confident	140 Å²	140	66.6 Å²	66.6	65%	0.654	37%	0.367	S	S	*	.	H	α-helix	trans	-61.8	-46.5	176.7	-71.4	-176.5	174.9	0	0	111.3	E22 A23 L24 T29 A30	E22-E26 WeakPolarHBondContact O-CG 3.35Å; E22-E26 PolarHBondContact O-N 3.11Å; A23-E26 PolarHBondContact O-N 2.98Å; L24-E26 VanDerWaalsContact C-N 3.35Å; L24-E26 PolarHBondContact O-N 3.38Å; E26-T29 PolarHBondContact O-N 3.05Å; E26-A30 WeakPolarHBondContact O-CB 3.46Å; E26-A30 PolarHBondContact O-N 3.18Å
27	T	95.1	Very high	90.7	Very high	4 Å²	4	69.3 Å²	69.3	3%	0.025	37%	0.372	C	S	.	.	H	α-helix	trans	-62.4	-46.1	177.7	-59.8	0	0	0	0	111.6	A23 L24 T29 A30 I31 A42 Q45 I46 L49	A23-T27 WeakPolarHBondContact O-CB 2.91Å; A23-T27 PolarHBondContact O-N 3.43Å; A23-T27 PolarHBondContact O-OG1 3.02Å; L24-T27 PolarHBondContact O-N 2.83Å; T27-T29 VanDerWaalsContact C-N 3.31Å; T27-T29 PolarHBondContact O-N 3.02Å; T27-A30 WeakPolarHBondContact O-CB 3.24Å; T27-A30 PolarHBondContact O-N 3.31Å; T27-A30 VanDerWaalsContact O-N 3.15Å; T27-I31 HydrophobicContact CG2-CD1 4.26Å; T27-I31 WeakPolarHBondContact O-CG1 3.33Å; T27-I31 PolarHBondContact O-N 3.35Å; T27-A42 HydrophobicContact CG2-CB 3.99Å; T27-A42 VanDerWaalsContact CG2-O 3.22Å; T27-A42 WeakPolarHBondContact CG2-O 3.3Å; T27-Q45 HydrophobicContact CG2-CB 3.97Å; T27-Q45 PolarHBondContact OG1-OE1 2.98Å; T27-I46 HydrophobicContact CG2-CB 3.88Å; T27-I46 HydrophobicContact CG2-CG1 4.49Å; T27-L49 HydrophobicContact CG2-CD1 4.41Å
28	L	94.7	Very high	91.9	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-62	-39.1	176.4	-67.9	176.7	0	0	0	112	L24 A30 I31 L32 I46 L59 L62 I72 L75 A76 I79	L24-L28 HydrophobicContact CD1-CD1 4.29Å; L24-L28 HydrophobicContact CD1-CG 4.13Å; L24-L28 HydrophobicContact CG-CD1 4.12Å; L24-L28 HydrophobicContact CG-CG 4.37Å; L24-L28 WeakPolarHBondContact O-CB 3.17Å; L24-L28 VanDerWaalsContact O-CG 3.24Å; L24-L28 WeakPolarHBondContact O-CG 3.42Å; L24-L28 PolarHBondContact O-N 3.04Å; L28-A30 VanDerWaalsContact C-N 3.33Å; L28-I31 HydrophobicContact CD2-CD1 4.45Å; L28-I31 PolarHBondContact O-N 3.11Å; L28-L32 PolarHBondContact O-N 2.94Å; L28-I46 HydrophobicContact CD2-CD1 3.99Å; L28-L59 HydrophobicContact CD1-CD2 4.49Å; L28-L62 HydrophobicContact CD1-CD1 3.81Å; L28-I72 HydrophobicContact CB-CD1 4Å; L28-I72 HydrophobicContact CB-CG2 4.5Å; L28-I72 HydrophobicContact CD1-CG2 4.09Å; L28-L75 HydrophobicContact CB-CD2 4.24Å; L28-L75 HydrophobicContact CD2-CD2 3.79Å; L28-L75 HydrophobicContact CD2-CG 3.94Å; L28-A76 HydrophobicContact CD1-CB 4.04Å; L28-I79 HydrophobicContact CD2-CD1 3.43Å; L28-I79 VanDerWaalsContact CD2-CD1 3.43Å
29	T	94.6	Very high	92.7	Very high	77 Å²	77	69.2 Å²	69.2	47%	0.472	37%	0.371	S	S	.	.	H	α-helix	trans	-64.9	-39.5	175.6	-56.3	0	0	0	0	111.1	I25 E26 T27 L32 I72	I25-T29 WeakPolarHBondContact O-CB 3.37Å; I25-T29 PolarHBondContact O-N 3.22Å; I25-T29 PolarHBondContact O-OG1 3.49Å; E26-T29 PolarHBondContact O-N 3.05Å; T27-T29 VanDerWaalsContact C-N 3.31Å; T27-T29 PolarHBondContact O-N 3.02Å; T29-L32 PolarHBondContact O-N 3.12Å; T29-I72 WeakPolarHBondContact OG1-CD1 3.34Å
30	A	93.4	Very high	93.1	Very high	21 Å²	21	69.7 Å²	69.7	17%	0.174	37%	0.372	C	S	.	.	H	α-helix	trans	-68.9	-35.4	177.3	0	0	0	0	0	113	E26 T27 L28 L32 S33 V38 A42	E26-A30 WeakPolarHBondContact O-CB 3.46Å; E26-A30 PolarHBondContact O-N 3.18Å; T27-A30 WeakPolarHBondContact O-CB 3.24Å; T27-A30 PolarHBondContact O-N 3.31Å; T27-A30 VanDerWaalsContact O-N 3.15Å; L28-A30 VanDerWaalsContact C-N 3.33Å; A30-L32 PolarHBondContact O-N 3.04Å; A30-S33 WeakPolarHBondContact O-CB 3.4Å; A30-S33 PolarHBondContact O-N 3.22Å; A30-S33 VanDerWaalsContact O-N 3.07Å; A30-V38 HydrophobicContact CB-CG1 3.66Å; A30-A42 HydrophobicContact CB-CB 3.6Å
31	I	94.6	Very high	93.5	Very high	31 Å²	31	69.2 Å²	69.2	16%	0.159	38%	0.376	C	S	.	.	H	α-helix	trans	-60.8	-32.2	173.5	-69.4	168.9	0	0	0	111.4	T27 L28 S33 R39 A42 I46 L75	T27-I31 HydrophobicContact CG2-CD1 4.26Å; T27-I31 WeakPolarHBondContact O-CG1 3.33Å; T27-I31 PolarHBondContact O-N 3.35Å; L28-I31 HydrophobicContact CD2-CD1 4.45Å; L28-I31 PolarHBondContact O-N 3.11Å; I31-S33 VanDerWaalsContact C-N 3.28Å; I31-S33 PolarHBondContact O-N 3.2Å; I31-R39 WeakPolarHBondContact O-CD 3.45Å; I31-R39 VanDerWaalsContact O-CG 3.3Å; I31-R39 WeakPolarHBondContact O-CG 3.46Å; I31-A42 HydrophobicContact CG1-CB 3.63Å; I31-I46 HydrophobicContact CD1-CB 4.38Å; I31-I46 HydrophobicContact CD1-CD1 3.75Å; I31-I46 HydrophobicContact CD1-CG2 4.31Å; I31-L75 HydrophobicContact CB-CD2 3.92Å; I31-L75 HydrophobicContact CG2-CD1 4.49Å; I31-L75 HydrophobicContact CG2-CD2 3.71Å
32	L	93.3	Very high	93.6	Very high	85 Å²	85	66.2 Å²	66.2	45%	0.445	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	3.7	178.1	-62	174.7	0	0	0	113.9	L28 T29 A30 A71 I72 L75	L28-L32 PolarHBondContact O-N 2.94Å; T29-L32 PolarHBondContact O-N 3.12Å; A30-L32 PolarHBondContact O-N 3.04Å; L32-A71 HydrophobicContact CD1-CB 3.8Å; L32-I72 HydrophobicContact CD1-CD1 4.03Å; L32-L75 HydrophobicContact CD1-CD2 4.31Å; L32-L75 HydrophobicContact CD2-CD2 3.99Å; L32-L75 HydrophobicContact CG-CD2 3.87Å
33	S	93.6	Very high	93.7	Very high	25 Å²	25	65.1 Å²	65.1	18%	0.175	36%	0.359	C	S	.	.			trans	-71.4	141.6	179.5	-177.9	0	0	0	0	112.1	A30 I31 V35 R39	A30-S33 WeakPolarHBondContact O-CB 3.4Å; A30-S33 PolarHBondContact O-N 3.22Å; A30-S33 VanDerWaalsContact O-N 3.07Å; I31-S33 VanDerWaalsContact C-N 3.28Å; I31-S33 PolarHBondContact O-N 3.2Å; S33-V35 PolarHBondContact O-N 2.97Å; S33-V35 PolarHBondContact OG-N 3.33Å; S33-R39 WeakPolarHBondContact O-CD 3.47Å; S33-R39 WeakPolarHBondContact O-CG 3.29Å
34	P	92.4	Very high	93.7	Very high	127 Å²	127	69 Å²	69	83%	0.825	37%	0.371	S	S	*	.	S	Bend	trans	-69.1	-13.7	170.6	29.8	-35.5	0	0	0	113
35	V	95.3	Very high	93.7	Very high	76 Å²	76	73.5 Å²	73.5	46%	0.461	39%	0.392	S	S	.	.			trans	-84.4	114.9	-179.3	-176.9	0	0	0	0	110	S33 E37 V38 R39	S33-V35 PolarHBondContact O-N 2.97Å; S33-V35 PolarHBondContact OG-N 3.33Å; V35-E37 VanDerWaalsContact C-N 3.34Å; V35-E37 HydrophobicContact CG1-CB 4.45Å; V35-E37 PolarHBondContact O-N 3.13Å; V35-V38 HydrophobicContact CB-CB 4.16Å; V35-V38 HydrophobicContact CB-CG2 3.9Å; V35-V38 HydrophobicContact CG1-CB 4.41Å; V35-V38 HydrophobicContact CG1-CG2 3.85Å; V35-V38 PolarHBondContact O-N 3.02Å; V35-V38 VanDerWaalsContact O-N 3.14Å; V35-R39 PolarHBondContact O-N 3.19Å; V35-R39 VanDerWaalsContact O-N 3.16Å
36	Q	94.6	Very high	93.8	Very high	149 Å²	149	71.6 Å²	71.6	70%	0.696	38%	0.382	S	S	*	.	H	α-helix	trans	-57.6	-41.4	-177.1	-176.2	178.7	-4.3	0	0	113.5	V38 R39 A40	Q36-V38 VanDerWaalsContact C-N 3.28Å; Q36-V38 PolarHBondContact O-N 2.86Å; Q36-R39 PolarHBondContact O-N 2.92Å; Q36-A40 WeakPolarHBondContact O-CB 3.4Å; Q36-A40 PolarHBondContact O-N 3.36Å
37	E	94.5	Very high	93.7	Very high	165 Å²	165	70 Å²	70	77%	0.771	37%	0.373	S	S	*	.	H	α-helix	trans	-62.1	-36.5	179.2	-64.8	-170.8	163.3	0	0	112.5	V35 A41	V35-E37 VanDerWaalsContact C-N 3.34Å; V35-E37 HydrophobicContact CG1-CB 4.45Å; V35-E37 PolarHBondContact O-N 3.13Å; E37-A41 WeakPolarHBondContact O-CB 3.18Å; E37-A41 PolarHBondContact O-N 3.38Å; E37-A41 VanDerWaalsContact O-N 3.1Å
38	V	93.4	Very high	93.6	Very high	62 Å²	62	74.6 Å²	74.6	38%	0.376	40%	0.401	S	S	.	.	H	α-helix	trans	-69	-41.3	177.3	176.1	0	0	0	0	110.6	A30 V35 Q36 A42	A30-V38 HydrophobicContact CB-CG1 3.66Å; V35-V38 HydrophobicContact CB-CB 4.16Å; V35-V38 HydrophobicContact CB-CG2 3.9Å; V35-V38 HydrophobicContact CG1-CB 4.41Å; V35-V38 HydrophobicContact CG1-CG2 3.85Å; V35-V38 PolarHBondContact O-N 3.02Å; V35-V38 VanDerWaalsContact O-N 3.14Å; Q36-V38 VanDerWaalsContact C-N 3.28Å; Q36-V38 PolarHBondContact O-N 2.86Å; V38-A42 WeakPolarHBondContact O-CB 3.43Å; V38-A42 PolarHBondContact O-N 3.19Å; V38-A42 VanDerWaalsContact O-N 3.09Å
39	R	94.4	Very high	93.5	Very high	106 Å²	106	75.4 Å²	75.4	40%	0.4	41%	0.405	S	S	.	.	H	α-helix	trans	-65.4	-47.3	175.5	-66.3	-167.4	-64.9	-175.4	3.2	112.5	I31 S33 V35 Q36 A41 A42 E43	I31-R39 WeakPolarHBondContact O-CD 3.45Å; I31-R39 VanDerWaalsContact O-CG 3.3Å; I31-R39 WeakPolarHBondContact O-CG 3.46Å; S33-R39 WeakPolarHBondContact O-CD 3.47Å; S33-R39 WeakPolarHBondContact O-CG 3.29Å; V35-R39 PolarHBondContact O-N 3.19Å; V35-R39 VanDerWaalsContact O-N 3.16Å; Q36-R39 PolarHBondContact O-N 2.92Å; R39-A41 VanDerWaalsContact C-N 3.31Å; R39-A41 PolarHBondContact O-N 2.95Å; R39-A42 CarbonylContact O-C 3.54Å; R39-A42 WeakPolarHBondContact O-CB 3.48Å; R39-A42 PolarHBondContact O-N 3.26Å; R39-E43 WeakPolarHBondContact O-CG 3.26Å; R39-E43 PolarHBondContact O-N 2.98Å
40	A	93.1	Very high	93.5	Very high	46 Å²	46	73.7 Å²	73.7	38%	0.38	39%	0.392	S	S	.	.	H	α-helix	trans	-61.2	-40.6	-179.7	0	0	0	0	0	111.7	Q36 A42 E43 E44	Q36-A40 WeakPolarHBondContact O-CB 3.4Å; Q36-A40 PolarHBondContact O-N 3.36Å; A40-A42 VanDerWaalsContact C-N 3.34Å; A40-E43 PolarHBondContact O-N 3.29Å; A40-E44 PolarHBondContact O-N 3.5Å
41	A	93.6	Very high	93.5	Very high	49 Å²	49	76.7 Å²	76.7	41%	0.405	41%	0.408	S	S	.	.	H	α-helix	trans	-63.7	-39.8	173.6	0	0	0	0	0	112.1	E37 R39 E44 Q45	E37-A41 WeakPolarHBondContact O-CB 3.18Å; E37-A41 PolarHBondContact O-N 3.38Å; E37-A41 VanDerWaalsContact O-N 3.1Å; R39-A41 VanDerWaalsContact C-N 3.31Å; R39-A41 PolarHBondContact O-N 2.95Å; A41-E44 PolarHBondContact O-N 3.14Å; A41-Q45 VanDerWaalsContact O-CG 3.28Å; A41-Q45 WeakPolarHBondContact O-CG 3.47Å; A41-Q45 PolarHBondContact O-N 3.44Å
42	A	92.9	Very high	93.4	Very high	1 Å²	1	76.9 Å²	76.9	1%	0.008	41%	0.41	C	S	.	.	H	α-helix	trans	-70.9	-34.3	178.8	0	0	0	0	0	113.1	T27 A30 I31 V38 R39 A40 E44 Q45 I46	T27-A42 HydrophobicContact CG2-CB 3.99Å; T27-A42 VanDerWaalsContact CG2-O 3.22Å; T27-A42 WeakPolarHBondContact CG2-O 3.3Å; A30-A42 HydrophobicContact CB-CB 3.6Å; I31-A42 HydrophobicContact CG1-CB 3.63Å; V38-A42 WeakPolarHBondContact O-CB 3.43Å; V38-A42 PolarHBondContact O-N 3.19Å; V38-A42 VanDerWaalsContact O-N 3.09Å; R39-A42 CarbonylContact O-C 3.54Å; R39-A42 WeakPolarHBondContact O-CB 3.48Å; R39-A42 PolarHBondContact O-N 3.26Å; A40-A42 VanDerWaalsContact C-N 3.34Å; A42-E44 VanDerWaalsContact C-N 3.33Å; A42-Q45 PolarHBondContact O-N 3.3Å; A42-I46 PolarHBondContact O-N 3.39Å
43	E	91.8	Very high	93.2	Very high	103 Å²	103	77.8 Å²	77.8	48%	0.481	41%	0.412	S	S	.	.	H	α-helix	trans	-63.8	-36	172.3	-76	173.6	-171.5	0	0	112.3	R39 A40 I46 K47	R39-E43 WeakPolarHBondContact O-CG 3.26Å; R39-E43 PolarHBondContact O-N 2.98Å; A40-E43 PolarHBondContact O-N 3.29Å; E43-I46 WeakPolarHBondContact O-CG2 3.42Å; E43-K47 WeakPolarHBondContact O-CG 3.25Å; E43-K47 PolarHBondContact O-N 3.48Å
44	E	93	Very high	93.2	Very high	114 Å²	114	78.4 Å²	78.4	53%	0.533	41%	0.412	S	S	.	.	H	α-helix	trans	-73.2	-37.6	172.6	-70	-57.4	132.6	0	0	112.1	A40 A41 A42 K47	A40-E44 PolarHBondContact O-N 3.5Å; A41-E44 PolarHBondContact O-N 3.14Å; A42-E44 VanDerWaalsContact C-N 3.33Å; E44-K47 IonicContact OE1-NZ 3.24Å; E44-K47 PolarHBondContact OE1-NZ 3.36Å; E44-K47 IonicContact OE2-NZ 3.56Å
45	Q	92.8	Very high	93.4	Very high	99 Å²	99	72.6 Å²	72.6	46%	0.463	37%	0.374	S	S	.	.	H	α-helix	trans	-64	-42	175.9	-73.7	170.6	7.3	0	0	112.1	T27 A41 A42 K47 V48 L49	T27-Q45 HydrophobicContact CG2-CB 3.97Å; T27-Q45 PolarHBondContact OG1-OE1 2.98Å; A41-Q45 VanDerWaalsContact O-CG 3.28Å; A41-Q45 WeakPolarHBondContact O-CG 3.47Å; A41-Q45 PolarHBondContact O-N 3.44Å; A42-Q45 PolarHBondContact O-N 3.3Å; Q45-K47 VanDerWaalsContact C-N 3.32Å; Q45-K47 PolarHBondContact O-N 3.05Å; Q45-V48 WeakPolarHBondContact O-CB 3.33Å; Q45-V48 PolarHBondContact O-N 3.16Å; Q45-V48 VanDerWaalsContact O-N 3.09Å; Q45-L49 PolarHBondContact O-N 3.29Å
46	I	94.4	Very high	93.4	Very high	23 Å²	23	69 Å²	69	12%	0.118	35%	0.352	C	S	.	.	H	α-helix	trans	-68.9	-31	-177	-157.7	164.3	0	0	0	112.5	T27 L28 I31 A42 E43 V48 L49 E50 F55 I79	T27-I46 HydrophobicContact CG2-CB 3.88Å; T27-I46 HydrophobicContact CG2-CG1 4.49Å; L28-I46 HydrophobicContact CD2-CD1 3.99Å; I31-I46 HydrophobicContact CD1-CB 4.38Å; I31-I46 HydrophobicContact CD1-CD1 3.75Å; I31-I46 HydrophobicContact CD1-CG2 4.31Å; A42-I46 PolarHBondContact O-N 3.39Å; E43-I46 WeakPolarHBondContact O-CG2 3.42Å; I46-V48 PolarHBondContact O-N 3.06Å; I46-L49 CarbonylContact O-C 3.55Å; I46-L49 PolarHBondContact O-N 3.17Å; I46-L49 VanDerWaalsContact O-N 3.14Å; I46-E50 WeakPolarHBondContact O-CB 3.27Å; I46-E50 PolarHBondContact O-N 3.31Å; I46-F55 HydrophobicContact CD1-CZ 4.35Å; I46-F55 HydrophobicContact CG1-CE2 3.99Å; I46-F55 HydrophobicContact CG1-CZ 3.93Å; I46-I79 HydrophobicContact CD1-CD1 3.65Å; I46-I79 HydrophobicContact CD1-CG2 4.49Å
47	K	91.5	Very high	93.5	Very high	107 Å²	107	62.3 Å²	62.3	47%	0.465	32%	0.322	S	S	.	.	H	α-helix	trans	-60.9	-33.1	171	-70	170.4	-171.4	172.2	0	112.5	E43 E44 Q45	E43-K47 WeakPolarHBondContact O-CG 3.25Å; E43-K47 PolarHBondContact O-N 3.48Å; E44-K47 IonicContact OE1-NZ 3.24Å; E44-K47 PolarHBondContact OE1-NZ 3.36Å; E44-K47 IonicContact OE2-NZ 3.56Å; Q45-K47 VanDerWaalsContact C-N 3.32Å; Q45-K47 PolarHBondContact O-N 3.05Å
48	V	93.4	Very high	93.6	Very high	101 Å²	101	54.8 Å²	54.8	61%	0.612	29%	0.287	S	S	*	.	H	α-helix	trans	-77	-36.5	174.9	-178.7	0	0	0	0	110.8	Q45 I46 E50 V51	Q45-V48 WeakPolarHBondContact O-CB 3.33Å; Q45-V48 PolarHBondContact O-N 3.16Å; Q45-V48 VanDerWaalsContact O-N 3.09Å; I46-V48 PolarHBondContact O-N 3.06Å; V48-E50 VanDerWaalsContact C-N 3.32Å; V48-V51 WeakPolarHBondContact O-CG2 3.22Å
49	L	93.4	Very high	93.8	Very high	17 Å²	17	51.9 Å²	51.9	9%	0.089	27%	0.269	C	S	.	.	H	α-helix	trans	-67.7	-33.1	175.1	-67.6	172.5	0	0	0	112	L20 L24 T27 Q45 I46 V51 T52 F55	L20-L49 HydrophobicContact CD2-CD2 4.39Å; L24-L49 HydrophobicContact CB-CD1 4.33Å; L24-L49 HydrophobicContact CD1-CD1 4Å; T27-L49 HydrophobicContact CG2-CD1 4.41Å; Q45-L49 PolarHBondContact O-N 3.29Å; I46-L49 CarbonylContact O-C 3.55Å; I46-L49 PolarHBondContact O-N 3.17Å; I46-L49 VanDerWaalsContact O-N 3.14Å; L49-V51 PolarHBondContact O-N 3.43Å; L49-V51 VanDerWaalsContact O-N 3.13Å; L49-T52 WeakPolarHBondContact O-CB 3.43Å; L49-T52 WeakPolarHBondContact O-CG2 3.32Å; L49-T52 PolarHBondContact O-N 3.21Å; L49-T52 PolarHBondContact O-OG1 3.29Å; L49-F55 HydrophobicContact CB-CD2 3.79Å; L49-F55 HydrophobicContact CB-CE2 3.77Å; L49-F55 WeakPolarHBondContact O-CB 3.36Å; L49-F55 VanDerWaalsContact O-CD2 3.28Å; L49-F55 WeakPolarHBondContact O-CD2 3.49Å; L49-F55 WeakPolarHBondContact O-CG 3.43Å
50	E	94.1	Very high	93.9	Very high	40 Å²	40	46.8 Å²	46.8	19%	0.187	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-31	179.9	-172.2	176.5	-176.1	0	0	112.9	I46 V48 F55 H87 R96	I46-E50 WeakPolarHBondContact O-CB 3.27Å; I46-E50 PolarHBondContact O-N 3.31Å; V48-E50 VanDerWaalsContact C-N 3.32Å; E50-F55 HydrophobicContact CB-CD1 4.45Å; E50-F55 HydrophobicContact CB-CE1 4.13Å; E50-F55 HydrophobicContact CB-CZ 4.37Å; E50-F55 HydrophobicContact CG-CE1 4.19Å; E50-H87 WeakPolarHBondContact CG-NE2 3.39Å; E50-H87 IonicContact OE1-NE2 2.8Å; E50-H87 PolarHBondContact OE1-NE2 3.08Å; E50-R96 IonicContact OE1-NH1 3.55Å
51	V	92.4	Very high	94	Very high	85 Å²	85	47.3 Å²	47.3	52%	0.515	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	4.5	179	-60.9	0	0	0	0	114.2	V48 L49	V48-V51 WeakPolarHBondContact O-CG2 3.22Å; L49-V51 PolarHBondContact O-N 3.43Å; L49-V51 VanDerWaalsContact O-N 3.13Å
52	T	92.6	Very high	94.1	Very high	34 Å²	34	46 Å²	46	21%	0.209	23%	0.23	C	C	.	.	S	Bend	trans	-82.9	143.3	175.5	66.6	0	0	0	0	111.3	L49 E54 F55	L49-T52 WeakPolarHBondContact O-CB 3.43Å; L49-T52 WeakPolarHBondContact O-CG2 3.32Å; L49-T52 PolarHBondContact O-N 3.21Å; L49-T52 PolarHBondContact O-OG1 3.29Å; T52-E54 VanDerWaalsContact C-N 3.32Å; T52-E54 PolarHBondContact O-N 2.76Å; T52-F55 WeakPolarHBondContact O-CB 3.27Å; T52-F55 PolarHBondContact O-N 2.68Å; T52-F55 WeakPolarHBondContact OG1-CB 3.16Å
53	E	90.4	Very high	94.2	Very high	105 Å²	105	45.9 Å²	45.9	49%	0.491	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-38.2	-173.8	-177.1	173.5	-167.2	0	0	113.6	T101	E53-T101 HydrophobicContact CG-CG2 3.85Å; E53-T101 WeakPolarHBondContact OE1-CB 3.34Å; E53-T101 WeakPolarHBondContact OE1-CG2 3.26Å; E53-T101 PolarHBondContact OE1-OG1 3.46Å
54	E	93.4	Very high	94.3	Very high	37 Å²	37	41.9 Å²	41.9	17%	0.173	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	10.7	-177.8	-65.3	-169.6	152.8	0	0	113.5	Q17 T52 G56 V57 H58	Q17-E54 VanDerWaalsContact CB-OE2 3.3Å; Q17-E54 WeakPolarHBondContact CB-OE2 3.47Å; Q17-E54 WeakPolarHBondContact CG-OE2 3.44Å; Q17-E54 PolarHBondContact NE2-OE1 3.41Å; Q17-E54 PolarHBondContact NE2-OE2 3.1Å; Q17-E54 VanDerWaalsContact NE2-OE2 3.15Å; T52-E54 VanDerWaalsContact C-N 3.32Å; T52-E54 PolarHBondContact O-N 2.76Å; E54-G56 PolarHBondContact O-N 3.43Å; E54-V57 HydrophobicContact CB-CB 4.23Å; E54-V57 HydrophobicContact CB-CG2 4.43Å; E54-V57 WeakPolarHBondContact O-CB 3.34Å; E54-V57 PolarHBondContact O-N 2.63Å; E54-H58 PolarHBondContact O-CD2 3.1Å; E54-H58 PolarHBondContact O-N 2.97Å; E54-H58 IonicContact OE2-CE1 3.07Å; E54-H58 IonicContact OE2-NE2 2.8Å
55	F	95.5	Very high	94.3	Very high	5 Å²	5	40 Å²	40	2%	0.022	21%	0.206	C	C	.	.	H	α-helix	trans	-54	-53.8	-179.9	-177.7	-115.6	0	0	0	112	L24 I46 L49 E50 T52 V57 H58 L59 I79 Y83	L24-F55 HydrophobicContact CD1-CD2 4.26Å; L24-F55 HydrophobicContact CD1-CE2 3.72Å; I46-F55 HydrophobicContact CD1-CZ 4.35Å; I46-F55 HydrophobicContact CG1-CE2 3.99Å; I46-F55 HydrophobicContact CG1-CZ 3.93Å; L49-F55 HydrophobicContact CB-CD2 3.79Å; L49-F55 HydrophobicContact CB-CE2 3.77Å; L49-F55 WeakPolarHBondContact O-CB 3.36Å; L49-F55 VanDerWaalsContact O-CD2 3.28Å; L49-F55 WeakPolarHBondContact O-CD2 3.49Å; L49-F55 WeakPolarHBondContact O-CG 3.43Å; E50-F55 HydrophobicContact CB-CD1 4.45Å; E50-F55 HydrophobicContact CB-CE1 4.13Å; E50-F55 HydrophobicContact CB-CZ 4.37Å; E50-F55 HydrophobicContact CG-CE1 4.19Å; T52-F55 WeakPolarHBondContact O-CB 3.27Å; T52-F55 PolarHBondContact O-N 2.68Å; T52-F55 WeakPolarHBondContact OG1-CB 3.16Å; F55-V57 VanDerWaalsContact C-N 3.3Å; F55-V57 PolarHBondContact O-N 3.44Å; F55-H58 PolarHBondContact O-N 3.46Å; F55-L59 HydrophobicContact CD1-CD1 3.75Å; F55-L59 HydrophobicContact CD2-CD1 4.42Å; F55-L59 HydrophobicContact CE1-CD1 3.43Å; F55-L59 VanDerWaalsContact CE1-CD1 3.43Å; F55-L59 HydrophobicContact CE2-CD1 4.14Å; F55-L59 HydrophobicContact CE2-CG 4.49Å; F55-L59 HydrophobicContact CG-CD1 4.26Å; F55-L59 HydrophobicContact CZ-CD1 3.66Å; F55-L59 HydrophobicContact CZ-CG 4.44Å; F55-L59 WeakPolarHBondContact O-CB 3.24Å; F55-L59 VanDerWaalsContact O-CG 3.3Å; F55-L59 WeakPolarHBondContact O-CG 3.38Å; F55-L59 PolarHBondContact O-N 3.11Å; F55-I79 HydrophobicContact CE1-CG2 4.11Å; F55-I79 HydrophobicContact CZ-CG2 3.87Å; F55-Y83 HydrophobicContact CB-CE2 4.48Å; F55-Y83 AromaticContact CD1-CD2 3.47Å; F55-Y83 HydrophobicContact CD1-CD2 3.47Å; F55-Y83 VanDerWaalsContact CD1-CD2 3.47Å; F55-Y83 AromaticContact CD1-CE2 3.78Å; F55-Y83 HydrophobicContact CD1-CE2 3.78Å; F55-Y83 HydrophobicContact CD1-CG 4.21Å; F55-Y83 AromaticContact CE1-CD2 3.94Å; F55-Y83 HydrophobicContact CE1-CD2 3.94Å
56	G	96	Very high	94.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.7	-34.1	176	0	0	0	0	0	113.4	E54 L59 A60	E54-G56 PolarHBondContact O-N 3.43Å; G56-L59 PolarHBondContact O-N 2.8Å; G56-A60 WeakPolarHBondContact O-CB 3.2Å; G56-A60 PolarHBondContact O-N 3.01Å
57	V	96.8	Very high	93.9	Very high	10 Å²	10	46.3 Å²	46.3	6%	0.061	24%	0.242	C	C	.	.	H	α-helix	trans	-65.7	-49.5	178.6	-177.4	0	0	0	0	110.1	E54 F55 L59 A60 E61 A104 A107 I108 L111	E54-V57 HydrophobicContact CB-CB 4.23Å; E54-V57 HydrophobicContact CB-CG2 4.43Å; E54-V57 WeakPolarHBondContact O-CB 3.34Å; E54-V57 PolarHBondContact O-N 2.63Å; F55-V57 VanDerWaalsContact C-N 3.3Å; F55-V57 PolarHBondContact O-N 3.44Å; V57-L59 PolarHBondContact O-N 3.48Å; V57-A60 WeakPolarHBondContact O-CB 3.48Å; V57-A60 PolarHBondContact O-N 3.13Å; V57-A60 VanDerWaalsContact O-N 3.17Å; V57-E61 WeakPolarHBondContact O-CG 3.41Å; V57-E61 PolarHBondContact O-N 3.44Å; V57-A104 HydrophobicContact CG2-CB 3.76Å; V57-A107 HydrophobicContact CG1-CB 4.14Å; V57-A107 HydrophobicContact CG2-CB 4.24Å; V57-I108 HydrophobicContact CB-CG1 4.48Å; V57-I108 HydrophobicContact CG2-CD1 4.2Å; V57-I108 HydrophobicContact CG2-CG1 4.02Å; V57-L111 HydrophobicContact CG1-CD1 4.16Å
58	H	96.5	Very high	93.8	Very high	7 Å²	7	42.6 Å²	42.6	3%	0.032	23%	0.234	C	C	.	.	H	α-helix	trans	-66.6	-37.1	178.5	-63.4	-30.1	0	0	0	112.3	Q17 K21 L24 E54 F55 A60 E61 L62	Q17-H58 PolarHBondContact O-NE2 3.2Å; K21-H58 HydrophobicContact CG-CB 4.32Å; L24-H58 HydrophobicContact CD2-CB 3.65Å; E54-H58 PolarHBondContact O-CD2 3.1Å; E54-H58 PolarHBondContact O-N 2.97Å; E54-H58 IonicContact OE2-CE1 3.07Å; E54-H58 IonicContact OE2-NE2 2.8Å; F55-H58 PolarHBondContact O-N 3.46Å; H58-A60 VanDerWaalsContact C-N 3.32Å; H58-A60 PolarHBondContact O-N 3.22Å; H58-E61 IonicContact ND1-OE2 3.25Å; H58-E61 PolarHBondContact ND1-OE2 3.35Å; H58-E61 PolarHBondContact O-N 3.07Å; H58-L62 WeakPolarHBondContact O-CB 3.46Å; H58-L62 VanDerWaalsContact O-CG 3.24Å; H58-L62 WeakPolarHBondContact O-CG 3.22Å; H58-L62 PolarHBondContact O-N 3.2Å
59	L	97	Very high	93.7	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.4	-41.5	171.5	-73.8	172	0	0	0	111.7	L24 L28 F55 G56 V57 T63 A76 I79 L80	L24-L59 HydrophobicContact CD1-CD2 4.4Å; L24-L59 HydrophobicContact CD2-CD2 4.05Å; L24-L59 HydrophobicContact CD2-CG 4.1Å; L28-L59 HydrophobicContact CD1-CD2 4.49Å; F55-L59 HydrophobicContact CD1-CD1 3.75Å; F55-L59 HydrophobicContact CD2-CD1 4.42Å; F55-L59 HydrophobicContact CE1-CD1 3.43Å; F55-L59 VanDerWaalsContact CE1-CD1 3.43Å; F55-L59 HydrophobicContact CE2-CD1 4.14Å; F55-L59 HydrophobicContact CE2-CG 4.49Å; F55-L59 HydrophobicContact CG-CD1 4.26Å; F55-L59 HydrophobicContact CZ-CD1 3.66Å; F55-L59 HydrophobicContact CZ-CG 4.44Å; F55-L59 WeakPolarHBondContact O-CB 3.24Å; F55-L59 VanDerWaalsContact O-CG 3.3Å; F55-L59 WeakPolarHBondContact O-CG 3.38Å; F55-L59 PolarHBondContact O-N 3.11Å; G56-L59 PolarHBondContact O-N 2.8Å; V57-L59 PolarHBondContact O-N 3.48Å; L59-T63 VanDerWaalsContact O-CB 3.3Å; L59-T63 WeakPolarHBondContact O-CB 3.4Å; L59-T63 PolarHBondContact O-N 3.33Å; L59-T63 PolarHBondContact O-OG1 2.97Å; L59-A76 HydrophobicContact CD2-CB 4.06Å; L59-I79 HydrophobicContact CD1-CB 4.33Å; L59-I79 HydrophobicContact CD1-CG2 3.71Å; L59-I79 HydrophobicContact CD2-CB 4.23Å; L59-I79 HydrophobicContact CD2-CG2 4.2Å; L59-L80 HydrophobicContact CB-CB 4.12Å; L59-L80 HydrophobicContact CB-CD1 3.99Å
60	A	96.8	Very high	93.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-63.1	-46.9	174.9	0	0	0	0	0	111.8	G56 V57 H58 L62 T63 V64 L80 I108 L111 L112	G56-A60 WeakPolarHBondContact O-CB 3.2Å; G56-A60 PolarHBondContact O-N 3.01Å; V57-A60 WeakPolarHBondContact O-CB 3.48Å; V57-A60 PolarHBondContact O-N 3.13Å; V57-A60 VanDerWaalsContact O-N 3.17Å; H58-A60 VanDerWaalsContact C-N 3.32Å; H58-A60 PolarHBondContact O-N 3.22Å; A60-L62 PolarHBondContact O-N 2.66Å; A60-T63 PolarHBondContact O-N 3.46Å; A60-V64 WeakPolarHBondContact O-CB 3.29Å; A60-V64 VanDerWaalsContact O-CG2 3.24Å; A60-V64 WeakPolarHBondContact O-CG2 3.43Å; A60-V64 PolarHBondContact O-N 3.18Å; A60-L80 HydrophobicContact CB-CD1 4.41Å; A60-L80 HydrophobicContact CB-CD2 4.11Å; A60-I108 HydrophobicContact CB-CG1 4.32Å; A60-I108 HydrophobicContact CB-CG2 4.44Å; A60-L111 HydrophobicContact CB-CB 4.48Å; A60-L111 HydrophobicContact CB-CD1 4.25Å; A60-L112 HydrophobicContact CB-CD2 4.08Å; A60-L112 HydrophobicContact CB-CG 4.43Å
61	E	96.1	Very high	93.4	Very high	56 Å²	56	45.5 Å²	45.5	26%	0.262	27%	0.265	S	S	.	.	H	α-helix	trans	-59.4	-47.4	176.9	-68.9	177.1	148.8	0	0	112.3	K21 V57 H58 T63 V64 D65 L111	K21-E61 WeakPolarHBondContact CD-OE2 3.45Å; K21-E61 VanDerWaalsContact CE-OE2 3.29Å; K21-E61 WeakPolarHBondContact CE-OE2 3.47Å; K21-E61 IonicContact NZ-OE2 2.68Å; K21-E61 PolarHBondContact NZ-OE2 3Å; V57-E61 WeakPolarHBondContact O-CG 3.41Å; V57-E61 PolarHBondContact O-N 3.44Å; H58-E61 IonicContact ND1-OE2 3.25Å; H58-E61 PolarHBondContact ND1-OE2 3.35Å; H58-E61 PolarHBondContact O-N 3.07Å; E61-T63 VanDerWaalsContact C-N 3.28Å; E61-T63 PolarHBondContact O-N 3.14Å; E61-V64 PolarHBondContact O-N 2.91Å; E61-D65 WeakPolarHBondContact O-CB 3.5Å; E61-D65 PolarHBondContact O-N 2.99Å; E61-L111 HydrophobicContact CG-CD1 3.71Å; E61-L111 HydrophobicContact CG-CD2 4.37Å
62	L	95.2	Very high	93.5	Very high	21 Å²	21	42.5 Å²	42.5	11%	0.11	25%	0.246	C	C	.	.	H	α-helix	trans	-63.5	-35.8	178.3	-70.7	173.7	0	0	0	112	L24 I25 L28 H58 A60 R73 A76	L24-L62 HydrophobicContact CD2-CD1 3.87Å; L24-L62 HydrophobicContact CG-CD1 4.11Å; I25-L62 HydrophobicContact CD1-CD2 3.86Å; I25-L62 HydrophobicContact CG1-CD1 4.03Å; I25-L62 HydrophobicContact CG1-CD2 3.63Å; I25-L62 HydrophobicContact CG1-CG 4.47Å; L28-L62 HydrophobicContact CD1-CD1 3.81Å; H58-L62 WeakPolarHBondContact O-CB 3.46Å; H58-L62 VanDerWaalsContact O-CG 3.24Å; H58-L62 WeakPolarHBondContact O-CG 3.22Å; H58-L62 PolarHBondContact O-N 3.2Å; A60-L62 PolarHBondContact O-N 2.66Å; L62-R73 WeakPolarHBondContact O-CG 3.44Å; L62-A76 HydrophobicContact CB-CB 3.99Å
63	T	95	Very high	93.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-69.6	-45.4	177.8	-61	0	0	0	0	111.5	L59 A60 E61 R73 S77 V123 V127	L59-T63 VanDerWaalsContact O-CB 3.3Å; L59-T63 WeakPolarHBondContact O-CB 3.4Å; L59-T63 PolarHBondContact O-N 3.33Å; L59-T63 PolarHBondContact O-OG1 2.97Å; A60-T63 PolarHBondContact O-N 3.46Å; E61-T63 VanDerWaalsContact C-N 3.28Å; E61-T63 PolarHBondContact O-N 3.14Å; T63-R73 PolarHBondContact O-NE 2.91Å; T63-R73 PolarHBondContact O-NH2 3.5Å; T63-S77 VanDerWaalsContact CG2-CB 3.48Å; T63-S77 WeakPolarHBondContact OG1-CA 3.22Å; T63-S77 PolarHBondContact OG1-N 3.37Å; T63-V123 HydrophobicContact CG2-CG1 3.99Å; T63-V127 HydrophobicContact CG2-CG2 3.58Å
64	V	93.9	Very high	93.5	Very high	18 Å²	18	38.6 Å²	38.6	11%	0.109	23%	0.225	C	C	.	.	H	α-helix	trans	-79.8	-27.8	-171.2	171.9	0	0	0	0	112.9	A60 E61 P66 L112 S114	A60-V64 WeakPolarHBondContact O-CB 3.29Å; A60-V64 VanDerWaalsContact O-CG2 3.24Å; A60-V64 WeakPolarHBondContact O-CG2 3.43Å; A60-V64 PolarHBondContact O-N 3.18Å; E61-V64 PolarHBondContact O-N 2.91Å; V64-P66 VanDerWaalsContact O-CD 3.23Å; V64-P66 WeakPolarHBondContact O-CD 3.39Å; V64-P66 VanDerWaalsContact O-N 3.11Å; V64-L112 HydrophobicContact CG2-CD2 4.22Å; V64-S114 WeakPolarHBondContact CG1-OG 3.37Å
65	D	92.4	Very high	93.5	Very high	76 Å²	76	38.4 Å²	38.4	41%	0.406	23%	0.225	S	C	.	.			trans	-60.3	111.5	-179.4	178.8	9.8	0	0	0	112.3	E61 Q67 G68 R73	E61-D65 WeakPolarHBondContact O-CB 3.5Å; E61-D65 PolarHBondContact O-N 2.99Å; D65-Q67 PolarHBondContact O-N 3.19Å; D65-Q67 PolarHBondContact OD1-N 3.33Å; D65-G68 PolarHBondContact O-N 2.69Å; D65-R73 WeakPolarHBondContact O-CD 3.35Å; D65-R73 PolarHBondContact O-NE 3.29Å
66	P	88.4	Confident	93.5	Very high	84 Å²	84	38.2 Å²	38.2	55%	0.545	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-18.3	-176.7	28.6	-35.1	0	0	0	113.3	V64	V64-P66 VanDerWaalsContact O-CD 3.23Å; V64-P66 WeakPolarHBondContact O-CD 3.39Å; V64-P66 VanDerWaalsContact O-N 3.11Å
67	Q	90.6	Very high	93.5	Very high	169 Å²	169	38.2 Å²	38.2	79%	0.79	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-6.7	-179	-57.2	-57	-49	0	0	113.4	D65	D65-Q67 PolarHBondContact O-N 3.19Å; D65-Q67 PolarHBondContact OD1-N 3.33Å
68	G	89.5	Confident	93.3	Very high	29 Å²	29	40.9 Å²	40.9	30%	0.299	24%	0.24	S	C	.	.	S	Bend	trans	-69.8	154.1	-179.3	0	0	0	0	0	114	D65 L70 R73	D65-G68 PolarHBondContact O-N 2.69Å; G68-L70 PolarHBondContact O-N 3.24Å; G68-R73 VanDerWaalsContact O-CD 3.31Å; G68-R73 WeakPolarHBondContact O-CD 3.29Å
69	A	91	Very high	93.3	Very high	68 Å²	68	41.7 Å²	41.7	56%	0.562	25%	0.245	S	C	*	.			trans	-64.4	125.1	175.9	0	0	0	0	0	111.2	A71 I72 R73	A69-A71 VanDerWaalsContact C-N 3.25Å; A69-A71 PolarHBondContact O-N 3.08Å; A69-A71 VanDerWaalsContact O-N 3.09Å; A69-I72 HydrophobicContact CB-CG1 4.41Å; A69-I72 PolarHBondContact O-N 3.34Å; A69-R73 WeakPolarHBondContact O-CG 3.35Å; A69-R73 PolarHBondContact O-N 3.01Å
70	L	90.4	Very high	93.3	Very high	92 Å²	92	41.8 Å²	41.8	48%	0.482	25%	0.245	S	C	.	.	H	α-helix	trans	-49.4	-42.1	-175.1	176.1	55.9	0	0	0	113.8	G68 I72 R73 Q74 I120 V123	G68-L70 PolarHBondContact O-N 3.24Å; L70-I72 VanDerWaalsContact C-N 3.31Å; L70-I72 PolarHBondContact O-N 3.32Å; L70-R73 PolarHBondContact O-N 3.27Å; L70-Q74 VanDerWaalsContact O-CB 3.29Å; L70-Q74 WeakPolarHBondContact O-CB 3.49Å; L70-Q74 PolarHBondContact O-N 3.27Å; L70-I120 HydrophobicContact CD1-CD1 3.74Å; L70-I120 HydrophobicContact CD1-CG2 4.03Å; L70-V123 HydrophobicContact CD1-CG2 4.13Å
71	A	91.8	Very high	93.2	Very high	59 Å²	59	44.4 Å²	44.4	49%	0.488	26%	0.256	S	S	.	.	H	α-helix	trans	-62.1	-39.1	-179.1	0	0	0	0	0	112.4	L32 A69 L75	L32-A71 HydrophobicContact CD1-CB 3.8Å; A69-A71 VanDerWaalsContact C-N 3.25Å; A69-A71 PolarHBondContact O-N 3.08Å; A69-A71 VanDerWaalsContact O-N 3.09Å; A71-L75 WeakPolarHBondContact O-CB 3.4Å; A71-L75 PolarHBondContact O-N 2.83Å; A71-L75 VanDerWaalsContact O-N 3.14Å
72	I	93.3	Very high	93.2	Very high	23 Å²	23	46 Å²	46	12%	0.118	26%	0.263	C	S	.	.	H	α-helix	trans	-72.3	-44.2	175.7	-60.1	-62.6	0	0	0	110.5	L28 T29 L32 A69 L70 Q74 L75 A76	L28-I72 HydrophobicContact CB-CD1 4Å; L28-I72 HydrophobicContact CB-CG2 4.5Å; L28-I72 HydrophobicContact CD1-CG2 4.09Å; T29-I72 WeakPolarHBondContact OG1-CD1 3.34Å; L32-I72 HydrophobicContact CD1-CD1 4.03Å; A69-I72 HydrophobicContact CB-CG1 4.41Å; A69-I72 PolarHBondContact O-N 3.34Å; L70-I72 VanDerWaalsContact C-N 3.31Å; L70-I72 PolarHBondContact O-N 3.32Å; I72-Q74 VanDerWaalsContact C-N 3.3Å; I72-Q74 PolarHBondContact O-N 2.95Å; I72-L75 PolarHBondContact O-N 3.43Å; I72-A76 WeakPolarHBondContact O-CB 3.32Å; I72-A76 PolarHBondContact O-N 2.98Å
73	R	94.1	Very high	93.3	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.015	26%	0.26	C	S	.	.	H	α-helix	trans	-58.7	-43.1	177.6	-61.8	-173.6	64.3	-167.6	3.8	111.9	L62 T63 D65 G68 A69 L70 S77 E118 V123	L62-R73 WeakPolarHBondContact O-CG 3.44Å; T63-R73 PolarHBondContact O-NE 2.91Å; T63-R73 PolarHBondContact O-NH2 3.5Å; D65-R73 WeakPolarHBondContact O-CD 3.35Å; D65-R73 PolarHBondContact O-NE 3.29Å; G68-R73 VanDerWaalsContact O-CD 3.31Å; G68-R73 WeakPolarHBondContact O-CD 3.29Å; A69-R73 WeakPolarHBondContact O-CG 3.35Å; A69-R73 PolarHBondContact O-N 3.01Å; L70-R73 PolarHBondContact O-N 3.27Å; R73-S77 VanDerWaalsContact O-CB 3.28Å; R73-S77 WeakPolarHBondContact O-CB 3.33Å; R73-S77 PolarHBondContact O-N 2.86Å; R73-S77 PolarHBondContact O-OG 3.41Å; R73-E118 IonicContact CZ-OE2 3.41Å; R73-E118 IonicContact NH1-OE1 2.91Å; R73-E118 IonicContact NH1-OE2 2.78Å; R73-E118 PolarHBondContact NH1-OE2 3.14Å; R73-E118 IonicContact NH2-OE2 2.68Å; R73-E118 PolarHBondContact NH2-OE2 3.01Å; R73-V123 HydrophobicContact CB-CG2 4.39Å
74	Q	90.5	Very high	93.4	Very high	53 Å²	53	45.3 Å²	45.3	25%	0.248	26%	0.26	C	S	.	.	H	α-helix	trans	-67.5	-43	178.8	-173.6	66.1	44.3	0	0	112	L70 I72 S77 V78 K122	L70-Q74 VanDerWaalsContact O-CB 3.29Å; L70-Q74 WeakPolarHBondContact O-CB 3.49Å; L70-Q74 PolarHBondContact O-N 3.27Å; I72-Q74 VanDerWaalsContact C-N 3.3Å; I72-Q74 PolarHBondContact O-N 2.95Å; Q74-S77 PolarHBondContact O-N 3.11Å; Q74-S77 PolarHBondContact O-OG 3.18Å; Q74-V78 VanDerWaalsContact O-CG2 3.3Å; Q74-V78 WeakPolarHBondContact O-CG2 3.47Å; Q74-V78 PolarHBondContact O-N 3.01Å; Q74-V78 VanDerWaalsContact O-N 3.15Å; Q74-K122 VanDerWaalsContact OE1-CB 3.28Å
75	L	93.4	Very high	93.5	Very high	33 Å²	33	47.7 Å²	47.7	17%	0.173	27%	0.27	C	S	.	.	H	α-helix	trans	-68.6	-44.1	177.6	-176.3	61.9	0	0	0	111.1	L28 I31 L32 A71 I72 S77 V78 I79	L28-L75 HydrophobicContact CB-CD2 4.24Å; L28-L75 HydrophobicContact CD2-CD2 3.79Å; L28-L75 HydrophobicContact CD2-CG 3.94Å; I31-L75 HydrophobicContact CB-CD2 3.92Å; I31-L75 HydrophobicContact CG2-CD1 4.49Å; I31-L75 HydrophobicContact CG2-CD2 3.71Å; L32-L75 HydrophobicContact CD1-CD2 4.31Å; L32-L75 HydrophobicContact CD2-CD2 3.99Å; L32-L75 HydrophobicContact CG-CD2 3.87Å; A71-L75 WeakPolarHBondContact O-CB 3.4Å; A71-L75 PolarHBondContact O-N 2.83Å; A71-L75 VanDerWaalsContact O-N 3.14Å; I72-L75 PolarHBondContact O-N 3.43Å; L75-S77 VanDerWaalsContact C-N 3.3Å; L75-S77 PolarHBondContact O-N 3.29Å; L75-V78 PolarHBondContact O-N 3.45Å; L75-I79 HydrophobicContact CD1-CD1 4Å; L75-I79 HydrophobicContact CD1-CG1 4.45Å; L75-I79 HydrophobicContact CG-CD1 3.82Å; L75-I79 WeakPolarHBondContact O-CD1 2.91Å; L75-I79 WeakPolarHBondContact O-CG1 3.26Å; L75-I79 PolarHBondContact O-N 2.82Å
76	A	95.7	Very high	93.7	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-58.4	-42.2	175.1	0	0	0	0	0	111.4	L28 L59 L62 I72 V78 I79 L80	L28-A76 HydrophobicContact CD1-CB 4.04Å; L59-A76 HydrophobicContact CD2-CB 4.06Å; L62-A76 HydrophobicContact CB-CB 3.99Å; I72-A76 WeakPolarHBondContact O-CB 3.32Å; I72-A76 PolarHBondContact O-N 2.98Å; A76-V78 PolarHBondContact O-N 3.36Å; A76-I79 PolarHBondContact O-N 3.17Å; A76-L80 VanDerWaalsContact O-CB 3.23Å; A76-L80 WeakPolarHBondContact O-CB 3.49Å; A76-L80 PolarHBondContact O-N 3.45Å
77	S	94.3	Very high	94.1	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.007	23%	0.227	C	C	.	.	H	α-helix	trans	-67.6	-35.3	179.6	76.7	0	0	0	0	112.8	T63 R73 Q74 L75 K81 S126	T63-S77 VanDerWaalsContact CG2-CB 3.48Å; T63-S77 WeakPolarHBondContact OG1-CA 3.22Å; T63-S77 PolarHBondContact OG1-N 3.37Å; R73-S77 VanDerWaalsContact O-CB 3.28Å; R73-S77 WeakPolarHBondContact O-CB 3.33Å; R73-S77 PolarHBondContact O-N 2.86Å; R73-S77 PolarHBondContact O-OG 3.41Å; Q74-S77 PolarHBondContact O-N 3.11Å; Q74-S77 PolarHBondContact O-OG 3.18Å; L75-S77 VanDerWaalsContact C-N 3.3Å; L75-S77 PolarHBondContact O-N 3.29Å; S77-K81 WeakPolarHBondContact O-CG 3.42Å; S77-K81 PolarHBondContact O-N 3.25Å; S77-S126 WeakPolarHBondContact OG-CB 3.28Å; S77-S126 PolarHBondContact OG-OG 3.5Å
78	V	94.3	Very high	94.5	Very high	65 Å²	65	32.4 Å²	32.4	39%	0.394	19%	0.189	S	C	.	.	H	α-helix	trans	-66.7	-46	175.6	171.3	0	0	0	0	110.7	Q74 L75 A76 L80 K81 Q82	Q74-V78 VanDerWaalsContact O-CG2 3.3Å; Q74-V78 WeakPolarHBondContact O-CG2 3.47Å; Q74-V78 PolarHBondContact O-N 3.01Å; Q74-V78 VanDerWaalsContact O-N 3.15Å; L75-V78 PolarHBondContact O-N 3.45Å; A76-V78 PolarHBondContact O-N 3.36Å; V78-L80 VanDerWaalsContact C-N 3.32Å; V78-L80 PolarHBondContact O-N 3.42Å; V78-K81 PolarHBondContact O-N 2.85Å; V78-Q82 PolarHBondContact O-N 3.16Å
79	I	95.9	Very high	94.8	Very high	25 Å²	25	31.7 Å²	31.7	13%	0.128	18%	0.179	C	C	.	.	H	α-helix	trans	-68.4	-35.4	179.2	-60.8	161.9	0	0	0	110.5	L28 I46 F55 L59 L75 A76 K81 Q82 Y83	L28-I79 HydrophobicContact CD2-CD1 3.43Å; L28-I79 VanDerWaalsContact CD2-CD1 3.43Å; I46-I79 HydrophobicContact CD1-CD1 3.65Å; I46-I79 HydrophobicContact CD1-CG2 4.49Å; F55-I79 HydrophobicContact CE1-CG2 4.11Å; F55-I79 HydrophobicContact CZ-CG2 3.87Å; L59-I79 HydrophobicContact CD1-CB 4.33Å; L59-I79 HydrophobicContact CD1-CG2 3.71Å; L59-I79 HydrophobicContact CD2-CB 4.23Å; L59-I79 HydrophobicContact CD2-CG2 4.2Å; L75-I79 HydrophobicContact CD1-CD1 4Å; L75-I79 HydrophobicContact CD1-CG1 4.45Å; L75-I79 HydrophobicContact CG-CD1 3.82Å; L75-I79 WeakPolarHBondContact O-CD1 2.91Å; L75-I79 WeakPolarHBondContact O-CG1 3.26Å; L75-I79 PolarHBondContact O-N 2.82Å; A76-I79 PolarHBondContact O-N 3.17Å; I79-K81 PolarHBondContact O-N 3.35Å; I79-Q82 PolarHBondContact O-N 2.81Å; I79-Y83 VanDerWaalsContact O-CB 3.32Å; I79-Y83 WeakPolarHBondContact O-CB 3.26Å; I79-Y83 PolarHBondContact O-N 2.73Å
80	L	97.2	Very high	95	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-60.6	-44	175.1	-178.9	59.9	0	0	0	112.1	L59 A60 A76 V78 Y83 V84 L112	L59-L80 HydrophobicContact CB-CB 4.12Å; L59-L80 HydrophobicContact CB-CD1 3.99Å; A60-L80 HydrophobicContact CB-CD1 4.41Å; A60-L80 HydrophobicContact CB-CD2 4.11Å; A76-L80 VanDerWaalsContact O-CB 3.23Å; A76-L80 WeakPolarHBondContact O-CB 3.49Å; A76-L80 PolarHBondContact O-N 3.45Å; V78-L80 VanDerWaalsContact C-N 3.32Å; V78-L80 PolarHBondContact O-N 3.42Å; L80-Y83 PolarHBondContact O-N 2.8Å; L80-V84 HydrophobicContact CD1-CG2 4.39Å; L80-V84 WeakPolarHBondContact O-CG2 3.41Å; L80-V84 PolarHBondContact O-N 2.88Å; L80-L112 HydrophobicContact CD2-CD2 3.66Å
81	K	95.2	Very high	95.2	Very high	56 Å²	56	34.1 Å²	34.1	24%	0.243	18%	0.183	C	C	.	.	H	α-helix	trans	-58	-51.1	175.8	-70.6	-173.6	-63.1	167	0	110.9	S77 V78 I79 Y83 V84 E85 Y129 A130	S77-K81 WeakPolarHBondContact O-CG 3.42Å; S77-K81 PolarHBondContact O-N 3.25Å; V78-K81 PolarHBondContact O-N 2.85Å; I79-K81 PolarHBondContact O-N 3.35Å; K81-Y83 VanDerWaalsContact C-N 3.3Å; K81-Y83 PolarHBondContact O-N 3.4Å; K81-V84 PolarHBondContact O-N 3Å; K81-E85 WeakPolarHBondContact O-CG 3.43Å; K81-E85 PolarHBondContact O-N 3.46Å; K81-Y129 HydrophobicContact CB-CD1 3.93Å; K81-Y129 HydrophobicContact CB-CE1 4.16Å; K81-Y129 HydrophobicContact CD-CD1 3.42Å; K81-Y129 VanDerWaalsContact CD-CD1 3.42Å; K81-Y129 HydrophobicContact CD-CE1 4.14Å; K81-Y129 HydrophobicContact CD-CG 3.7Å; K81-Y129 HydrophobicContact CG-CD1 3.6Å; K81-Y129 HydrophobicContact CG-CE1 4.32Å; K81-Y129 HydrophobicContact CG-CG 4.28Å; K81-A130 HydrophobicContact CG-CB 4.5Å
82	Q	95.2	Very high	95.3	Very high	88 Å²	88	32.3 Å²	32.3	41%	0.411	17%	0.167	S	C	.	.	H	α-helix	trans	-59.6	-43.1	178.3	-177.1	173.3	14.8	0	0	111.4	V78 I79 V84 E85 T86	V78-Q82 PolarHBondContact O-N 3.16Å; I79-Q82 PolarHBondContact O-N 2.81Å; Q82-V84 PolarHBondContact O-N 3.43Å; Q82-E85 PolarHBondContact O-N 3.01Å; Q82-T86 PolarHBondContact O-N 3.25Å; Q82-T86 PolarHBondContact O-OG1 2.98Å
83	Y	97.2	Very high	95.3	Very high	7 Å²	7	40.5 Å²	40.5	3%	0.027	21%	0.205	C	C	.	.	H	α-helix	trans	-59.6	-44.9	177.6	174.2	-92.4	0	0	0	111.9	F55 I79 L80 K81 T86 H87 T100 I108	F55-Y83 HydrophobicContact CB-CE2 4.48Å; F55-Y83 AromaticContact CD1-CD2 3.47Å; F55-Y83 HydrophobicContact CD1-CD2 3.47Å; F55-Y83 VanDerWaalsContact CD1-CD2 3.47Å; F55-Y83 AromaticContact CD1-CE2 3.78Å; F55-Y83 HydrophobicContact CD1-CE2 3.78Å; F55-Y83 HydrophobicContact CD1-CG 4.21Å; F55-Y83 AromaticContact CE1-CD2 3.94Å; F55-Y83 HydrophobicContact CE1-CD2 3.94Å; I79-Y83 VanDerWaalsContact O-CB 3.32Å; I79-Y83 WeakPolarHBondContact O-CB 3.26Å; I79-Y83 PolarHBondContact O-N 2.73Å; L80-Y83 PolarHBondContact O-N 2.8Å; K81-Y83 VanDerWaalsContact C-N 3.3Å; K81-Y83 PolarHBondContact O-N 3.4Å; Y83-T86 PolarHBondContact O-N 3.34Å; Y83-H87 HydrophobicContact CD2-CB 3.93Å; Y83-H87 AromaticContact CD2-CD2 3.43Å; Y83-H87 VanDerWaalsContact CD2-CD2 3.43Å; Y83-H87 WeakPolarHBondContact CD2-CD2 3.26Å; Y83-H87 AromaticContact CD2-CG 3.72Å; Y83-H87 HydrophobicContact CE1-CB 4.26Å; Y83-H87 HydrophobicContact CE2-CB 3.61Å; Y83-H87 AromaticContact CE2-CD2 3.78Å; Y83-H87 AromaticContact CE2-CG 3.58Å; Y83-H87 HydrophobicContact CG-CB 4.43Å; Y83-H87 WeakPolarHBondContact O-CA 3.17Å; Y83-H87 VanDerWaalsContact O-CB 3.28Å; Y83-H87 WeakPolarHBondContact O-CB 3.33Å; Y83-H87 PolarHBondContact O-N 3.1Å; Y83-T100 HydrophobicContact CE1-CG2 4.28Å; Y83-T100 WeakPolarHBondContact CE1-OG1 3.47Å; Y83-T100 PolarHBondContact OH-OG1 3.5Å; Y83-I108 HydrophobicContact CE1-CD1 4.49Å
84	V	97.1	Very high	95.3	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-62	-45.7	176.7	170.9	0	0	0	0	110.6	L80 K81 Q82 T86 W88 A130 A133 I134	L80-V84 HydrophobicContact CD1-CG2 4.39Å; L80-V84 WeakPolarHBondContact O-CG2 3.41Å; L80-V84 PolarHBondContact O-N 2.88Å; K81-V84 PolarHBondContact O-N 3Å; Q82-V84 PolarHBondContact O-N 3.43Å; V84-T86 VanDerWaalsContact C-N 3.31Å; V84-T86 PolarHBondContact O-N 2.85Å; V84-W88 HydrophobicContact CG1-CB 4.2Å; V84-W88 HydrophobicContact CG1-CD2 4.44Å; V84-W88 HydrophobicContact CG1-CE3 4.36Å; V84-W88 HydrophobicContact CG1-CG 4.4Å; V84-W88 HydrophobicContact CG2-CE3 4.13Å; V84-W88 HydrophobicContact CG2-CZ3 4.43Å; V84-W88 WeakPolarHBondContact O-CB 3.17Å; V84-W88 PolarHBondContact O-N 3.2Å; V84-W88 VanDerWaalsContact O-N 3.15Å; V84-A130 HydrophobicContact CG2-CB 4.48Å; V84-A133 HydrophobicContact CG1-CB 3.68Å; V84-I134 HydrophobicContact CG1-CG1 3.64Å; V84-I134 HydrophobicContact CG2-CD1 4.32Å; V84-I134 HydrophobicContact CG2-CG1 4.25Å
85	E	95.6	Very high	95.6	Very high	68 Å²	68	47.3 Å²	47.3	32%	0.318	23%	0.234	S	C	.	.	H	α-helix	trans	-61.6	-37.1	179.4	-69.3	-173.6	124.9	0	0	113.4	K81 Q82 S92 Y129	K81-E85 WeakPolarHBondContact O-CG 3.43Å; K81-E85 PolarHBondContact O-N 3.46Å; Q82-E85 PolarHBondContact O-N 3.01Å; E85-S92 PolarHBondContact O-OG 3.05Å; E85-Y129 HydrophobicContact CG-CE1 4.42Å; E85-Y129 PolarHBondContact OE1-OH 3.03Å
86	T	96.9	Very high	95.7	Very high	7 Å²	7	51 Å²	51	4%	0.043	25%	0.246	C	C	.	.	H	α-helix	trans	-99	-23.5	-173	62.3	0	0	0	0	114.2	Q82 Y83 V84 K94 F95 R96	Q82-T86 PolarHBondContact O-N 3.25Å; Q82-T86 PolarHBondContact O-OG1 2.98Å; Y83-T86 PolarHBondContact O-N 3.34Å; V84-T86 VanDerWaalsContact C-N 3.31Å; V84-T86 PolarHBondContact O-N 2.85Å; T86-K94 HydrophobicContact CG2-CB 4.45Å; T86-K94 WeakPolarHBondContact CG2-O 3.04Å; T86-F95 CarbonylContact O-C 3.53Å; T86-F95 VanDerWaalsContact O-CA 3.3Å; T86-F95 WeakPolarHBondContact O-CA 3.33Å; T86-F95 WeakPolarHBondContact O-CD2 3.48Å; T86-R96 PolarHBondContact O-N 3.17Å
87	H	97.5	Very high	95.6	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-116.3	-8.6	-175.6	-65.4	-90.5	0	0	0	114.2	E50 Y83 R96 P98 E99 T100	E50-H87 WeakPolarHBondContact CG-NE2 3.39Å; E50-H87 IonicContact OE1-NE2 2.8Å; E50-H87 PolarHBondContact OE1-NE2 3.08Å; Y83-H87 HydrophobicContact CD2-CB 3.93Å; Y83-H87 AromaticContact CD2-CD2 3.43Å; Y83-H87 VanDerWaalsContact CD2-CD2 3.43Å; Y83-H87 WeakPolarHBondContact CD2-CD2 3.26Å; Y83-H87 AromaticContact CD2-CG 3.72Å; Y83-H87 HydrophobicContact CE1-CB 4.26Å; Y83-H87 HydrophobicContact CE2-CB 3.61Å; Y83-H87 AromaticContact CE2-CD2 3.78Å; Y83-H87 AromaticContact CE2-CG 3.58Å; Y83-H87 HydrophobicContact CG-CB 4.43Å; Y83-H87 WeakPolarHBondContact O-CA 3.17Å; Y83-H87 VanDerWaalsContact O-CB 3.28Å; Y83-H87 WeakPolarHBondContact O-CB 3.33Å; Y83-H87 PolarHBondContact O-N 3.1Å; H87-R96 PolarHBondContact CE1-O 3.05Å; H87-R96 PolarHBondContact ND1-O 3.38Å; H87-P98 PolarHBondContact ND1-O 2.97Å; H87-E99 CarbonylContact O-C 3.56Å; H87-E99 WeakPolarHBondContact O-CA 3.25Å; H87-T100 PolarHBondContact O-N 3.47Å; H87-T100 PolarHBondContact O-OG1 3.34Å
88	W	97.8	Very high	95.7	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.291	C	S	.	.	S	Bend	trans	-75.1	-36.9	-172.7	-160.1	-92.2	0	0	0	114	V84 T100 K105 I108 R109 I134 D138	V84-W88 HydrophobicContact CG1-CB 4.2Å; V84-W88 HydrophobicContact CG1-CD2 4.44Å; V84-W88 HydrophobicContact CG1-CE3 4.36Å; V84-W88 HydrophobicContact CG1-CG 4.4Å; V84-W88 HydrophobicContact CG2-CE3 4.13Å; V84-W88 HydrophobicContact CG2-CZ3 4.43Å; V84-W88 WeakPolarHBondContact O-CB 3.17Å; V84-W88 PolarHBondContact O-N 3.2Å; V84-W88 VanDerWaalsContact O-N 3.15Å; W88-T100 HydrophobicContact CE3-CG2 4.26Å; W88-T100 HydrophobicContact CZ3-CG2 4.24Å; W88-K105 HydrophobicContact CD2-CD 4.44Å; W88-K105 HydrophobicContact CD2-CG 4.24Å; W88-K105 HydrophobicContact CE3-CG 4.38Å; W88-K105 HydrophobicContact CH2-CB 3.87Å; W88-K105 HydrophobicContact CH2-CG 3.83Å; W88-K105 HydrophobicContact CZ2-CB 3.76Å; W88-K105 HydrophobicContact CZ2-CD 4.02Å; W88-K105 HydrophobicContact CZ2-CG 3.61Å; W88-K105 HydrophobicContact CZ3-CG 4.19Å; W88-K105 WeakPolarHBondContact O-CE 3.45Å; W88-K105 PolarHBondContact O-NZ 3.07Å; W88-I108 HydrophobicContact CH2-CB 4Å; W88-I108 HydrophobicContact CH2-CD1 4.45Å; W88-I108 HydrophobicContact CH2-CG2 3.92Å; W88-I108 HydrophobicContact CZ3-CB 4.09Å; W88-I108 HydrophobicContact CZ3-CD1 3.79Å; W88-I108 HydrophobicContact CZ3-CG2 3.86Å; W88-R109 HydrophobicContact CH2-CG 4.31Å; W88-R109 HydrophobicContact CZ2-CG 4.17Å; W88-I134 HydrophobicContact CD2-CG1 3.91Å; W88-I134 HydrophobicContact CE3-CD1 4.36Å; W88-I134 HydrophobicContact CE3-CG1 4.02Å; W88-I134 HydrophobicContact CH2-CD1 3.55Å; W88-I134 HydrophobicContact CH2-CG1 3.79Å; W88-I134 HydrophobicContact CH2-CG2 4.13Å; W88-I134 HydrophobicContact CZ2-CB 4.14Å; W88-I134 HydrophobicContact CZ2-CD1 3.92Å; W88-I134 HydrophobicContact CZ2-CG1 3.7Å; W88-I134 HydrophobicContact CZ2-CG2 3.36Å; W88-I134 HydrophobicContact CZ3-CD1 3.81Å; W88-I134 HydrophobicContact CZ3-CG1 3.96Å; W88-D138 VanDerWaalsContact CZ2-OD2 3.29Å; W88-D138 WeakPolarHBondContact CZ2-OD2 3.46Å; W88-D138 PolarHBondContact NE1-OD1 3.33Å; W88-D138 PolarHBondContact NE1-OD2 3.48Å
89	C	96.4	Very high	95.8	Very high	13 Å²	13	58.9 Å²	58.9	9%	0.088	29%	0.291	C	S	.	.			trans	-133.1	126.3	-178.8	-177.8	0	0	0	0	111.5	H91 S92 F95 E99 W137	C89-H91 PolarHBondContact O-N 3.39Å; C89-H91 VanDerWaalsContact O-N 3.16Å; C89-H91 PolarHBondContact SG-N 2.9Å; C89-H91 VanDerWaalsContact SG-N 3.44Å; C89-S92 VanDerWaalsContact O-CB 3.28Å; C89-S92 WeakPolarHBondContact O-CB 3.34Å; C89-S92 PolarHBondContact O-N 3.01Å; C89-S92 VanDerWaalsContact O-N 3.09Å; C89-F95 WeakPolarHBondContact O-CD2 3.42Å; C89-E99 WeakPolarHBondContact CA-OE1 3.44Å; C89-W137 HydrophobicContact CB-CD2 3.47Å; C89-W137 VanDerWaalsContact CB-CD2 3.47Å; C89-W137 HydrophobicContact CB-CE3 3.73Å; C89-W137 HydrophobicContact CB-CG 3.85Å; C89-W137 HydrophobicContact CB-CH2 4.33Å; C89-W137 HydrophobicContact CB-CZ2 4.12Å; C89-W137 HydrophobicContact CB-CZ3 4.16Å; C89-W137 VanDerWaalsContact SG-CZ3 3.56Å
90	A	95.8	Very high	95.9	Very high	43 Å²	43	57.9 Å²	57.9	36%	0.355	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-16.4	177.5	0	0	0	0	0	114.3	F95 E99	A90-F95 HydrophobicContact CB-CE1 4.15Å; A90-F95 HydrophobicContact CB-CE2 4.26Å; A90-F95 HydrophobicContact CB-CZ 4.01Å; A90-E99 PolarHBondContact N-OE1 2.79Å
91	H	94	Very high	95.8	Very high	168 Å²	168	60.2 Å²	60.2	78%	0.778	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-1.5	177.7	-54.8	91.4	0	0	0	113.2	C89	C89-H91 PolarHBondContact O-N 3.39Å; C89-H91 VanDerWaalsContact O-N 3.16Å; C89-H91 PolarHBondContact SG-N 2.9Å; C89-H91 VanDerWaalsContact SG-N 3.44Å
92	S	94	Very high	95.8	Very high	22 Å²	22	63.8 Å²	63.8	15%	0.154	32%	0.322	C	S	.	.			trans	-64.1	139.1	174.2	175.7	0	0	0	0	110.8	E85 C89 K94 F95	E85-S92 PolarHBondContact O-OG 3.05Å; C89-S92 VanDerWaalsContact O-CB 3.28Å; C89-S92 WeakPolarHBondContact O-CB 3.34Å; C89-S92 PolarHBondContact O-N 3.01Å; C89-S92 VanDerWaalsContact O-N 3.09Å; S92-K94 PolarHBondContact O-N 3.28Å; S92-K94 PolarHBondContact OG-N 3.36Å; S92-F95 WeakPolarHBondContact O-CB 3.18Å; S92-F95 PolarHBondContact O-N 3.35Å; S92-F95 VanDerWaalsContact O-N 3.12Å
93	E	92.3	Very high	95.8	Very high	194 Å²	194	66.1 Å²	66.1	91%	0.907	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-35.8	176.4	-172.8	-172.6	179.4	0	0	111.9	F95	E93-F95 VanDerWaalsContact C-N 3.3Å; E93-F95 PolarHBondContact O-N 3.19Å
94	K	94.3	Very high	95.7	Very high	138 Å²	138	66 Å²	66	60%	0.6	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	18.1	-178.8	-59.8	177.3	-173.6	169.4	0	112.4	T86 S92 R96	T86-K94 HydrophobicContact CG2-CB 4.45Å; T86-K94 WeakPolarHBondContact CG2-O 3.04Å; S92-K94 PolarHBondContact O-N 3.28Å; S92-K94 PolarHBondContact OG-N 3.36Å; K94-R96 PolarHBondContact O-N 3.39Å
95	F	97.1	Very high	95.7	Very high	63 Å²	63	67 Å²	67	28%	0.276	34%	0.337	S	S	.	.			trans	-59.9	135.5	-173.6	177.4	-113.4	0	0	0	112.8	T86 C89 A90 S92 E93 P97 E99	T86-F95 CarbonylContact O-C 3.53Å; T86-F95 VanDerWaalsContact O-CA 3.3Å; T86-F95 WeakPolarHBondContact O-CA 3.33Å; T86-F95 WeakPolarHBondContact O-CD2 3.48Å; C89-F95 WeakPolarHBondContact O-CD2 3.42Å; A90-F95 HydrophobicContact CB-CE1 4.15Å; A90-F95 HydrophobicContact CB-CE2 4.26Å; A90-F95 HydrophobicContact CB-CZ 4.01Å; S92-F95 WeakPolarHBondContact O-CB 3.18Å; S92-F95 PolarHBondContact O-N 3.35Å; S92-F95 VanDerWaalsContact O-N 3.12Å; E93-F95 VanDerWaalsContact C-N 3.3Å; E93-F95 PolarHBondContact O-N 3.19Å; F95-P97 HydrophobicContact CE1-CB 4.25Å; F95-P97 HydrophobicContact CZ-CB 4.34Å; F95-E99 HydrophobicContact CE2-CB 3.87Å; F95-E99 HydrophobicContact CE2-CG 4.35Å; F95-E99 HydrophobicContact CZ-CB 3.87Å
96	R	95.6	Very high	95.8	Very high	111 Å²	111	66 Å²	66	42%	0.419	34%	0.341	S	S	.	.			trans	-124.9	126.4	172.6	-65.6	179.9	-175.8	174.3	1.4	108.2	E50 T86 H87 K94	E50-R96 IonicContact OE1-NH1 3.55Å; T86-R96 PolarHBondContact O-N 3.17Å; H87-R96 PolarHBondContact CE1-O 3.05Å; H87-R96 PolarHBondContact ND1-O 3.38Å; K94-R96 PolarHBondContact O-N 3.39Å
97	P	93.8	Very high	95.7	Very high	96 Å²	96	67.2 Å²	67.2	62%	0.623	35%	0.352	S	S	*	.	S	Bend	trans	-71.3	152.6	175.4	29.8	-34.3	0	0	0	111.1	F95	F95-P97 HydrophobicContact CE1-CB 4.25Å; F95-P97 HydrophobicContact CZ-CB 4.34Å
98	P	96	Very high	95.7	Very high	52 Å²	52	67.1 Å²	67.1	34%	0.338	35%	0.352	S	S	.	.	S	Bend	cis	-79.1	156.3	-0.9	33.1	-34.9	0	0	0	112.7	H87	H87-P98 PolarHBondContact ND1-O 2.97Å
99	E	97.1	Very high	95.7	Very high	82 Å²	82	69 Å²	69	38%	0.383	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-69	141.3	166.3	-172	176.5	-142.9	0	0	109.7	H87 C89 A90 F95 T101	H87-E99 CarbonylContact O-C 3.56Å; H87-E99 WeakPolarHBondContact O-CA 3.25Å; C89-E99 WeakPolarHBondContact CA-OE1 3.44Å; A90-E99 PolarHBondContact N-OE1 2.79Å; F95-E99 HydrophobicContact CE2-CB 3.87Å; F95-E99 HydrophobicContact CE2-CG 4.35Å; F95-E99 HydrophobicContact CZ-CB 3.87Å; E99-T101 PolarHBondContact O-N 3.08Å
100	T	97.4	Very high	95.7	Very high	4 Å²	4	76.1 Å²	76.1	3%	0.025	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-60.1	122.9	177.6	-54.9	0	0	0	0	109.1	Y83 H87 W88 A104 K105 I108	Y83-T100 HydrophobicContact CE1-CG2 4.28Å; Y83-T100 WeakPolarHBondContact CE1-OG1 3.47Å; Y83-T100 PolarHBondContact OH-OG1 3.5Å; H87-T100 PolarHBondContact O-N 3.47Å; H87-T100 PolarHBondContact O-OG1 3.34Å; W88-T100 HydrophobicContact CE3-CG2 4.26Å; W88-T100 HydrophobicContact CZ3-CG2 4.24Å; T100-A104 HydrophobicContact CG2-CB 3.7Å; T100-K105 HydrophobicContact CG2-CG 3.67Å; T100-K105 VanDerWaalsContact O-CE 3.3Å; T100-K105 WeakPolarHBondContact O-CE 3.47Å; T100-I108 HydrophobicContact CG2-CD1 4.32Å
101	T	96.6	Very high	95.7	Very high	50 Å²	50	76.4 Å²	76.4	31%	0.307	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-67.6	154.6	-176.6	68.1	0	0	0	0	111.5	E53 E99 Q103 A104 K105	E53-T101 HydrophobicContact CG-CG2 3.85Å; E53-T101 WeakPolarHBondContact OE1-CB 3.34Å; E53-T101 WeakPolarHBondContact OE1-CG2 3.26Å; E53-T101 PolarHBondContact OE1-OG1 3.46Å; E99-T101 PolarHBondContact O-N 3.08Å; T101-Q103 PolarHBondContact O-N 3.1Å; T101-Q103 VanDerWaalsContact O-N 3.14Å; T101-A104 PolarHBondContact O-N 2.83Å; T101-A104 PolarHBondContact OG1-N 3.34Å; T101-K105 WeakPolarHBondContact O-CG 3.45Å; T101-K105 PolarHBondContact O-N 3.02Å
102	D	94.9	Very high	95.8	Very high	131 Å²	131	68.4 Å²	68.4	70%	0.701	35%	0.349	S	S	*	.	H	α-helix	trans	-56.2	-34.1	-179.7	-69.1	-33.5	0	0	0	112.9	A106	D102-A106 WeakPolarHBondContact O-CB 3.45Å; D102-A106 PolarHBondContact O-N 3.33Å
103	Q	95.3	Very high	95.9	Very high	138 Å²	138	67.7 Å²	67.7	65%	0.645	34%	0.344	S	S	*	.	H	α-helix	trans	-66.6	-46.9	175.7	-177.1	175.4	-11.3	0	0	111.5	T101 A106 A107	T101-Q103 PolarHBondContact O-N 3.1Å; T101-Q103 VanDerWaalsContact O-N 3.14Å; Q103-A106 PolarHBondContact O-N 2.9Å; Q103-A107 PolarHBondContact O-N 2.93Å; Q103-A107 VanDerWaalsContact O-N 3.08Å
104	A	94.7	Very high	96	Very high	4 Å²	4	61.7 Å²	61.7	3%	0.033	32%	0.323	C	S	.	.	H	α-helix	trans	-64.7	-41.9	176.3	0	0	0	0	0	111.6	V57 T100 T101 A106 A107 I108	V57-A104 HydrophobicContact CG2-CB 3.76Å; T100-A104 HydrophobicContact CG2-CB 3.7Å; T101-A104 PolarHBondContact O-N 2.83Å; T101-A104 PolarHBondContact OG1-N 3.34Å; A104-A106 PolarHBondContact O-N 3.33Å; A104-A107 PolarHBondContact O-N 2.86Å; A104-I108 WeakPolarHBondContact O-CB 3.21Å; A104-I108 WeakPolarHBondContact O-CD1 3.47Å; A104-I108 VanDerWaalsContact O-CG1 3.25Å; A104-I108 WeakPolarHBondContact O-CG1 3.27Å; A104-I108 PolarHBondContact O-N 3Å
105	K	97.4	Very high	96	Very high	21 Å²	21	55.2 Å²	55.2	9%	0.091	30%	0.296	C	S	.	.	H	α-helix	trans	-57.7	-47.9	174	-70.5	-172.5	175.1	179.2	0	111.4	W88 T100 T101 A107 I108 R109	W88-K105 HydrophobicContact CD2-CD 4.44Å; W88-K105 HydrophobicContact CD2-CG 4.24Å; W88-K105 HydrophobicContact CE3-CG 4.38Å; W88-K105 HydrophobicContact CH2-CB 3.87Å; W88-K105 HydrophobicContact CH2-CG 3.83Å; W88-K105 HydrophobicContact CZ2-CB 3.76Å; W88-K105 HydrophobicContact CZ2-CD 4.02Å; W88-K105 HydrophobicContact CZ2-CG 3.61Å; W88-K105 HydrophobicContact CZ3-CG 4.19Å; W88-K105 WeakPolarHBondContact O-CE 3.45Å; W88-K105 PolarHBondContact O-NZ 3.07Å; T100-K105 HydrophobicContact CG2-CG 3.67Å; T100-K105 VanDerWaalsContact O-CE 3.3Å; T100-K105 WeakPolarHBondContact O-CE 3.47Å; T101-K105 WeakPolarHBondContact O-CG 3.45Å; T101-K105 PolarHBondContact O-N 3.02Å; K105-A107 PolarHBondContact O-N 3.15Å; K105-I108 PolarHBondContact O-N 2.82Å; K105-R109 WeakPolarHBondContact O-CB 3.4Å; K105-R109 VanDerWaalsContact O-CG 3.28Å; K105-R109 WeakPolarHBondContact O-CG 3.49Å; K105-R109 PolarHBondContact O-N 3.42Å
106	A	96.3	Very high	95.9	Very high	48 Å²	48	52.3 Å²	52.3	40%	0.397	28%	0.283	S	S	.	.	H	α-helix	trans	-59.4	-45.1	178.2	0	0	0	0	0	112.2	D102 Q103 A104 R109 E110	D102-A106 WeakPolarHBondContact O-CB 3.45Å; D102-A106 PolarHBondContact O-N 3.33Å; Q103-A106 PolarHBondContact O-N 2.9Å; A104-A106 PolarHBondContact O-N 3.33Å; A106-R109 PolarHBondContact O-N 3.07Å; A106-E110 PolarHBondContact O-N 3.48Å; A106-E110 VanDerWaalsContact O-N 3.09Å
107	A	96.2	Very high	95.9	Very high	32 Å²	32	51.7 Å²	51.7	26%	0.264	28%	0.281	S	S	.	.	H	α-helix	trans	-63.5	-45.6	177.4	0	0	0	0	0	112.2	V57 Q103 A104 K105 R109 E110 L111	V57-A107 HydrophobicContact CG1-CB 4.14Å; V57-A107 HydrophobicContact CG2-CB 4.24Å; Q103-A107 PolarHBondContact O-N 2.93Å; Q103-A107 VanDerWaalsContact O-N 3.08Å; A104-A107 PolarHBondContact O-N 2.86Å; K105-A107 PolarHBondContact O-N 3.15Å; A107-R109 PolarHBondContact O-N 3.19Å; A107-E110 PolarHBondContact O-N 2.92Å; A107-L111 WeakPolarHBondContact O-CB 3.27Å; A107-L111 VanDerWaalsContact O-CG 3.25Å; A107-L111 WeakPolarHBondContact O-CG 3.4Å; A107-L111 PolarHBondContact O-N 2.87Å
108	I	97.4	Very high	95.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.5	-42	179.2	-67.2	164.1	0	0	0	110.9	V57 A60 Y83 W88 T100 A104 K105 E110 L111 L112 I134	V57-I108 HydrophobicContact CB-CG1 4.48Å; V57-I108 HydrophobicContact CG2-CD1 4.2Å; V57-I108 HydrophobicContact CG2-CG1 4.02Å; A60-I108 HydrophobicContact CB-CG1 4.32Å; A60-I108 HydrophobicContact CB-CG2 4.44Å; Y83-I108 HydrophobicContact CE1-CD1 4.49Å; W88-I108 HydrophobicContact CH2-CB 4Å; W88-I108 HydrophobicContact CH2-CD1 4.45Å; W88-I108 HydrophobicContact CH2-CG2 3.92Å; W88-I108 HydrophobicContact CZ3-CB 4.09Å; W88-I108 HydrophobicContact CZ3-CD1 3.79Å; W88-I108 HydrophobicContact CZ3-CG2 3.86Å; T100-I108 HydrophobicContact CG2-CD1 4.32Å; A104-I108 WeakPolarHBondContact O-CB 3.21Å; A104-I108 WeakPolarHBondContact O-CD1 3.47Å; A104-I108 VanDerWaalsContact O-CG1 3.25Å; A104-I108 WeakPolarHBondContact O-CG1 3.27Å; A104-I108 PolarHBondContact O-N 3Å; K105-I108 PolarHBondContact O-N 2.82Å; I108-E110 VanDerWaalsContact C-N 3.29Å; I108-E110 PolarHBondContact O-N 2.96Å; I108-L111 PolarHBondContact O-N 3.25Å; I108-L112 HydrophobicContact CG2-CD1 3.46Å; I108-L112 VanDerWaalsContact CG2-CD1 3.46Å; I108-L112 HydrophobicContact CG2-CG 3.87Å; I108-L112 WeakPolarHBondContact O-CG 3.49Å; I108-L112 PolarHBondContact O-N 3.29Å; I108-I134 HydrophobicContact CG2-CD1 3.91Å
109	R	97.4	Very high	95.6	Very high	38 Å²	38	49.2 Å²	49.2	14%	0.143	27%	0.265	C	S	.	.	H	α-helix	trans	-64.1	-30	175.9	-72.5	-174	-62.9	-128	4.3	113.1	W88 K105 A106 A107 P113 I134 D138 W143	W88-R109 HydrophobicContact CH2-CG 4.31Å; W88-R109 HydrophobicContact CZ2-CG 4.17Å; K105-R109 WeakPolarHBondContact O-CB 3.4Å; K105-R109 VanDerWaalsContact O-CG 3.28Å; K105-R109 WeakPolarHBondContact O-CG 3.49Å; K105-R109 PolarHBondContact O-N 3.42Å; A106-R109 PolarHBondContact O-N 3.07Å; A107-R109 PolarHBondContact O-N 3.19Å; R109-P113 WeakPolarHBondContact O-CD 3.4Å; R109-P113 VanDerWaalsContact O-CG 3.26Å; R109-P113 WeakPolarHBondContact O-CG 3.28Å; R109-I134 HydrophobicContact CG-CG2 4.14Å; R109-D138 IonicContact CZ-OD2 3.42Å; R109-D138 IonicContact NH1-OD1 2.79Å; R109-D138 IonicContact NH1-OD2 2.69Å; R109-D138 PolarHBondContact NH1-OD2 2.67Å; R109-W143 HydrophobicContact CB-CD2 4.23Å; R109-W143 HydrophobicContact CB-CE3 4.44Å; R109-W143 HydrophobicContact CB-CH2 4.03Å; R109-W143 HydrophobicContact CB-CZ2 3.8Å; R109-W143 HydrophobicContact CB-CZ3 4.36Å; R109-W143 HydrophobicContact CG-CD2 3.86Å; R109-W143 HydrophobicContact CG-CE3 3.7Å; R109-W143 HydrophobicContact CG-CH2 3.93Å; R109-W143 HydrophobicContact CG-CZ2 4.09Å; R109-W143 HydrophobicContact CG-CZ3 3.75Å; R109-W143 VanDerWaalsContact O-CZ2 3.25Å; R109-W143 WeakPolarHBondContact O-CZ2 3.24Å
110	E	96.3	Very high	95.3	Very high	164 Å²	164	48 Å²	48	77%	0.766	26%	0.261	S	S	*	.	H	α-helix	trans	-76.6	-37.5	173.6	-170.5	175.2	-179.6	0	0	112.1	A106 A107 I108	A106-E110 PolarHBondContact O-N 3.48Å; A106-E110 VanDerWaalsContact O-N 3.09Å; A107-E110 PolarHBondContact O-N 2.92Å; I108-E110 VanDerWaalsContact C-N 3.29Å; I108-E110 PolarHBondContact O-N 2.96Å
111	L	95.6	Very high	94.8	Very high	48 Å²	48	50.7 Å²	50.7	25%	0.251	28%	0.28	S	S	.	.	H	α-helix	trans	-75.6	-53.3	-175.9	-72.7	167.9	0	0	0	113.4	V57 A60 E61 A107 I108 P113 S114	V57-L111 HydrophobicContact CG1-CD1 4.16Å; A60-L111 HydrophobicContact CB-CB 4.48Å; A60-L111 HydrophobicContact CB-CD1 4.25Å; E61-L111 HydrophobicContact CG-CD1 3.71Å; E61-L111 HydrophobicContact CG-CD2 4.37Å; A107-L111 WeakPolarHBondContact O-CB 3.27Å; A107-L111 VanDerWaalsContact O-CG 3.25Å; A107-L111 WeakPolarHBondContact O-CG 3.4Å; A107-L111 PolarHBondContact O-N 2.87Å; I108-L111 PolarHBondContact O-N 3.25Å; L111-P113 VanDerWaalsContact C-CD 3.44Å; L111-S114 PolarHBondContact O-N 2.99Å; L111-S114 PolarHBondContact O-OG 3.45Å
112	L	96.7	Very high	94.4	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-58	-39.6	-168.2	-74.5	178.6	0	0	0	115	A60 V64 L80 I108 S114 G115 V127 A130 V131 I134	A60-L112 HydrophobicContact CB-CD2 4.08Å; A60-L112 HydrophobicContact CB-CG 4.43Å; V64-L112 HydrophobicContact CG2-CD2 4.22Å; L80-L112 HydrophobicContact CD2-CD2 3.66Å; I108-L112 HydrophobicContact CG2-CD1 3.46Å; I108-L112 VanDerWaalsContact CG2-CD1 3.46Å; I108-L112 HydrophobicContact CG2-CG 3.87Å; I108-L112 WeakPolarHBondContact O-CG 3.49Å; I108-L112 PolarHBondContact O-N 3.29Å; L112-S114 PolarHBondContact O-N 3.21Å; L112-S114 VanDerWaalsContact O-N 3.16Å; L112-G115 WeakPolarHBondContact O-CA 3.28Å; L112-G115 PolarHBondContact O-N 3.49Å; L112-V127 HydrophobicContact CB-CG1 4.36Å; L112-V127 HydrophobicContact CD2-CG1 4.21Å; L112-V127 WeakPolarHBondContact O-CG1 3.27Å; L112-A130 HydrophobicContact CD1-CB 4.13Å; L112-V131 HydrophobicContact CB-CG2 3.81Å; L112-V131 HydrophobicContact CD1-CG2 4.26Å; L112-I134 HydrophobicContact CD1-CD1 3.58Å
113	P	95.9	Very high	94.2	Very high	8 Å²	8	49.1 Å²	49.1	5%	0.052	26%	0.263	C	S	.	.	H	α-helix	trans	-56.9	-34.1	-179.1	-28.3	36.7	0	0	0	113.7	R109 L111 G115 L116 W143 L149 M153	R109-P113 WeakPolarHBondContact O-CD 3.4Å; R109-P113 VanDerWaalsContact O-CG 3.26Å; R109-P113 WeakPolarHBondContact O-CG 3.28Å; L111-P113 VanDerWaalsContact C-CD 3.44Å; P113-G115 PolarHBondContact O-N 2.91Å; P113-L116 WeakPolarHBondContact O-CB 3.29Å; P113-L116 PolarHBondContact O-N 2.65Å; P113-L116 VanDerWaalsContact O-N 3.13Å; P113-W143 HydrophobicContact CG-CH2 4.26Å; P113-W143 HydrophobicContact CG-CZ2 3.83Å; P113-L149 HydrophobicContact CB-CD2 3.44Å; P113-L149 VanDerWaalsContact CB-CD2 3.44Å; P113-L149 HydrophobicContact CB-CG 4.27Å; P113-L149 HydrophobicContact CG-CD2 3.45Å; P113-L149 VanDerWaalsContact CG-CD2 3.45Å; P113-M153 HydrophobicContact CB-CE 3.74Å; P113-M153 WeakPolarHBondContact O-CE 3.41Å
114	S	94.5	Very high	94.1	Very high	67 Å²	67	42.9 Å²	42.9	47%	0.469	23%	0.233	S	C	.	.	H	α-helix	trans	-64.8	-29.3	176.7	68.2	0	0	0	0	112.8	V64 L111 L112 L116 R117	V64-S114 WeakPolarHBondContact CG1-OG 3.37Å; L111-S114 PolarHBondContact O-N 2.99Å; L111-S114 PolarHBondContact O-OG 3.45Å; L112-S114 PolarHBondContact O-N 3.21Å; L112-S114 VanDerWaalsContact O-N 3.16Å; S114-L116 PolarHBondContact O-N 3.38Å; S114-R117 PolarHBondContact O-N 2.87Å
115	G	94.3	Very high	93.9	Very high	3 Å²	3	43.2 Å²	43.2	3%	0.031	24%	0.235	C	C	.	.	H	α-helix	trans	-69.6	-15.2	175	0	0	0	0	0	114.5	L112 P113 R117 E118	L112-G115 WeakPolarHBondContact O-CA 3.28Å; L112-G115 PolarHBondContact O-N 3.49Å; P113-G115 PolarHBondContact O-N 2.91Å; G115-R117 PolarHBondContact O-N 3.48Å; G115-E118 WeakPolarHBondContact O-CB 3.39Å; G115-E118 PolarHBondContact O-N 2.83Å
116	L	95.4	Very high	93.7	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-15	173.1	-62.3	176.5	0	0	0	112.5	P113 S114 R124 V127 A128 L150 M153 N160 V168	P113-L116 WeakPolarHBondContact O-CB 3.29Å; P113-L116 PolarHBondContact O-N 2.65Å; P113-L116 VanDerWaalsContact O-N 3.13Å; S114-L116 PolarHBondContact O-N 3.38Å; L116-R124 WeakPolarHBondContact O-CD 3.42Å; L116-R124 WeakPolarHBondContact O-CG 3.28Å; L116-V127 HydrophobicContact CD2-CB 4.48Å; L116-V127 HydrophobicContact CD2-CG1 3.87Å; L116-V127 HydrophobicContact CG-CG1 4.22Å; L116-A128 HydrophobicContact CD2-CB 3.84Å; L116-L150 HydrophobicContact CD1-CD2 3.92Å; L116-M153 HydrophobicContact CB-CE 4.38Å; L116-M153 HydrophobicContact CB-SD 3.86Å; L116-M153 HydrophobicContact CD1-CE 4.11Å; L116-M153 HydrophobicContact CD1-SD 3.71Å; L116-M153 HydrophobicContact CG-SD 4.41Å; L116-N160 VanDerWaalsContact O-O 3.09Å; L116-V168 HydrophobicContact CD1-CG2 4.07Å; L116-V168 HydrophobicContact CD2-CG2 3.84Å
117	R	95.2	Very high	93.7	Very high	98 Å²	98	40.4 Å²	40.4	37%	0.37	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	0.6	175.7	-53.6	-173.3	174.1	-89.5	-2.3	113.6	S114 G115 S156 D158 A161	S114-R117 PolarHBondContact O-N 2.87Å; G115-R117 PolarHBondContact O-N 3.48Å; R117-S156 PolarHBondContact NH1-OG 3.39Å; R117-D158 IonicContact NH1-OD2 3.94Å; R117-A161 HydrophobicContact CG-CB 3.86Å; R117-A161 VanDerWaalsContact NH1-CB 3.33Å
118	E	93.3	Very high	93.6	Very high	16 Å²	16	38.9 Å²	38.9	8%	0.075	20%	0.202	C	C	.	.			trans	-60	138.8	-176	175.9	49.4	-112.2	0	0	111.4	R73 G115 I120 V123 R124	R73-E118 IonicContact CZ-OE2 3.41Å; R73-E118 IonicContact NH1-OE1 2.91Å; R73-E118 IonicContact NH1-OE2 2.78Å; R73-E118 PolarHBondContact NH1-OE2 3.14Å; R73-E118 IonicContact NH2-OE2 2.68Å; R73-E118 PolarHBondContact NH2-OE2 3.01Å; G115-E118 WeakPolarHBondContact O-CB 3.39Å; G115-E118 PolarHBondContact O-N 2.83Å; E118-I120 HydrophobicContact CG-CB 4.14Å; E118-I120 PolarHBondContact OE1-N 3.46Å; E118-V123 HydrophobicContact CG-CB 4Å; E118-V123 HydrophobicContact CG-CG1 4.05Å; E118-R124 HydrophobicContact CB-CB 4.22Å; E118-R124 WeakPolarHBondContact O-CD 3.28Å; E118-R124 PolarHBondContact O-NH1 2.93Å
119	S	90	Very high	93.5	Very high	81 Å²	81	43.3 Å²	43.3	57%	0.566	22%	0.22	S	C	*	.	S	Bend	trans	-67	-36.8	176	64.1	0	0	0	0	113.1	S121 R124	S119-S121 PolarHBondContact O-N 2.78Å; S119-R124 PolarHBondContact O-NH1 3.12Å
120	I	90.3	Very high	93.5	Very high	55 Å²	55	41.5 Å²	41.5	28%	0.282	21%	0.213	S	C	.	.	S	Bend	trans	-79.3	110.4	-177.8	-56.3	177.1	0	0	0	110.5	L70 E118 K122 V123 R124	L70-I120 HydrophobicContact CD1-CD1 3.74Å; L70-I120 HydrophobicContact CD1-CG2 4.03Å; E118-I120 HydrophobicContact CG-CB 4.14Å; E118-I120 PolarHBondContact OE1-N 3.46Å; I120-K122 VanDerWaalsContact C-N 3.32Å; I120-K122 PolarHBondContact O-N 3.32Å; I120-V123 HydrophobicContact CB-CB 4.44Å; I120-V123 HydrophobicContact CB-CG2 4.32Å; I120-V123 HydrophobicContact CG2-CG2 4.05Å; I120-V123 PolarHBondContact O-N 3.17Å; I120-V123 VanDerWaalsContact O-N 3.15Å; I120-R124 PolarHBondContact O-N 3.48Å
121	S	87.9	Confident	93.6	Very high	61 Å²	61	33.8 Å²	33.8	43%	0.427	18%	0.177	S	C	.	.	H	α-helix	trans	-55.7	-38.4	-175.6	-58.3	0	0	0	0	114.4	S119 V123 R124 S125	S119-S121 PolarHBondContact O-N 2.78Å; S121-V123 PolarHBondContact O-N 2.86Å; S121-R124 PolarHBondContact O-N 3.18Å; S121-R124 PolarHBondContact OG-NH2 3.46Å; S121-S125 WeakPolarHBondContact O-CB 3.33Å; S121-S125 PolarHBondContact O-N 3.32Å; S121-S125 PolarHBondContact O-OG 2.77Å
122	K	87.1	Confident	93.6	Very high	149 Å²	149	32.3 Å²	32.3	65%	0.648	17%	0.171	S	C	*	.	H	α-helix	trans	-65.2	-39.2	179.9	-66.1	-173.9	176.6	-174	0	113.1	Q74 I120 S126	Q74-K122 VanDerWaalsContact OE1-CB 3.28Å; I120-K122 VanDerWaalsContact C-N 3.32Å; I120-K122 PolarHBondContact O-N 3.32Å; K122-S126 PolarHBondContact O-N 3.36Å; K122-S126 VanDerWaalsContact O-N 3.11Å; K122-S126 PolarHBondContact O-OG 3.3Å
123	V	90.9	Very high	93.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-72.5	-48.6	177.1	178.8	0	0	0	0	109.6	T63 L70 R73 E118 I120 S121 S125 S126 V127	T63-V123 HydrophobicContact CG2-CG1 3.99Å; L70-V123 HydrophobicContact CD1-CG2 4.13Å; R73-V123 HydrophobicContact CB-CG2 4.39Å; E118-V123 HydrophobicContact CG-CB 4Å; E118-V123 HydrophobicContact CG-CG1 4.05Å; I120-V123 HydrophobicContact CB-CB 4.44Å; I120-V123 HydrophobicContact CB-CG2 4.32Å; I120-V123 HydrophobicContact CG2-CG2 4.05Å; I120-V123 PolarHBondContact O-N 3.17Å; I120-V123 VanDerWaalsContact O-N 3.15Å; S121-V123 PolarHBondContact O-N 2.86Å; V123-S125 PolarHBondContact O-N 3.37Å; V123-S126 PolarHBondContact O-N 3.49Å; V123-S126 VanDerWaalsContact O-N 3.08Å; V123-V127 HydrophobicContact CG1-CG2 4.47Å; V123-V127 WeakPolarHBondContact O-CG2 3.38Å; V123-V127 PolarHBondContact O-N 3.24Å
124	R	93.8	Very high	93.6	Very high	7 Å²	7	32.9 Å²	32.9	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-54.1	-41.9	175.6	-174.1	170.9	64.9	-100.2	-1.1	112.3	L116 E118 S119 I120 S121 V127 A128 N160 H163	L116-R124 WeakPolarHBondContact O-CD 3.42Å; L116-R124 WeakPolarHBondContact O-CG 3.28Å; E118-R124 HydrophobicContact CB-CB 4.22Å; E118-R124 WeakPolarHBondContact O-CD 3.28Å; E118-R124 PolarHBondContact O-NH1 2.93Å; S119-R124 PolarHBondContact O-NH1 3.12Å; I120-R124 PolarHBondContact O-N 3.48Å; S121-R124 PolarHBondContact O-N 3.18Å; S121-R124 PolarHBondContact OG-NH2 3.46Å; R124-V127 PolarHBondContact O-N 3Å; R124-A128 WeakPolarHBondContact O-CB 3.39Å; R124-A128 PolarHBondContact O-N 3.34Å; R124-N160 VanDerWaalsContact CD-O 3.26Å; R124-N160 WeakPolarHBondContact CD-O 3.47Å; R124-H163 PolarHBondContact NE-ND1 3.44Å; R124-H163 VanDerWaalsContact NE-ND1 3.1Å; R124-H163 PolarHBondContact NH2-ND1 3.03Å
125	S	90.8	Very high	93.7	Very high	10 Å²	10	29.7 Å²	29.7	7%	0.07	15%	0.154	C	C	.	.	H	α-helix	trans	-67.5	-39.9	177.9	-63.1	0	0	0	0	112.9	S121 V123 A128 Y129 R167	S121-S125 WeakPolarHBondContact O-CB 3.33Å; S121-S125 PolarHBondContact O-N 3.32Å; S121-S125 PolarHBondContact O-OG 2.77Å; V123-S125 PolarHBondContact O-N 3.37Å; S125-A128 PolarHBondContact O-N 3.06Å; S125-Y129 PolarHBondContact O-N 2.94Å; S125-R167 VanDerWaalsContact CB-NH1 3.34Å; S125-R167 PolarHBondContact OG-NH1 3.31Å; S125-R167 VanDerWaalsContact OG-NH1 3.12Å
126	S	92.5	Very high	93.8	Very high	9 Å²	9	33.9 Å²	33.9	6%	0.063	17%	0.173	C	C	.	.	H	α-helix	trans	-68.2	-38.6	176.2	-58.9	0	0	0	0	112	S77 K122 V123 Y129 A130	S77-S126 WeakPolarHBondContact OG-CB 3.28Å; S77-S126 PolarHBondContact OG-OG 3.5Å; K122-S126 PolarHBondContact O-N 3.36Å; K122-S126 VanDerWaalsContact O-N 3.11Å; K122-S126 PolarHBondContact O-OG 3.3Å; V123-S126 PolarHBondContact O-N 3.49Å; V123-S126 VanDerWaalsContact O-N 3.08Å; S126-Y129 PolarHBondContact O-N 2.75Å; S126-A130 PolarHBondContact O-N 3.03Å; S126-A130 VanDerWaalsContact O-N 3.08Å
127	V	95.6	Very high	93.8	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-63.7	-47.1	173	172.9	0	0	0	0	110.6	T63 L112 L116 V123 R124 Y129 A130 V131	T63-V127 HydrophobicContact CG2-CG2 3.58Å; L112-V127 HydrophobicContact CB-CG1 4.36Å; L112-V127 HydrophobicContact CD2-CG1 4.21Å; L112-V127 WeakPolarHBondContact O-CG1 3.27Å; L116-V127 HydrophobicContact CD2-CB 4.48Å; L116-V127 HydrophobicContact CD2-CG1 3.87Å; L116-V127 HydrophobicContact CG-CG1 4.22Å; V123-V127 HydrophobicContact CG1-CG2 4.47Å; V123-V127 WeakPolarHBondContact O-CG2 3.38Å; V123-V127 PolarHBondContact O-N 3.24Å; R124-V127 PolarHBondContact O-N 3Å; V127-Y129 VanDerWaalsContact C-N 3.3Å; V127-Y129 PolarHBondContact O-N 3.08Å; V127-A130 PolarHBondContact O-N 3.44Å; V127-A130 VanDerWaalsContact O-N 3.17Å; V127-V131 HydrophobicContact CG1-CG2 4.35Å; V127-V131 WeakPolarHBondContact O-CG2 3.46Å; V127-V131 PolarHBondContact O-N 2.98Å
128	A	95.4	Very high	93.9	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-56.7	-44.8	177	0	0	0	0	0	111.8	L116 R124 S125 A130 V131 S132 R167 V168	L116-A128 HydrophobicContact CD2-CB 3.84Å; R124-A128 WeakPolarHBondContact O-CB 3.39Å; R124-A128 PolarHBondContact O-N 3.34Å; S125-A128 PolarHBondContact O-N 3.06Å; A128-A130 PolarHBondContact O-N 3.11Å; A128-V131 PolarHBondContact O-N 3.32Å; A128-S132 PolarHBondContact O-N 2.93Å; A128-S132 PolarHBondContact O-OG 3.3Å; A128-R167 HydrophobicContact CB-CB 4.11Å; A128-R167 HydrophobicContact CB-CG 3.88Å; A128-V168 HydrophobicContact CB-CG2 3.68Å
129	Y	94.8	Very high	94	Very high	94 Å²	94	34.5 Å²	34.5	37%	0.369	18%	0.175	S	C	.	.	H	α-helix	trans	-58.7	-47.9	175.3	-174.6	-82.5	0	0	0	112.5	K81 E85 S125 S126 V127 V131 S132 A133	K81-Y129 HydrophobicContact CB-CD1 3.93Å; K81-Y129 HydrophobicContact CB-CE1 4.16Å; K81-Y129 HydrophobicContact CD-CD1 3.42Å; K81-Y129 VanDerWaalsContact CD-CD1 3.42Å; K81-Y129 HydrophobicContact CD-CE1 4.14Å; K81-Y129 HydrophobicContact CD-CG 3.7Å; K81-Y129 HydrophobicContact CG-CD1 3.6Å; K81-Y129 HydrophobicContact CG-CE1 4.32Å; K81-Y129 HydrophobicContact CG-CG 4.28Å; E85-Y129 HydrophobicContact CG-CE1 4.42Å; E85-Y129 PolarHBondContact OE1-OH 3.03Å; S125-Y129 PolarHBondContact O-N 2.94Å; S126-Y129 PolarHBondContact O-N 2.75Å; V127-Y129 VanDerWaalsContact C-N 3.3Å; V127-Y129 PolarHBondContact O-N 3.08Å; Y129-V131 VanDerWaalsContact C-N 3.3Å; Y129-V131 PolarHBondContact O-N 3.15Å; Y129-S132 PolarHBondContact O-N 3.42Å; Y129-A133 WeakPolarHBondContact O-CB 3.49Å; Y129-A133 PolarHBondContact O-N 3.27Å
130	A	96.7	Very high	94.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.6	-39.2	178.1	0	0	0	0	0	111.7	K81 V84 L112 S126 V127 A128 A133 I134	K81-A130 HydrophobicContact CG-CB 4.5Å; V84-A130 HydrophobicContact CG2-CB 4.48Å; L112-A130 HydrophobicContact CD1-CB 4.13Å; S126-A130 PolarHBondContact O-N 3.03Å; S126-A130 VanDerWaalsContact O-N 3.08Å; V127-A130 PolarHBondContact O-N 3.44Å; V127-A130 VanDerWaalsContact O-N 3.17Å; A128-A130 PolarHBondContact O-N 3.11Å; A130-A133 PolarHBondContact O-N 3.49Å; A130-I134 VanDerWaalsContact O-CG1 3.23Å; A130-I134 WeakPolarHBondContact O-CG1 3.39Å; A130-I134 PolarHBondContact O-N 3.39Å
131	V	97.9	Very high	94.5	Very high	1 Å²	1	37 Å²	37	1%	0.006	18%	0.179	C	C	.	.	H	α-helix	trans	-64	-43.9	175.2	175.5	0	0	0	0	111.2	L112 V127 A128 Y129 I134 A135 W143 L146 V168	L112-V131 HydrophobicContact CB-CG2 3.81Å; L112-V131 HydrophobicContact CD1-CG2 4.26Å; V127-V131 HydrophobicContact CG1-CG2 4.35Å; V127-V131 WeakPolarHBondContact O-CG2 3.46Å; V127-V131 PolarHBondContact O-N 2.98Å; A128-V131 PolarHBondContact O-N 3.32Å; Y129-V131 VanDerWaalsContact C-N 3.3Å; Y129-V131 PolarHBondContact O-N 3.15Å; V131-I134 PolarHBondContact O-N 3.21Å; V131-A135 WeakPolarHBondContact O-CB 3.18Å; V131-A135 PolarHBondContact O-N 2.96Å; V131-W143 HydrophobicContact CG1-CH2 4.11Å; V131-W143 HydrophobicContact CG1-CZ3 4.2Å; V131-L146 HydrophobicContact CG1-CD1 4.03Å; V131-V168 HydrophobicContact CB-CG1 4.38Å; V131-V168 HydrophobicContact CB-CG2 4.08Å; V131-V168 HydrophobicContact CG1-CG1 3.68Å; V131-V168 HydrophobicContact CG1-CG2 4.09Å
132	S	96.4	Very high	94.8	Very high	17 Å²	17	36.4 Å²	36.4	12%	0.119	18%	0.178	C	C	.	.	H	α-helix	trans	-62.5	-43.3	175.9	-59.9	0	0	0	0	112.2	A128 Y129 I134 A135 H136	A128-S132 PolarHBondContact O-N 2.93Å; A128-S132 PolarHBondContact O-OG 3.3Å; Y129-S132 PolarHBondContact O-N 3.42Å; S132-I134 VanDerWaalsContact C-N 3.29Å; S132-I134 PolarHBondContact O-N 2.91Å; S132-A135 WeakPolarHBondContact O-CB 3.48Å; S132-A135 PolarHBondContact O-N 3.43Å; S132-A135 VanDerWaalsContact O-N 3.11Å; S132-H136 PolarHBondContact O-N 3.48Å
133	A	95.9	Very high	95.3	Very high	20 Å²	20	29.5 Å²	29.5	17%	0.165	15%	0.148	C	C	.	.	H	α-helix	trans	-63.4	-34.5	176.9	0	0	0	0	0	112.6	V84 Y129 A130 W137	V84-A133 HydrophobicContact CG1-CB 3.68Å; Y129-A133 WeakPolarHBondContact O-CB 3.49Å; Y129-A133 PolarHBondContact O-N 3.27Å; A130-A133 PolarHBondContact O-N 3.49Å; A133-W137 VanDerWaalsContact O-CD1 3.28Å
134	I	97.8	Very high	95.5	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-69.4	-44.4	171.4	-67	166.1	0	0	0	110.4	V84 W88 I108 R109 L112 A130 V131 S132 H136 W137 D138 W143	V84-I134 HydrophobicContact CG1-CG1 3.64Å; V84-I134 HydrophobicContact CG2-CD1 4.32Å; V84-I134 HydrophobicContact CG2-CG1 4.25Å; W88-I134 HydrophobicContact CD2-CG1 3.91Å; W88-I134 HydrophobicContact CE3-CD1 4.36Å; W88-I134 HydrophobicContact CE3-CG1 4.02Å; W88-I134 HydrophobicContact CH2-CD1 3.55Å; W88-I134 HydrophobicContact CH2-CG1 3.79Å; W88-I134 HydrophobicContact CH2-CG2 4.13Å; W88-I134 HydrophobicContact CZ2-CB 4.14Å; W88-I134 HydrophobicContact CZ2-CD1 3.92Å; W88-I134 HydrophobicContact CZ2-CG1 3.7Å; W88-I134 HydrophobicContact CZ2-CG2 3.36Å; W88-I134 HydrophobicContact CZ3-CD1 3.81Å; W88-I134 HydrophobicContact CZ3-CG1 3.96Å; I108-I134 HydrophobicContact CG2-CD1 3.91Å; R109-I134 HydrophobicContact CG-CG2 4.14Å; L112-I134 HydrophobicContact CD1-CD1 3.58Å; A130-I134 VanDerWaalsContact O-CG1 3.23Å; A130-I134 WeakPolarHBondContact O-CG1 3.39Å; A130-I134 PolarHBondContact O-N 3.39Å; V131-I134 PolarHBondContact O-N 3.21Å; S132-I134 VanDerWaalsContact C-N 3.29Å; S132-I134 PolarHBondContact O-N 2.91Å; I134-H136 VanDerWaalsContact C-N 3.28Å; I134-H136 PolarHBondContact O-N 2.9Å; I134-W137 PolarHBondContact O-N 3.49Å; I134-W137 VanDerWaalsContact O-N 3.09Å; I134-D138 HydrophobicContact CG2-CB 4.17Å; I134-D138 WeakPolarHBondContact CG2-OD2 3.27Å; I134-D138 WeakPolarHBondContact O-CB 3.43Å; I134-D138 PolarHBondContact O-N 3.48Å; I134-W143 HydrophobicContact CB-CE3 4.45Å; I134-W143 HydrophobicContact CB-CZ3 4.01Å; I134-W143 HydrophobicContact CG2-CE3 3.55Å; I134-W143 HydrophobicContact CG2-CZ3 3.49Å; I134-W143 VanDerWaalsContact CG2-CZ3 3.49Å
135	A	96.8	Very high	95.6	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.008	19%	0.194	C	C	.	.	H	α-helix	trans	-57.6	-40.7	-178.2	0	0	0	0	0	112	V131 S132 W137 D138 W139 L146	V131-A135 WeakPolarHBondContact O-CB 3.18Å; V131-A135 PolarHBondContact O-N 2.96Å; S132-A135 WeakPolarHBondContact O-CB 3.48Å; S132-A135 PolarHBondContact O-N 3.43Å; S132-A135 VanDerWaalsContact O-N 3.11Å; A135-W137 PolarHBondContact O-N 2.86Å; A135-W137 VanDerWaalsContact O-N 3.14Å; A135-D138 PolarHBondContact O-N 2.9Å; A135-W139 WeakPolarHBondContact O-CB 3.34Å; A135-W139 PolarHBondContact O-N 3.47Å; A135-L146 HydrophobicContact CB-CD2 3.51Å
136	H	95.9	Very high	95.9	Very high	91 Å²	91	37.4 Å²	37.4	42%	0.421	19%	0.191	S	C	.	.	H	α-helix	trans	-51.9	-35.3	175.7	-179.6	73	0	0	0	113.8	S132 I134 E175	S132-H136 PolarHBondContact O-N 3.48Å; I134-H136 VanDerWaalsContact C-N 3.28Å; I134-H136 PolarHBondContact O-N 2.9Å; H136-E175 IonicContact CE1-OE1 3.87Å; H136-E175 IonicContact CG-OE1 2.73Å; H136-E175 VanDerWaalsContact ND1-CD 3.33Å; H136-E175 IonicContact ND1-OE1 3.17Å; H136-E175 PolarHBondContact ND1-OE1 3.47Å; H136-E175 IonicContact ND1-OE2 2.75Å; H136-E175 PolarHBondContact ND1-OE2 3.2Å
137	W	95.4	Very high	96.1	Very high	92 Å²	92	37.9 Å²	37.9	35%	0.348	19%	0.192	S	C	.	.	H	α-helix	trans	-97	-30.8	-179.3	-64.2	110.1	0	0	0	114	C89 A133 I134 A135	C89-W137 HydrophobicContact CB-CD2 3.47Å; C89-W137 VanDerWaalsContact CB-CD2 3.47Å; C89-W137 HydrophobicContact CB-CE3 3.73Å; C89-W137 HydrophobicContact CB-CG 3.85Å; C89-W137 HydrophobicContact CB-CH2 4.33Å; C89-W137 HydrophobicContact CB-CZ2 4.12Å; C89-W137 HydrophobicContact CB-CZ3 4.16Å; C89-W137 VanDerWaalsContact SG-CZ3 3.56Å; A133-W137 VanDerWaalsContact O-CD1 3.28Å; I134-W137 PolarHBondContact O-N 3.49Å; I134-W137 VanDerWaalsContact O-N 3.09Å; A135-W137 PolarHBondContact O-N 2.86Å; A135-W137 VanDerWaalsContact O-N 3.14Å
138	D	96.8	Very high	96.1	Very high	8 Å²	8	41.6 Å²	41.6	4%	0.043	21%	0.214	C	C	.	.	H	α-helix	trans	-107.9	-14.4	-166.6	-72.1	-1.2	0	0	0	113.5	W88 R109 I134 A135 E141 A142 W143	W88-D138 VanDerWaalsContact CZ2-OD2 3.29Å; W88-D138 WeakPolarHBondContact CZ2-OD2 3.46Å; W88-D138 PolarHBondContact NE1-OD1 3.33Å; W88-D138 PolarHBondContact NE1-OD2 3.48Å; R109-D138 IonicContact CZ-OD2 3.42Å; R109-D138 IonicContact NH1-OD1 2.79Å; R109-D138 IonicContact NH1-OD2 2.69Å; R109-D138 PolarHBondContact NH1-OD2 2.67Å; I134-D138 HydrophobicContact CG2-CB 4.17Å; I134-D138 WeakPolarHBondContact CG2-OD2 3.27Å; I134-D138 WeakPolarHBondContact O-CB 3.43Å; I134-D138 PolarHBondContact O-N 3.48Å; A135-D138 PolarHBondContact O-N 2.9Å; D138-E141 PolarHBondContact O-N 3.11Å; D138-A142 HydrophobicContact CB-CB 3.86Å; D138-A142 CarbonylContact O-C 3.53Å; D138-A142 WeakPolarHBondContact O-CA 3.46Å; D138-A142 PolarHBondContact O-N 3.28Å; D138-W143 HydrophobicContact CB-CB 4.14Å; D138-W143 PolarHBondContact O-N 2.95Å
139	W	95.8	Very high	96.1	Very high	28 Å²	28	44 Å²	44	11%	0.106	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	138.9	174.4	177.3	-101.7	0	0	0	110.8	A135 P144 L146 F147 F172	A135-W139 WeakPolarHBondContact O-CB 3.34Å; A135-W139 PolarHBondContact O-N 3.47Å; W139-P144 VanDerWaalsContact CZ3-O 3.32Å; W139-P144 WeakPolarHBondContact CZ3-O 3.49Å; W139-L146 HydrophobicContact CE3-CB 4.17Å; W139-L146 HydrophobicContact CZ3-CB 4.4Å; W139-F147 HydrophobicContact CH2-CB 3.82Å; W139-F147 HydrophobicContact CZ2-CB 4.47Å; W139-F147 HydrophobicContact CZ3-CB 4.19Å; W139-F172 AromaticContact CD1-CE2 3.94Å; W139-F172 AromaticContact CD2-CE2 3.43Å; W139-F172 HydrophobicContact CD2-CE2 3.43Å; W139-F172 VanDerWaalsContact CD2-CE2 3.43Å; W139-F172 AromaticContact CD2-CZ 3.9Å; W139-F172 HydrophobicContact CD2-CZ 3.9Å; W139-F172 AromaticContact CE2-CE2 3.53Å; W139-F172 AromaticContact CE2-CZ 3.5Å; W139-F172 VanDerWaalsContact CE2-CZ 3.5Å; W139-F172 AromaticContact CE3-CE2 3.81Å; W139-F172 HydrophobicContact CE3-CE2 3.81Å; W139-F172 HydrophobicContact CE3-CZ 4.3Å; W139-F172 HydrophobicContact CG-CD2 4.47Å; W139-F172 AromaticContact CG-CE2 3.74Å; W139-F172 HydrophobicContact CG-CE2 3.74Å; W139-F172 HydrophobicContact CG-CZ 4.48Å; W139-F172 HydrophobicContact CH2-CE2 4.39Å; W139-F172 HydrophobicContact CH2-CZ 4.06Å; W139-F172 HydrophobicContact CZ2-CE2 4.06Å; W139-F172 AromaticContact CZ2-CZ 3.61Å; W139-F172 HydrophobicContact CZ2-CZ 3.61Å; W139-F172 HydrophobicContact CZ3-CE2 4.26Å; W139-F172 HydrophobicContact CZ3-CZ 4.36Å; W139-F172 AromaticContact NE1-CE2 3.8Å; W139-F172 AromaticContact NE1-CZ 3.82Å
140	P	95.1	Very high	96.3	Very high	34 Å²	34	39.5 Å²	39.5	22%	0.221	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	cis	-88	-10.2	-4.7	33.1	-36.1	0	0	0	115.6	P144	P140-P144 WeakPolarHBondContact O-CA 3.42Å; P140-P144 WeakPolarHBondContact O-CB 3.22Å
141	E	94.4	Very high	96.3	Very high	154 Å²	154	40.6 Å²	40.6	72%	0.72	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-45.1	-164.2	-62.8	76.4	-167.3	0	0	114.3	D138	D138-E141 PolarHBondContact O-N 3.11Å
142	A	95.3	Very high	96.2	Very high	48 Å²	48	46 Å²	46	40%	0.397	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-17.2	-173.4	0	0	0	0	0	113.5	D138 P144	D138-A142 HydrophobicContact CB-CB 3.86Å; D138-A142 CarbonylContact O-C 3.53Å; D138-A142 WeakPolarHBondContact O-CA 3.46Å; D138-A142 PolarHBondContact O-N 3.28Å; A142-P144 VanDerWaalsContact C-CD 3.49Å
143	W	97.1	Very high	96.2	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.015	24%	0.236	C	C	.	.			trans	-133.7	55.5	175.2	-157.1	-5.5	0	0	0	114	R109 P113 V131 I134 D138 Q145 L146	R109-W143 HydrophobicContact CB-CD2 4.23Å; R109-W143 HydrophobicContact CB-CE3 4.44Å; R109-W143 HydrophobicContact CB-CH2 4.03Å; R109-W143 HydrophobicContact CB-CZ2 3.8Å; R109-W143 HydrophobicContact CB-CZ3 4.36Å; R109-W143 HydrophobicContact CG-CD2 3.86Å; R109-W143 HydrophobicContact CG-CE3 3.7Å; R109-W143 HydrophobicContact CG-CH2 3.93Å; R109-W143 HydrophobicContact CG-CZ2 4.09Å; R109-W143 HydrophobicContact CG-CZ3 3.75Å; R109-W143 VanDerWaalsContact O-CZ2 3.25Å; R109-W143 WeakPolarHBondContact O-CZ2 3.24Å; P113-W143 HydrophobicContact CG-CH2 4.26Å; P113-W143 HydrophobicContact CG-CZ2 3.83Å; V131-W143 HydrophobicContact CG1-CH2 4.11Å; V131-W143 HydrophobicContact CG1-CZ3 4.2Å; I134-W143 HydrophobicContact CB-CE3 4.45Å; I134-W143 HydrophobicContact CB-CZ3 4.01Å; I134-W143 HydrophobicContact CG2-CE3 3.55Å; I134-W143 HydrophobicContact CG2-CZ3 3.49Å; I134-W143 VanDerWaalsContact CG2-CZ3 3.49Å; D138-W143 HydrophobicContact CB-CB 4.14Å; D138-W143 PolarHBondContact O-N 2.95Å; W143-Q145 PolarHBondContact O-N 3.36Å; W143-L146 HydrophobicContact CB-CB 4.45Å; W143-L146 HydrophobicContact CD2-CB 4Å; W143-L146 HydrophobicContact CD2-CD1 4.16Å; W143-L146 HydrophobicContact CD2-CD2 4.31Å; W143-L146 HydrophobicContact CD2-CG 4.38Å; W143-L146 HydrophobicContact CE3-CD1 4.28Å; W143-L146 HydrophobicContact CE3-CD2 4.09Å; W143-L146 HydrophobicContact CG-CB 3.87Å; W143-L146 HydrophobicContact CH2-CD1 4.1Å; W143-L146 HydrophobicContact CZ2-CD1 3.93Å; W143-L146 HydrophobicContact CZ3-CD1 4.24Å; W143-L146 VanDerWaalsContact O-CB 3.32Å; W143-L146 WeakPolarHBondContact O-CB 3.32Å; W143-L146 PolarHBondContact O-N 3.33Å
144	P	95.5	Very high	96.1	Very high	75 Å²	75	44.6 Å²	44.6	49%	0.487	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.3	-172.6	24.3	-34.6	0	0	0	115.4	W139 P140 A142	W139-P144 VanDerWaalsContact CZ3-O 3.32Å; W139-P144 WeakPolarHBondContact CZ3-O 3.49Å; P140-P144 WeakPolarHBondContact O-CA 3.42Å; P140-P144 WeakPolarHBondContact O-CB 3.22Å; A142-P144 VanDerWaalsContact C-CD 3.49Å
145	Q	95.9	Very high	95.9	Very high	108 Å²	108	48.7 Å²	48.7	51%	0.505	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-4.2	178.7	64.1	-83	19.7	0	0	114	W143 F147 T148 L149	W143-Q145 PolarHBondContact O-N 3.36Å; Q145-F147 PolarHBondContact O-N 2.96Å; Q145-T148 PolarHBondContact O-N 3.5Å; Q145-L149 WeakPolarHBondContact O-CB 3.47Å; Q145-L149 PolarHBondContact O-N 3.32Å
146	L	96.4	Very high	95.7	Very high	1 Å²	1	51 Å²	51	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-57.3	-47.5	-176.1	177.7	59.5	0	0	0	112	V131 A135 W139 W143 T148 L149 L150 F172	V131-L146 HydrophobicContact CG1-CD1 4.03Å; A135-L146 HydrophobicContact CB-CD2 3.51Å; W139-L146 HydrophobicContact CE3-CB 4.17Å; W139-L146 HydrophobicContact CZ3-CB 4.4Å; W143-L146 HydrophobicContact CB-CB 4.45Å; W143-L146 HydrophobicContact CD2-CB 4Å; W143-L146 HydrophobicContact CD2-CD1 4.16Å; W143-L146 HydrophobicContact CD2-CD2 4.31Å; W143-L146 HydrophobicContact CD2-CG 4.38Å; W143-L146 HydrophobicContact CE3-CD1 4.28Å; W143-L146 HydrophobicContact CE3-CD2 4.09Å; W143-L146 HydrophobicContact CG-CB 3.87Å; W143-L146 HydrophobicContact CH2-CD1 4.1Å; W143-L146 HydrophobicContact CZ2-CD1 3.93Å; W143-L146 HydrophobicContact CZ3-CD1 4.24Å; W143-L146 VanDerWaalsContact O-CB 3.32Å; W143-L146 WeakPolarHBondContact O-CB 3.32Å; W143-L146 PolarHBondContact O-N 3.33Å; L146-T148 PolarHBondContact O-N 2.88Å; L146-L149 WeakPolarHBondContact O-CB 3.37Å; L146-L149 PolarHBondContact O-N 3.08Å; L146-L150 HydrophobicContact CD1-CD1 3.99Å; L146-L150 HydrophobicContact CD1-CG 4.1Å; L146-L150 HydrophobicContact CG-CD1 3.99Å; L146-L150 WeakPolarHBondContact O-CG 3.43Å; L146-L150 PolarHBondContact O-N 2.69Å; L146-F172 HydrophobicContact CD2-CD2 3.91Å; L146-F172 HydrophobicContact CD2-CE2 4.14Å; L146-F172 HydrophobicContact CG-CD2 4.38Å; L146-F172 HydrophobicContact CG-CE2 4.37Å
147	F	96.8	Very high	95.2	Very high	19 Å²	19	50 Å²	50	8%	0.083	28%	0.283	C	S	.	.	H	α-helix	trans	-58.2	-49.6	179.8	179.8	-123.1	0	0	0	112.1	W139 Q145 L149 L150 M151 L169 F172 V184 V187 I188	W139-F147 HydrophobicContact CH2-CB 3.82Å; W139-F147 HydrophobicContact CZ2-CB 4.47Å; W139-F147 HydrophobicContact CZ3-CB 4.19Å; Q145-F147 PolarHBondContact O-N 2.96Å; F147-L149 VanDerWaalsContact C-N 3.3Å; F147-L149 PolarHBondContact O-N 2.89Å; F147-L150 PolarHBondContact O-N 2.98Å; F147-M151 HydrophobicContact CD2-CG 4.21Å; F147-M151 HydrophobicContact CE1-CG 4.23Å; F147-M151 HydrophobicContact CE2-CG 3.78Å; F147-M151 HydrophobicContact CE2-SD 3.83Å; F147-M151 HydrophobicContact CZ-CG 3.8Å; F147-M151 HydrophobicContact CZ-SD 4Å; F147-M151 WeakPolarHBondContact O-CG 3.33Å; F147-M151 PolarHBondContact O-N 3.1Å; F147-L169 HydrophobicContact CD2-CD2 4.45Å; F147-F172 HydrophobicContact CB-CE1 4.18Å; F147-F172 HydrophobicContact CB-CE2 4.44Å; F147-F172 HydrophobicContact CB-CZ 3.69Å; F147-F172 HydrophobicContact CD2-CD1 4.4Å; F147-F172 AromaticContact CD2-CE1 3.54Å; F147-F172 HydrophobicContact CD2-CE1 3.54Å; F147-F172 AromaticContact CD2-CZ 3.97Å; F147-F172 HydrophobicContact CD2-CZ 3.97Å; F147-F172 HydrophobicContact CE2-CE1 4.34Å; F147-F172 HydrophobicContact CG-CE1 4.17Å; F147-F172 HydrophobicContact CG-CZ 4.14Å; F147-V184 HydrophobicContact CD1-CG2 4.36Å; F147-V184 HydrophobicContact CD2-CG1 4.49Å; F147-V184 HydrophobicContact CE1-CG2 4.27Å; F147-V184 HydrophobicContact CE2-CG1 3.85Å; F147-V184 HydrophobicContact CZ-CB 4.3Å; F147-V184 HydrophobicContact CZ-CG1 3.88Å; F147-V184 HydrophobicContact CZ-CG2 4.39Å; F147-V187 HydrophobicContact CE1-CB 4.15Å; F147-V187 HydrophobicContact CE1-CG1 4.13Å; F147-V187 HydrophobicContact CZ-CB 4.07Å; F147-V187 HydrophobicContact CZ-CG1 4.07Å; F147-I188 HydrophobicContact CE2-CB 4.23Å; F147-I188 HydrophobicContact CE2-CD1 4.29Å; F147-I188 HydrophobicContact CZ-CB 4.2Å
148	T	96.1	Very high	95	Very high	79 Å²	79	48 Å²	48	49%	0.485	28%	0.279	S	S	.	.	H	α-helix	trans	-60.4	-41.5	178.9	-51.1	0	0	0	0	111.6	Q145 L146 L150 M151 E152	Q145-T148 PolarHBondContact O-N 3.5Å; L146-T148 PolarHBondContact O-N 2.88Å; T148-L150 PolarHBondContact O-N 2.89Å; T148-M151 PolarHBondContact O-N 3.48Å; T148-E152 WeakPolarHBondContact O-CG 3.38Å; T148-E152 PolarHBondContact O-N 3.2Å
149	L	96.4	Very high	94.7	Very high	49 Å²	49	51.1 Å²	51.1	26%	0.257	30%	0.298	S	S	.	.	H	α-helix	trans	-62.4	-41.4	178.2	-175.2	66.8	0	0	0	112.5	P113 Q145 L146 F147 E152 M153	P113-L149 HydrophobicContact CB-CD2 3.44Å; P113-L149 VanDerWaalsContact CB-CD2 3.44Å; P113-L149 HydrophobicContact CB-CG 4.27Å; P113-L149 HydrophobicContact CG-CD2 3.45Å; P113-L149 VanDerWaalsContact CG-CD2 3.45Å; Q145-L149 WeakPolarHBondContact O-CB 3.47Å; Q145-L149 PolarHBondContact O-N 3.32Å; L146-L149 WeakPolarHBondContact O-CB 3.37Å; L146-L149 PolarHBondContact O-N 3.08Å; F147-L149 VanDerWaalsContact C-N 3.3Å; F147-L149 PolarHBondContact O-N 2.89Å; L149-E152 PolarHBondContact O-N 3.41Å; L149-M153 HydrophobicContact CG-CE 4.27Å; L149-M153 WeakPolarHBondContact O-CG 3.3Å; L149-M153 PolarHBondContact O-N 2.98Å
150	L	97.3	Very high	94.6	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-67.2	-40.9	176.1	-66.8	170.7	0	0	0	111.2	L116 L146 F147 T148 E152 M153 L154 A165 V168 L169 F172	L116-L150 HydrophobicContact CD1-CD2 3.92Å; L146-L150 HydrophobicContact CD1-CD1 3.99Å; L146-L150 HydrophobicContact CD1-CG 4.1Å; L146-L150 HydrophobicContact CG-CD1 3.99Å; L146-L150 WeakPolarHBondContact O-CG 3.43Å; L146-L150 PolarHBondContact O-N 2.69Å; F147-L150 PolarHBondContact O-N 2.98Å; T148-L150 PolarHBondContact O-N 2.89Å; L150-E152 VanDerWaalsContact C-N 3.35Å; L150-E152 PolarHBondContact O-N 3.16Å; L150-M153 WeakPolarHBondContact O-CB 3.46Å; L150-M153 PolarHBondContact O-N 3.31Å; L150-M153 VanDerWaalsContact O-N 3.14Å; L150-L154 PolarHBondContact O-N 3.27Å; L150-A165 HydrophobicContact CD2-CB 4.13Å; L150-V168 HydrophobicContact CD1-CB 4.3Å; L150-V168 HydrophobicContact CD1-CG1 3.67Å; L150-V168 HydrophobicContact CD2-CB 3.95Å; L150-V168 HydrophobicContact CD2-CG1 3.96Å; L150-V168 HydrophobicContact CD2-CG2 4.39Å; L150-V168 HydrophobicContact CG-CG1 4.48Å; L150-L169 HydrophobicContact CB-CD1 4.4Å; L150-L169 HydrophobicContact CB-CD2 3.97Å; L150-L169 HydrophobicContact CB-CG 4.15Å; L150-L169 HydrophobicContact CD1-CD2 3.77Å; L150-L169 HydrophobicContact CD1-CG 4.13Å; L150-F172 HydrophobicContact CD1-CG 4.45Å
151	M	97.1	Very high	94.5	Very high	22 Å²	22	50.8 Å²	50.8	11%	0.108	30%	0.297	C	S	.	.	H	α-helix	trans	-62.3	-39.6	175.7	-68.7	-54.1	-54.6	0	0	112.5	F147 T148 M153 L154 V155 V187 I188 E191	F147-M151 HydrophobicContact CD2-CG 4.21Å; F147-M151 HydrophobicContact CE1-CG 4.23Å; F147-M151 HydrophobicContact CE2-CG 3.78Å; F147-M151 HydrophobicContact CE2-SD 3.83Å; F147-M151 HydrophobicContact CZ-CG 3.8Å; F147-M151 HydrophobicContact CZ-SD 4Å; F147-M151 WeakPolarHBondContact O-CG 3.33Å; F147-M151 PolarHBondContact O-N 3.1Å; T148-M151 PolarHBondContact O-N 3.48Å; M151-M153 VanDerWaalsContact C-N 3.25Å; M151-M153 PolarHBondContact O-N 3.33Å; M151-L154 HydrophobicContact CE-CD1 4.01Å; M151-L154 PolarHBondContact O-N 3.2Å; M151-L154 HydrophobicContact SD-CD1 3.92Å; M151-V155 PolarHBondContact O-N 3.08Å; M151-V187 HydrophobicContact CE-CG1 4.04Å; M151-V187 HydrophobicContact CG-CG1 4.22Å; M151-V187 HydrophobicContact SD-CG1 4.48Å; M151-I188 HydrophobicContact SD-CB 4.41Å; M151-I188 HydrophobicContact SD-CG1 4.21Å; M151-E191 HydrophobicContact CE-CB 3.87Å; M151-E191 HydrophobicContact CE-CG 4.25Å
152	E	96.1	Very high	94.5	Very high	116 Å²	116	43.5 Å²	43.5	54%	0.542	26%	0.263	S	S	.	.	H	α-helix	trans	-60.3	-35	174.3	-75.2	177.9	-173.1	0	0	112.4	T148 L149 L150 S156	T148-E152 WeakPolarHBondContact O-CG 3.38Å; T148-E152 PolarHBondContact O-N 3.2Å; L149-E152 PolarHBondContact O-N 3.41Å; L150-E152 VanDerWaalsContact C-N 3.35Å; L150-E152 PolarHBondContact O-N 3.16Å; E152-S156 WeakPolarHBondContact O-CB 3.4Å; E152-S156 PolarHBondContact O-N 3.13Å
153	M	95.8	Very high	94.4	Very high	5 Å²	5	42.2 Å²	42.2	3%	0.025	25%	0.249	C	C	.	.	H	α-helix	trans	-68.3	-39.2	175.9	-68.1	-177.3	-174.4	0	0	112.1	P113 L116 L149 L150 M151 V155 S156 A161 A165	P113-M153 HydrophobicContact CB-CE 3.74Å; P113-M153 WeakPolarHBondContact O-CE 3.41Å; L116-M153 HydrophobicContact CB-CE 4.38Å; L116-M153 HydrophobicContact CB-SD 3.86Å; L116-M153 HydrophobicContact CD1-CE 4.11Å; L116-M153 HydrophobicContact CD1-SD 3.71Å; L116-M153 HydrophobicContact CG-SD 4.41Å; L149-M153 HydrophobicContact CG-CE 4.27Å; L149-M153 WeakPolarHBondContact O-CG 3.3Å; L149-M153 PolarHBondContact O-N 2.98Å; L150-M153 WeakPolarHBondContact O-CB 3.46Å; L150-M153 PolarHBondContact O-N 3.31Å; L150-M153 VanDerWaalsContact O-N 3.14Å; M151-M153 VanDerWaalsContact C-N 3.25Å; M151-M153 PolarHBondContact O-N 3.33Å; M153-V155 VanDerWaalsContact C-N 3.33Å; M153-V155 PolarHBondContact O-N 3.49Å; M153-S156 WeakPolarHBondContact O-CB 3.44Å; M153-S156 PolarHBondContact O-N 3.07Å; M153-S156 PolarHBondContact O-OG 2.97Å; M153-A161 HydrophobicContact CB-CB 4.19Å; M153-A165 HydrophobicContact CB-CB 3.74Å; M153-A165 HydrophobicContact SD-CB 4.27Å
154	L	94.9	Very high	94.2	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-60.8	-41.6	177.4	-62.2	-173.7	0	0	0	112.2	L150 M151 S156 V162 A165 M166 L169 E191 M192 I195	L150-L154 PolarHBondContact O-N 3.27Å; M151-L154 HydrophobicContact CE-CD1 4.01Å; M151-L154 PolarHBondContact O-N 3.2Å; M151-L154 HydrophobicContact SD-CD1 3.92Å; L154-S156 VanDerWaalsContact C-N 3.34Å; L154-S156 PolarHBondContact O-N 3.48Å; L154-V162 HydrophobicContact CD2-CG1 4.09Å; L154-V162 WeakPolarHBondContact O-CG2 3.49Å; L154-A165 HydrophobicContact CD2-CB 3.88Å; L154-A165 HydrophobicContact CG-CB 4.49Å; L154-M166 HydrophobicContact CD1-SD 4.41Å; L154-M166 HydrophobicContact CD2-CG 3.75Å; L154-M166 HydrophobicContact CD2-SD 3.75Å; L154-L169 HydrophobicContact CD1-CD1 3.62Å; L154-L169 HydrophobicContact CD2-CD1 4.12Å; L154-L169 HydrophobicContact CG-CD1 4.07Å; L154-E191 HydrophobicContact CB-CG 3.91Å; L154-E191 HydrophobicContact CD1-CB 4.4Å; L154-E191 HydrophobicContact CD1-CG 3.79Å; L154-M192 HydrophobicContact CD1-CE 3.6Å; L154-I195 HydrophobicContact CD1-CD1 4.33Å; L154-I195 HydrophobicContact CD2-CD1 4.03Å
155	V	93.6	Very high	94.3	Very high	86 Å²	86	38.5 Å²	38.5	52%	0.521	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	0.3	-177.9	-57.4	0	0	0	0	113.9	M151 M153 G157	M151-V155 PolarHBondContact O-N 3.08Å; M153-V155 VanDerWaalsContact C-N 3.33Å; M153-V155 PolarHBondContact O-N 3.49Å; V155-G157 VanDerWaalsContact C-N 3.27Å; V155-G157 PolarHBondContact O-N 2.93Å
156	S	91.7	Very high	94.3	Very high	51 Å²	51	33.4 Å²	33.4	36%	0.357	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-15.1	-173.4	70.1	0	0	0	0	115	R117 E152 M153 L154 D158	R117-S156 PolarHBondContact NH1-OG 3.39Å; E152-S156 WeakPolarHBondContact O-CB 3.4Å; E152-S156 PolarHBondContact O-N 3.13Å; M153-S156 WeakPolarHBondContact O-CB 3.44Å; M153-S156 PolarHBondContact O-N 3.07Å; M153-S156 PolarHBondContact O-OG 2.97Å; L154-S156 VanDerWaalsContact C-N 3.34Å; L154-S156 PolarHBondContact O-N 3.48Å; S156-D158 PolarHBondContact O-N 2.98Å
157	G	85.6	Confident	94.1	Very high	68 Å²	68	35 Å²	35	70%	0.701	21%	0.207	S	C	*	.	S	Bend	trans	78.2	-1.4	-175.6	0	0	0	0	0	114.7	V155	V155-G157 VanDerWaalsContact C-N 3.27Å; V155-G157 PolarHBondContact O-N 2.93Å
158	D	91.9	Very high	94.1	Very high	50 Å²	50	34.1 Å²	34.1	27%	0.267	20%	0.203	S	C	.	.			trans	-89.4	112.3	173.9	176.2	3.4	0	0	0	110.4	R117 S156 N160 A161 V162	R117-D158 IonicContact NH1-OD2 3.94Å; S156-D158 PolarHBondContact O-N 2.98Å; D158-N160 PolarHBondContact O-N 3.23Å; D158-N160 WeakPolarHBondContact OD1-CB 3.41Å; D158-N160 PolarHBondContact OD1-N 3.04Å; D158-A161 HydrophobicContact CB-CB 3.79Å; D158-A161 WeakPolarHBondContact O-CB 3.4Å; D158-A161 PolarHBondContact O-N 3Å; D158-A161 VanDerWaalsContact O-N 3.1Å; D158-V162 WeakPolarHBondContact O-CG2 3.14Å; D158-V162 PolarHBondContact O-N 3.3Å
159	V	90.6	Very high	94.1	Very high	74 Å²	74	30.4 Å²	30.4	45%	0.448	18%	0.18	S	C	.	.	H	α-helix	trans	-60.2	-32.9	-178.2	-179.1	0	0	0	0	112.1	H163	V159-H163 WeakPolarHBondContact O-CB 3.41Å; V159-H163 PolarHBondContact O-N 2.81Å
160	N	92.2	Very high	94	Very high	55 Å²	55	28.3 Å²	28.3	29%	0.294	17%	0.17	S	C	.	.	H	α-helix	trans	-69.2	-43.5	176.8	-64.6	-44	0	0	0	110.4	L116 R124 D158 V162 H163 G164	L116-N160 VanDerWaalsContact O-O 3.09Å; R124-N160 VanDerWaalsContact CD-O 3.26Å; R124-N160 WeakPolarHBondContact CD-O 3.47Å; D158-N160 PolarHBondContact O-N 3.23Å; D158-N160 WeakPolarHBondContact OD1-CB 3.41Å; D158-N160 PolarHBondContact OD1-N 3.04Å; N160-V162 PolarHBondContact O-N 3.24Å; N160-H163 PolarHBondContact O-N 3.01Å; N160-G164 PolarHBondContact O-N 3.33Å
161	A	94.1	Very high	93.9	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.2	-44.7	176	0	0	0	0	0	111.8	R117 M153 D158 G164 A165	R117-A161 HydrophobicContact CG-CB 3.86Å; R117-A161 VanDerWaalsContact NH1-CB 3.33Å; M153-A161 HydrophobicContact CB-CB 4.19Å; D158-A161 HydrophobicContact CB-CB 3.79Å; D158-A161 WeakPolarHBondContact O-CB 3.4Å; D158-A161 PolarHBondContact O-N 3Å; D158-A161 VanDerWaalsContact O-N 3.1Å; A161-G164 PolarHBondContact O-N 3.36Å; A161-A165 VanDerWaalsContact O-CB 3.27Å; A161-A165 WeakPolarHBondContact O-CB 3.45Å; A161-A165 PolarHBondContact O-N 3.02Å
162	V	94.4	Very high	93.8	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.012	18%	0.183	C	C	.	.	H	α-helix	trans	-59.8	-49.2	175.5	177.2	0	0	0	0	110.1	L154 D158 N160 G164 A165 M166 I195 Y202 T206	L154-V162 HydrophobicContact CD2-CG1 4.09Å; L154-V162 WeakPolarHBondContact O-CG2 3.49Å; D158-V162 WeakPolarHBondContact O-CG2 3.14Å; D158-V162 PolarHBondContact O-N 3.3Å; N160-V162 PolarHBondContact O-N 3.24Å; V162-G164 PolarHBondContact O-N 2.98Å; V162-A165 PolarHBondContact O-N 3.14Å; V162-M166 HydrophobicContact CG1-CG 4.03Å; V162-M166 VanDerWaalsContact O-CB 3.29Å; V162-M166 WeakPolarHBondContact O-CB 3.24Å; V162-M166 WeakPolarHBondContact O-CG 3.35Å; V162-M166 PolarHBondContact O-N 2.83Å; V162-I195 HydrophobicContact CG1-CD1 4.04Å; V162-Y202 HydrophobicContact CB-CE1 4.18Å; V162-Y202 HydrophobicContact CG1-CD1 4.06Å; V162-Y202 HydrophobicContact CG1-CE1 3.75Å; V162-Y202 HydrophobicContact CG2-CE1 4.04Å; V162-T206 HydrophobicContact CG1-CG2 4.1Å
163	H	92	Very high	93.7	Very high	21 Å²	21	25.7 Å²	25.7	10%	0.097	16%	0.157	C	C	.	.	H	α-helix	trans	-59.6	-44.4	178.4	179.5	-65.2	0	0	0	112.4	R124 V159 N160 R167	R124-H163 PolarHBondContact NE-ND1 3.44Å; R124-H163 VanDerWaalsContact NE-ND1 3.1Å; R124-H163 PolarHBondContact NH2-ND1 3.03Å; V159-H163 WeakPolarHBondContact O-CB 3.41Å; V159-H163 PolarHBondContact O-N 2.81Å; N160-H163 PolarHBondContact O-N 3.01Å; H163-R167 PolarHBondContact O-N 2.94Å
164	G	93.6	Very high	93.6	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-63.3	-48.5	178.1	0	0	0	0	0	111.8	N160 A161 V162 R167 V168	N160-G164 PolarHBondContact O-N 3.33Å; A161-G164 PolarHBondContact O-N 3.36Å; V162-G164 PolarHBondContact O-N 2.98Å; G164-R167 PolarHBondContact O-N 3.11Å; G164-V168 PolarHBondContact O-N 2.86Å
165	A	96.9	Very high	93.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-65.2	-43.7	180	0	0	0	0	0	112.6	L150 M153 L154 A161 V162 R167 V168 L169	L150-A165 HydrophobicContact CD2-CB 4.13Å; M153-A165 HydrophobicContact CB-CB 3.74Å; M153-A165 HydrophobicContact SD-CB 4.27Å; L154-A165 HydrophobicContact CD2-CB 3.88Å; L154-A165 HydrophobicContact CG-CB 4.49Å; A161-A165 VanDerWaalsContact O-CB 3.27Å; A161-A165 WeakPolarHBondContact O-CB 3.45Å; A161-A165 PolarHBondContact O-N 3.02Å; V162-A165 PolarHBondContact O-N 3.14Å; A165-R167 VanDerWaalsContact C-N 3.25Å; A165-R167 PolarHBondContact O-N 3Å; A165-V168 PolarHBondContact O-N 3.1Å; A165-V168 VanDerWaalsContact O-N 3.11Å; A165-L169 WeakPolarHBondContact O-CB 3.48Å; A165-L169 VanDerWaalsContact O-CG 3.3Å; A165-L169 WeakPolarHBondContact O-CG 3.37Å; A165-L169 PolarHBondContact O-N 3.03Å
166	M	95.9	Very high	93.6	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-58.5	-38	176.8	-75.1	-62.9	-64.7	0	0	112.4	L154 V162 L169 T170 M192 I195 T206 R209 A210 I213	L154-M166 HydrophobicContact CD1-SD 4.41Å; L154-M166 HydrophobicContact CD2-CG 3.75Å; L154-M166 HydrophobicContact CD2-SD 3.75Å; V162-M166 HydrophobicContact CG1-CG 4.03Å; V162-M166 VanDerWaalsContact O-CB 3.29Å; V162-M166 WeakPolarHBondContact O-CB 3.24Å; V162-M166 WeakPolarHBondContact O-CG 3.35Å; V162-M166 PolarHBondContact O-N 2.83Å; M166-L169 PolarHBondContact O-N 3.31Å; M166-L169 HydrophobicContact SD-CD1 4.47Å; M166-T170 PolarHBondContact O-N 2.96Å; M166-T170 VanDerWaalsContact O-N 3.09Å; M166-T170 PolarHBondContact O-OG1 2.91Å; M166-M192 HydrophobicContact CE-CE 4.22Å; M166-M192 HydrophobicContact CE-SD 3.63Å; M166-M192 HydrophobicContact SD-CE 3.6Å; M166-M192 VanDerWaalsContact SD-CE 3.6Å; M166-M192 HydrophobicContact SD-SD 3.83Å; M166-I195 HydrophobicContact CG-CD1 4.23Å; M166-I195 HydrophobicContact SD-CD1 3.64Å; M166-T206 HydrophobicContact CB-CG2 4.41Å; M166-T206 HydrophobicContact CG-CG2 3.95Å; M166-R209 HydrophobicContact CE-CB 3.94Å; M166-A210 HydrophobicContact CE-CB 3.71Å; M166-A210 VanDerWaalsContact CE-N 3.33Å; M166-I213 HydrophobicContact CE-CD1 3.69Å; M166-I213 HydrophobicContact SD-CD1 4.2Å
167	R	92.7	Very high	93.8	Very high	36 Å²	36	31.3 Å²	31.3	14%	0.136	17%	0.172	C	C	.	.	H	α-helix	trans	-68	-35.7	177.2	-176	173.4	169.3	127.1	4.6	112.7	S125 A128 H163 G164 A165 S321 D322	S125-R167 VanDerWaalsContact CB-NH1 3.34Å; S125-R167 PolarHBondContact OG-NH1 3.31Å; S125-R167 VanDerWaalsContact OG-NH1 3.12Å; A128-R167 HydrophobicContact CB-CB 4.11Å; A128-R167 HydrophobicContact CB-CG 3.88Å; H163-R167 PolarHBondContact O-N 2.94Å; G164-R167 PolarHBondContact O-N 3.11Å; A165-R167 VanDerWaalsContact C-N 3.25Å; A165-R167 PolarHBondContact O-N 3Å; R167-S321 PolarHBondContact NH1-OG 3.4Å; R167-D322 IonicContact CZ-OD1 2.61Å; R167-D322 IonicContact CZ-OD2 3.2Å; R167-D322 VanDerWaalsContact NH1-CG 3.32Å; R167-D322 IonicContact NH1-OD1 3.8Å; R167-D322 PolarHBondContact NH1-OD1 3.09Å; R167-D322 IonicContact NH1-OD2 3.92Å; R167-D322 PolarHBondContact NH1-OD2 3.14Å; R167-D322 VanDerWaalsContact NH1-OD2 3.07Å; R167-D322 IonicContact NH2-OD1 3.99Å; R167-D322 PolarHBondContact NH2-OD1 3.02Å; R167-D322 IonicContact NH2-OD2 3.02Å
168	V	96.8	Very high	94.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-71	-42.6	172	179.3	0	0	0	0	110.4	L116 A128 V131 L150 G164 A165 T170 E171 F172	L116-V168 HydrophobicContact CD1-CG2 4.07Å; L116-V168 HydrophobicContact CD2-CG2 3.84Å; A128-V168 HydrophobicContact CB-CG2 3.68Å; V131-V168 HydrophobicContact CB-CG1 4.38Å; V131-V168 HydrophobicContact CB-CG2 4.08Å; V131-V168 HydrophobicContact CG1-CG1 3.68Å; V131-V168 HydrophobicContact CG1-CG2 4.09Å; L150-V168 HydrophobicContact CD1-CB 4.3Å; L150-V168 HydrophobicContact CD1-CG1 3.67Å; L150-V168 HydrophobicContact CD2-CB 3.95Å; L150-V168 HydrophobicContact CD2-CG1 3.96Å; L150-V168 HydrophobicContact CD2-CG2 4.39Å; L150-V168 HydrophobicContact CG-CG1 4.48Å; G164-V168 PolarHBondContact O-N 2.86Å; A165-V168 PolarHBondContact O-N 3.1Å; A165-V168 VanDerWaalsContact O-N 3.11Å; V168-T170 VanDerWaalsContact C-N 3.3Å; V168-T170 PolarHBondContact O-N 3.49Å; V168-E171 PolarHBondContact O-N 3.02Å; V168-F172 VanDerWaalsContact O-CB 3.32Å; V168-F172 WeakPolarHBondContact O-CB 3.3Å; V168-F172 PolarHBondContact O-N 3.37Å
169	L	97.5	Very high	94.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62.2	-34.4	-175.9	-77.2	169.8	0	0	0	113	F147 L150 L154 A165 M166 E171 F172 T173 I188 I213	F147-L169 HydrophobicContact CD2-CD2 4.45Å; L150-L169 HydrophobicContact CB-CD1 4.4Å; L150-L169 HydrophobicContact CB-CD2 3.97Å; L150-L169 HydrophobicContact CB-CG 4.15Å; L150-L169 HydrophobicContact CD1-CD2 3.77Å; L150-L169 HydrophobicContact CD1-CG 4.13Å; L154-L169 HydrophobicContact CD1-CD1 3.62Å; L154-L169 HydrophobicContact CD2-CD1 4.12Å; L154-L169 HydrophobicContact CG-CD1 4.07Å; A165-L169 WeakPolarHBondContact O-CB 3.48Å; A165-L169 VanDerWaalsContact O-CG 3.3Å; A165-L169 WeakPolarHBondContact O-CG 3.37Å; A165-L169 PolarHBondContact O-N 3.03Å; M166-L169 PolarHBondContact O-N 3.31Å; M166-L169 HydrophobicContact SD-CD1 4.47Å; L169-E171 PolarHBondContact O-N 3.23Å; L169-F172 HydrophobicContact CD2-CD1 3.91Å; L169-F172 HydrophobicContact CD2-CG 4.49Å; L169-F172 PolarHBondContact O-N 2.87Å; L169-T173 WeakPolarHBondContact O-CB 3.49Å; L169-T173 VanDerWaalsContact O-CG2 3.32Å; L169-T173 WeakPolarHBondContact O-CG2 3.32Å; L169-T173 PolarHBondContact O-N 3.42Å; L169-T173 PolarHBondContact O-OG1 3.43Å; L169-I188 HydrophobicContact CD1-CD1 4.46Å; L169-I188 HydrophobicContact CD2-CD1 4.01Å; L169-I213 HydrophobicContact CB-CD1 3.66Å
170	T	94.1	Very high	94.5	Very high	5 Å²	5	33.4 Å²	33.4	3%	0.031	17%	0.166	C	C	.	.	H	α-helix	trans	-50.6	-57	171.4	-70.5	0	0	0	0	111.2	M166 V168 T173 E212	M166-T170 PolarHBondContact O-N 2.96Å; M166-T170 VanDerWaalsContact O-N 3.09Å; M166-T170 PolarHBondContact O-OG1 2.91Å; V168-T170 VanDerWaalsContact C-N 3.3Å; V168-T170 PolarHBondContact O-N 3.49Å; T170-T173 PolarHBondContact O-OG1 2.95Å; T170-T173 VanDerWaalsContact O-OG1 3.08Å; T170-E212 HydrophobicContact CG2-CG 4.3Å; T170-E212 WeakPolarHBondContact CG2-OE1 3.17Å; T170-E212 WeakPolarHBondContact CG2-OE2 3.29Å; T170-E212 PolarHBondContact OG1-OE2 3.27Å
171	E	93.4	Very high	94.6	Very high	83 Å²	83	30.8 Å²	30.8	39%	0.388	15%	0.152	S	C	.	.	H	α-helix	trans	-72.2	-41.3	179.4	-60.7	-49.7	133.5	0	0	112.1	V168 L169 T173 R174 E175	V168-E171 PolarHBondContact O-N 3.02Å; L169-E171 PolarHBondContact O-N 3.23Å; E171-T173 VanDerWaalsContact C-N 3.28Å; E171-T173 PolarHBondContact O-N 3.14Å; E171-R174 WeakPolarHBondContact O-CB 3.35Å; E171-R174 PolarHBondContact O-N 2.92Å; E171-R174 IonicContact OE1-NH1 3.83Å; E171-R174 PolarHBondContact OE1-NH1 2.87Å; E171-R174 IonicContact OE2-NH1 2.78Å; E171-E175 PolarHBondContact O-N 2.99Å
172	F	96.5	Very high	94.6	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-56.5	-41.5	179.2	170.6	-89.7	0	0	0	112.2	W139 L146 F147 L150 V168 L169 R174 E175 V176	W139-F172 AromaticContact CD1-CE2 3.94Å; W139-F172 AromaticContact CD2-CE2 3.43Å; W139-F172 HydrophobicContact CD2-CE2 3.43Å; W139-F172 VanDerWaalsContact CD2-CE2 3.43Å; W139-F172 AromaticContact CD2-CZ 3.9Å; W139-F172 HydrophobicContact CD2-CZ 3.9Å; W139-F172 AromaticContact CE2-CE2 3.53Å; W139-F172 AromaticContact CE2-CZ 3.5Å; W139-F172 VanDerWaalsContact CE2-CZ 3.5Å; W139-F172 AromaticContact CE3-CE2 3.81Å; W139-F172 HydrophobicContact CE3-CE2 3.81Å; W139-F172 HydrophobicContact CE3-CZ 4.3Å; W139-F172 HydrophobicContact CG-CD2 4.47Å; W139-F172 AromaticContact CG-CE2 3.74Å; W139-F172 HydrophobicContact CG-CE2 3.74Å; W139-F172 HydrophobicContact CG-CZ 4.48Å; W139-F172 HydrophobicContact CH2-CE2 4.39Å; W139-F172 HydrophobicContact CH2-CZ 4.06Å; W139-F172 HydrophobicContact CZ2-CE2 4.06Å; W139-F172 AromaticContact CZ2-CZ 3.61Å; W139-F172 HydrophobicContact CZ2-CZ 3.61Å; W139-F172 HydrophobicContact CZ3-CE2 4.26Å; W139-F172 HydrophobicContact CZ3-CZ 4.36Å; W139-F172 AromaticContact NE1-CE2 3.8Å; W139-F172 AromaticContact NE1-CZ 3.82Å; L146-F172 HydrophobicContact CD2-CD2 3.91Å; L146-F172 HydrophobicContact CD2-CE2 4.14Å; L146-F172 HydrophobicContact CG-CD2 4.38Å; L146-F172 HydrophobicContact CG-CE2 4.37Å; F147-F172 HydrophobicContact CB-CE1 4.18Å; F147-F172 HydrophobicContact CB-CE2 4.44Å; F147-F172 HydrophobicContact CB-CZ 3.69Å; F147-F172 HydrophobicContact CD2-CD1 4.4Å; F147-F172 AromaticContact CD2-CE1 3.54Å; F147-F172 HydrophobicContact CD2-CE1 3.54Å; F147-F172 AromaticContact CD2-CZ 3.97Å; F147-F172 HydrophobicContact CD2-CZ 3.97Å; F147-F172 HydrophobicContact CE2-CE1 4.34Å; F147-F172 HydrophobicContact CG-CE1 4.17Å; F147-F172 HydrophobicContact CG-CZ 4.14Å; L150-F172 HydrophobicContact CD1-CG 4.45Å; V168-F172 VanDerWaalsContact O-CB 3.32Å; V168-F172 WeakPolarHBondContact O-CB 3.3Å; V168-F172 PolarHBondContact O-N 3.37Å; L169-F172 HydrophobicContact CD2-CD1 3.91Å; L169-F172 HydrophobicContact CD2-CG 4.49Å; L169-F172 PolarHBondContact O-N 2.87Å; F172-R174 PolarHBondContact O-N 2.94Å; F172-E175 WeakPolarHBondContact O-CB 3.38Å; F172-E175 PolarHBondContact O-N 3.42Å; F172-V176 HydrophobicContact CD1-CG2 4.19Å; F172-V176 HydrophobicContact CE1-CG2 3.71Å; F172-V176 HydrophobicContact CZ-CG2 4.15Å; F172-V176 PolarHBondContact O-N 2.87Å
173	T	94.3	Very high	94.6	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.012	20%	0.201	C	C	.	.	H	α-helix	trans	-67.5	-21.1	179.2	55.6	0	0	0	0	113.8	L169 T170 E171 E175 V176 I188 I213	L169-T173 WeakPolarHBondContact O-CB 3.49Å; L169-T173 VanDerWaalsContact O-CG2 3.32Å; L169-T173 WeakPolarHBondContact O-CG2 3.32Å; L169-T173 PolarHBondContact O-N 3.42Å; L169-T173 PolarHBondContact O-OG1 3.43Å; T170-T173 PolarHBondContact O-OG1 2.95Å; T170-T173 VanDerWaalsContact O-OG1 3.08Å; E171-T173 VanDerWaalsContact C-N 3.28Å; E171-T173 PolarHBondContact O-N 3.14Å; T173-E175 VanDerWaalsContact C-N 3.34Å; T173-V176 PolarHBondContact O-N 3.19Å; T173-I188 HydrophobicContact CG2-CD1 3.62Å; T173-I213 HydrophobicContact CG2-CG2 3.84Å
174	R	93.1	Very high	94.8	Very high	124 Å²	124	38.5 Å²	38.5	47%	0.468	20%	0.197	S	C	.	.	H	α-helix	trans	-74.4	-26.1	171	-63.7	178	163.8	125	8.5	112.4	E171 F172 V176 E212 T216	E171-R174 WeakPolarHBondContact O-CB 3.35Å; E171-R174 PolarHBondContact O-N 2.92Å; E171-R174 IonicContact OE1-NH1 3.83Å; E171-R174 PolarHBondContact OE1-NH1 2.87Å; E171-R174 IonicContact OE2-NH1 2.78Å; F172-R174 PolarHBondContact O-N 2.94Å; R174-V176 VanDerWaalsContact C-N 3.33Å; R174-E212 IonicContact CZ-OE1 3.33Å; R174-E212 IonicContact NH1-OE1 2.76Å; R174-E212 PolarHBondContact NH1-OE1 2.78Å; R174-E212 IonicContact NH2-OE1 2.83Å; R174-E212 PolarHBondContact NH2-OE1 3.24Å; R174-T216 HydrophobicContact CG-CG2 4.04Å
175	E	93.7	Very high	94.9	Very high	65 Å²	65	38.5 Å²	38.5	30%	0.304	20%	0.197	S	C	.	.	S	Bend	trans	-82.8	-9.1	173.8	-58.7	-61	157	0	0	113.2	H136 E171 F172 T173 T177	H136-E175 IonicContact CE1-OE1 3.87Å; H136-E175 IonicContact CG-OE1 2.73Å; H136-E175 VanDerWaalsContact ND1-CD 3.33Å; H136-E175 IonicContact ND1-OE1 3.17Å; H136-E175 PolarHBondContact ND1-OE1 3.47Å; H136-E175 IonicContact ND1-OE2 2.75Å; H136-E175 PolarHBondContact ND1-OE2 3.2Å; E171-E175 PolarHBondContact O-N 2.99Å; F172-E175 WeakPolarHBondContact O-CB 3.38Å; F172-E175 PolarHBondContact O-N 3.42Å; T173-E175 VanDerWaalsContact C-N 3.34Å; E175-T177 PolarHBondContact O-N 3.14Å
176	V	95.4	Very high	94.8	Very high	6 Å²	6	41.6 Å²	41.6	4%	0.036	22%	0.217	C	C	.	.			trans	-75.4	127.5	176.2	178.5	0	0	0	0	108.8	F172 T173 R174 Q180 M181 V184 L220	F172-V176 HydrophobicContact CD1-CG2 4.19Å; F172-V176 HydrophobicContact CE1-CG2 3.71Å; F172-V176 HydrophobicContact CZ-CG2 4.15Å; F172-V176 PolarHBondContact O-N 2.87Å; T173-V176 PolarHBondContact O-N 3.19Å; R174-V176 VanDerWaalsContact C-N 3.33Å; V176-Q180 HydrophobicContact CG1-CB 4.03Å; V176-M181 HydrophobicContact CB-CE 4.12Å; V176-M181 HydrophobicContact CG1-CB 4.15Å; V176-M181 HydrophobicContact CG1-CE 3.67Å; V176-M181 HydrophobicContact CG1-SD 4.34Å; V176-V184 HydrophobicContact CG1-CB 4.28Å; V176-V184 HydrophobicContact CG1-CG2 4.12Å; V176-V184 HydrophobicContact CG2-CG1 4.33Å; V176-V184 HydrophobicContact CG2-CG2 4.24Å; V176-L220 WeakPolarHBondContact O-CD2 3.48Å
177	T	94.9	Very high	94.8	Very high	66 Å²	66	45.1 Å²	45.1	41%	0.405	24%	0.238	S	C	.	.			trans	-100.1	173.6	176.9	64.1	0	0	0	0	111.9	E175 T179 Q180 M181	E175-T177 PolarHBondContact O-N 3.14Å; T177-T179 PolarHBondContact O-N 2.91Å; T177-T179 PolarHBondContact OG1-OG1 3.43Å; T177-Q180 PolarHBondContact O-N 3.24Å; T177-M181 WeakPolarHBondContact O-CB 3.33Å; T177-M181 PolarHBondContact O-N 3.31Å
178	D	93.4	Very high	95	Very high	94 Å²	94	43.4 Å²	43.4	50%	0.503	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-37.6	172.3	64.3	-38.5	0	0	0	113.2	Q180 P182 I224	D178-Q180 VanDerWaalsContact C-N 3.34Å; D178-Q180 PolarHBondContact O-N 3.07Å; D178-P182 WeakPolarHBondContact O-CD 3.44Å; D178-I224 HydrophobicContact CB-CD1 4.11Å; D178-I224 HydrophobicContact CB-CG1 3.8Å
179	T	93.6	Very high	95	Very high	92 Å²	92	43.5 Å²	43.5	56%	0.564	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-33	179.7	64.4	0	0	0	0	114	T177	T177-T179 PolarHBondContact O-N 2.91Å; T177-T179 PolarHBondContact OG1-OG1 3.43Å
180	Q	95.4	Very high	95	Very high	49 Å²	49	46.6 Å²	46.6	23%	0.229	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-22.7	-174.5	-59.8	-57.3	-15.5	0	0	113	V176 T177 D178 P182 L183 V184	V176-Q180 HydrophobicContact CG1-CB 4.03Å; T177-Q180 PolarHBondContact O-N 3.24Å; D178-Q180 VanDerWaalsContact C-N 3.34Å; D178-Q180 PolarHBondContact O-N 3.07Å; Q180-P182 VanDerWaalsContact C-CD 3.42Å; Q180-P182 VanDerWaalsContact C-N 3.31Å; Q180-L183 WeakPolarHBondContact O-CB 3.47Å; Q180-L183 PolarHBondContact O-N 3.18Å; Q180-V184 PolarHBondContact O-N 3.38Å; Q180-V184 VanDerWaalsContact O-N 3.11Å
181	M	95.4	Very high	95.1	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-54	-38	-177.5	-171	52.3	74.9	0	0	114	V176 T177 L183 V184 A185 C217 L220 I221 I224	V176-M181 HydrophobicContact CB-CE 4.12Å; V176-M181 HydrophobicContact CG1-CB 4.15Å; V176-M181 HydrophobicContact CG1-CE 3.67Å; V176-M181 HydrophobicContact CG1-SD 4.34Å; T177-M181 WeakPolarHBondContact O-CB 3.33Å; T177-M181 PolarHBondContact O-N 3.31Å; M181-L183 PolarHBondContact O-N 3.01Å; M181-L183 VanDerWaalsContact O-N 3.16Å; M181-V184 PolarHBondContact O-N 2.76Å; M181-V184 VanDerWaalsContact O-N 3.15Å; M181-A185 HydrophobicContact CG-CB 4.33Å; M181-A185 WeakPolarHBondContact O-CB 3.3Å; M181-A185 PolarHBondContact O-N 3.2Å; M181-A185 HydrophobicContact SD-CB 3.65Å; M181-C217 HydrophobicContact CE-CB 4.35Å; M181-C217 HydrophobicContact SD-CB 4.35Å; M181-L220 HydrophobicContact CB-CD2 4.03Å; M181-L220 HydrophobicContact CE-CB 4.11Å; M181-L220 HydrophobicContact CE-CD2 3.41Å; M181-L220 VanDerWaalsContact CE-CD2 3.41Å; M181-L220 HydrophobicContact CE-CG 4.22Å; M181-L220 HydrophobicContact CG-CD2 4.18Å; M181-I221 HydrophobicContact CG-CD1 4.49Å; M181-I221 HydrophobicContact CG-CG1 3.85Å; M181-I221 HydrophobicContact SD-CG1 4.45Å; M181-I224 HydrophobicContact CB-CD1 3.87Å; M181-I224 HydrophobicContact CG-CD1 4.06Å
182	P	94.4	Very high	95.3	Very high	64 Å²	64	43.5 Å²	43.5	42%	0.416	24%	0.238	S	C	.	.	H	α-helix	trans	-60.4	-23.6	174.7	-26.3	35.7	0	0	0	115	D178 Q180 P186 L235	D178-P182 WeakPolarHBondContact O-CD 3.44Å; Q180-P182 VanDerWaalsContact C-CD 3.42Å; Q180-P182 VanDerWaalsContact C-N 3.31Å; P182-P186 WeakPolarHBondContact O-CD 3.36Å; P182-P186 WeakPolarHBondContact O-CG 3.17Å; P182-L235 HydrophobicContact CB-CD2 4.35Å; P182-L235 HydrophobicContact CG-CD1 4.38Å
183	L	94.1	Very high	95.3	Very high	119 Å²	119	46.6 Å²	46.6	62%	0.623	25%	0.25	S	S	*	.	H	α-helix	trans	-92.5	-29.6	176.8	-59.1	175.8	0	0	0	112.1	Q180 M181	Q180-L183 WeakPolarHBondContact O-CB 3.47Å; Q180-L183 PolarHBondContact O-N 3.18Å; M181-L183 PolarHBondContact O-N 3.01Å; M181-L183 VanDerWaalsContact O-N 3.16Å
184	V	96.1	Very high	95.4	Very high	3 Å²	3	50.2 Å²	50.2	2%	0.018	27%	0.266	C	S	.	.	H	α-helix	trans	-85.2	-53.1	-175.9	173.5	0	0	0	0	111.9	F147 V176 Q180 M181 V187 I188	F147-V184 HydrophobicContact CD1-CG2 4.36Å; F147-V184 HydrophobicContact CD2-CG1 4.49Å; F147-V184 HydrophobicContact CE1-CG2 4.27Å; F147-V184 HydrophobicContact CE2-CG1 3.85Å; F147-V184 HydrophobicContact CZ-CB 4.3Å; F147-V184 HydrophobicContact CZ-CG1 3.88Å; F147-V184 HydrophobicContact CZ-CG2 4.39Å; V176-V184 HydrophobicContact CG1-CB 4.28Å; V176-V184 HydrophobicContact CG1-CG2 4.12Å; V176-V184 HydrophobicContact CG2-CG1 4.33Å; V176-V184 HydrophobicContact CG2-CG2 4.24Å; Q180-V184 PolarHBondContact O-N 3.38Å; Q180-V184 VanDerWaalsContact O-N 3.11Å; M181-V184 PolarHBondContact O-N 2.76Å; M181-V184 VanDerWaalsContact O-N 3.15Å; V184-V187 PolarHBondContact O-N 3.41Å; V184-V187 VanDerWaalsContact O-N 3.08Å; V184-I188 HydrophobicContact CG1-CB 4.45Å; V184-I188 HydrophobicContact CG1-CG2 3.99Å; V184-I188 WeakPolarHBondContact O-CG2 3.28Å; V184-I188 PolarHBondContact O-N 3.47Å
185	A	95.9	Very high	95.6	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-55.3	-47.6	-172.9	0	0	0	0	0	114.1	M181 V187 I188 L189 I221 L235	M181-A185 HydrophobicContact CG-CB 4.33Å; M181-A185 WeakPolarHBondContact O-CB 3.3Å; M181-A185 PolarHBondContact O-N 3.2Å; M181-A185 HydrophobicContact SD-CB 3.65Å; A185-V187 PolarHBondContact O-N 3.23Å; A185-V187 VanDerWaalsContact O-N 3.09Å; A185-I188 PolarHBondContact O-N 3.39Å; A185-L189 HydrophobicContact CB-CD1 4.08Å; A185-L189 HydrophobicContact CB-CG 4.49Å; A185-L189 WeakPolarHBondContact O-CB 3.28Å; A185-L189 VanDerWaalsContact O-CG 3.28Å; A185-L189 WeakPolarHBondContact O-CG 3.48Å; A185-L189 PolarHBondContact O-N 3.35Å; A185-L189 VanDerWaalsContact O-N 3.12Å; A185-I221 HydrophobicContact CB-CD1 3.92Å; A185-L235 HydrophobicContact CB-CB 4.43Å
186	P	95.1	Very high	95.8	Very high	66 Å²	66	41.4 Å²	41.4	43%	0.429	23%	0.229	S	C	.	.	H	α-helix	trans	-63.7	-19.9	-178.5	-24.1	36.3	0	0	0	114	P182 P190 L235	P182-P186 WeakPolarHBondContact O-CD 3.36Å; P182-P186 WeakPolarHBondContact O-CG 3.17Å; P186-P190 WeakPolarHBondContact O-CD 3.37Å; P186-P190 WeakPolarHBondContact O-CG 3.22Å; P186-L235 HydrophobicContact CG-CD2 3.82Å
187	V	95.8	Very high	95.8	Very high	73 Å²	73	44 Å²	44	44%	0.442	25%	0.245	S	C	.	.	H	α-helix	trans	-96.6	-44.4	-177.8	179.2	0	0	0	0	111.2	F147 M151 V184 A185	F147-V187 HydrophobicContact CE1-CB 4.15Å; F147-V187 HydrophobicContact CE1-CG1 4.13Å; F147-V187 HydrophobicContact CZ-CB 4.07Å; F147-V187 HydrophobicContact CZ-CG1 4.07Å; M151-V187 HydrophobicContact CE-CG1 4.04Å; M151-V187 HydrophobicContact CG-CG1 4.22Å; M151-V187 HydrophobicContact SD-CG1 4.48Å; V184-V187 PolarHBondContact O-N 3.41Å; V184-V187 VanDerWaalsContact O-N 3.08Å; A185-V187 PolarHBondContact O-N 3.23Å; A185-V187 VanDerWaalsContact O-N 3.09Å
188	I	96.6	Very high	95.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-77.9	-41.8	-174.4	-162.3	172.5	0	0	0	112.3	F147 M151 L169 T173 V184 A185 E191 M192 I213	F147-I188 HydrophobicContact CE2-CB 4.23Å; F147-I188 HydrophobicContact CE2-CD1 4.29Å; F147-I188 HydrophobicContact CZ-CB 4.2Å; M151-I188 HydrophobicContact SD-CB 4.41Å; M151-I188 HydrophobicContact SD-CG1 4.21Å; L169-I188 HydrophobicContact CD1-CD1 4.46Å; L169-I188 HydrophobicContact CD2-CD1 4.01Å; T173-I188 HydrophobicContact CG2-CD1 3.62Å; V184-I188 HydrophobicContact CG1-CB 4.45Å; V184-I188 HydrophobicContact CG1-CG2 3.99Å; V184-I188 WeakPolarHBondContact O-CG2 3.28Å; V184-I188 PolarHBondContact O-N 3.47Å; A185-I188 PolarHBondContact O-N 3.39Å; I188-E191 PolarHBondContact O-N 3.05Å; I188-E191 VanDerWaalsContact O-N 3.11Å; I188-M192 HydrophobicContact CG1-CE 3.91Å; I188-M192 HydrophobicContact CG1-CG 4.15Å; I188-M192 HydrophobicContact CG1-SD 4.36Å; I188-M192 WeakPolarHBondContact O-CG 2.99Å; I188-M192 PolarHBondContact O-N 3.04Å; I188-I213 HydrophobicContact CD1-CG2 3.62Å; I188-I213 HydrophobicContact CG1-CG2 4.17Å
189	L	96.9	Very high	95.8	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-60.8	-42.3	-173.8	-64.4	177	0	0	0	113.2	A185 E191 M192 Y193 F214 C217 I236 V239 F243	A185-L189 HydrophobicContact CB-CD1 4.08Å; A185-L189 HydrophobicContact CB-CG 4.49Å; A185-L189 WeakPolarHBondContact O-CB 3.28Å; A185-L189 VanDerWaalsContact O-CG 3.28Å; A185-L189 WeakPolarHBondContact O-CG 3.48Å; A185-L189 PolarHBondContact O-N 3.35Å; A185-L189 VanDerWaalsContact O-N 3.12Å; L189-E191 VanDerWaalsContact C-N 3.32Å; L189-E191 PolarHBondContact O-N 2.92Å; L189-M192 PolarHBondContact O-N 3.02Å; L189-Y193 PolarHBondContact O-N 2.82Å; L189-F214 HydrophobicContact CD2-CB 4.5Å; L189-F214 HydrophobicContact CD2-CD2 3.96Å; L189-C217 HydrophobicContact CD2-CB 3.92Å; L189-I236 HydrophobicContact CD1-CG1 4.38Å; L189-V239 HydrophobicContact CB-CG2 4.34Å; L189-V239 HydrophobicContact CD1-CG2 4.03Å; L189-F243 HydrophobicContact CB-CE2 4.47Å; L189-F243 VanDerWaalsContact O-CZ 3.27Å; L189-F243 WeakPolarHBondContact O-CZ 3.23Å
190	P	96.1	Very high	95.7	Very high	66 Å²	66	43 Å²	43	43%	0.429	23%	0.232	S	C	.	.	H	α-helix	trans	-61.3	-36.5	175	-25.5	36.3	0	0	0	113.9	P186 Y193 K194	P186-P190 WeakPolarHBondContact O-CD 3.37Å; P186-P190 WeakPolarHBondContact O-CG 3.22Å; P190-Y193 WeakPolarHBondContact O-CB 3.35Å; P190-Y193 PolarHBondContact O-N 3.49Å; P190-K194 PolarHBondContact O-N 3.15Å
191	E	96.2	Very high	95.6	Very high	23 Å²	23	43.7 Å²	43.7	11%	0.107	24%	0.24	C	C	.	.	H	α-helix	trans	-74.4	-35.1	177.3	-165.9	61.8	-150.7	0	0	111.1	M151 L154 I188 L189 Y193 K194 I195	M151-E191 HydrophobicContact CE-CB 3.87Å; M151-E191 HydrophobicContact CE-CG 4.25Å; L154-E191 HydrophobicContact CB-CG 3.91Å; L154-E191 HydrophobicContact CD1-CB 4.4Å; L154-E191 HydrophobicContact CD1-CG 3.79Å; I188-E191 PolarHBondContact O-N 3.05Å; I188-E191 VanDerWaalsContact O-N 3.11Å; L189-E191 VanDerWaalsContact C-N 3.32Å; L189-E191 PolarHBondContact O-N 2.92Å; E191-Y193 VanDerWaalsContact C-N 3.3Å; E191-Y193 PolarHBondContact O-N 3.04Å; E191-K194 PolarHBondContact O-N 3.26Å; E191-K194 IonicContact OE1-NZ 3.36Å; E191-K194 PolarHBondContact OE1-NZ 2.88Å; E191-K194 IonicContact OE2-NZ 3.05Å; E191-K194 PolarHBondContact OE2-NZ 3.13Å; E191-I195 HydrophobicContact CG-CD1 4.25Å; E191-I195 WeakPolarHBondContact O-CG1 3.41Å; E191-I195 PolarHBondContact O-N 2.74Å
192	M	97.6	Very high	95.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.9	-42.2	172.1	-64.7	-50	92.6	0	0	111.2	L154 M166 I188 L189 K194 I195 F196 A210 I213 F243	L154-M192 HydrophobicContact CD1-CE 3.6Å; M166-M192 HydrophobicContact CE-CE 4.22Å; M166-M192 HydrophobicContact CE-SD 3.63Å; M166-M192 HydrophobicContact SD-CE 3.6Å; M166-M192 VanDerWaalsContact SD-CE 3.6Å; M166-M192 HydrophobicContact SD-SD 3.83Å; I188-M192 HydrophobicContact CG1-CE 3.91Å; I188-M192 HydrophobicContact CG1-CG 4.15Å; I188-M192 HydrophobicContact CG1-SD 4.36Å; I188-M192 WeakPolarHBondContact O-CG 2.99Å; I188-M192 PolarHBondContact O-N 3.04Å; L189-M192 PolarHBondContact O-N 3.02Å; M192-K194 PolarHBondContact O-N 2.75Å; M192-I195 HydrophobicContact CE-CD1 4.08Å; M192-I195 PolarHBondContact O-N 3.05Å; M192-F196 VanDerWaalsContact O-CB 3.23Å; M192-F196 WeakPolarHBondContact O-CB 3.44Å; M192-F196 PolarHBondContact O-N 2.76Å; M192-A210 HydrophobicContact CB-CB 4.15Å; M192-A210 HydrophobicContact SD-CB 3.96Å; M192-I213 HydrophobicContact CG-CB 4.25Å; M192-I213 HydrophobicContact CG-CG2 3.76Å; M192-I213 HydrophobicContact SD-CB 3.95Å; M192-I213 HydrophobicContact SD-CD1 3.62Å; M192-I213 HydrophobicContact SD-CG1 4.39Å; M192-I213 HydrophobicContact SD-CG2 3.8Å; M192-F243 HydrophobicContact CB-CZ 4.13Å
193	Y	97.5	Very high	95.4	Very high	65 Å²	65	44.3 Å²	44.3	26%	0.255	24%	0.243	S	C	.	.	H	α-helix	trans	-59.3	-46.4	176.5	-176.9	-100.4	0	0	0	111.9	L189 P190 E191 F196 T197 Q242 F243 A246	L189-Y193 PolarHBondContact O-N 2.82Å; P190-Y193 WeakPolarHBondContact O-CB 3.35Å; P190-Y193 PolarHBondContact O-N 3.49Å; E191-Y193 VanDerWaalsContact C-N 3.3Å; E191-Y193 PolarHBondContact O-N 3.04Å; Y193-F196 PolarHBondContact O-N 2.73Å; Y193-T197 HydrophobicContact CD1-CG2 4.43Å; Y193-T197 HydrophobicContact CD2-CG2 4.4Å; Y193-T197 HydrophobicContact CE1-CG2 4.03Å; Y193-T197 HydrophobicContact CE2-CG2 3.98Å; Y193-T197 WeakPolarHBondContact O-CB 3.38Å; Y193-T197 WeakPolarHBondContact O-CG2 3.42Å; Y193-T197 PolarHBondContact O-N 3.1Å; Y193-T197 PolarHBondContact O-OG1 3.29Å; Y193-Q242 HydrophobicContact CD2-CB 4.37Å; Y193-Q242 HydrophobicContact CE2-CB 3.8Å; Y193-Q242 WeakPolarHBondContact CE2-O 3.33Å; Y193-F243 VanDerWaalsContact CB-CZ 3.49Å; Y193-F243 HydrophobicContact CD2-CD1 4.08Å; Y193-F243 HydrophobicContact CD2-CD2 4.01Å; Y193-F243 HydrophobicContact CD2-CE1 4.15Å; Y193-F243 HydrophobicContact CD2-CE2 4.08Å; Y193-F243 HydrophobicContact CD2-CG 4.04Å; Y193-F243 HydrophobicContact CD2-CZ 4.16Å; Y193-F243 HydrophobicContact CG-CE2 4.35Å; Y193-F243 HydrophobicContact CG-CZ 4.35Å; Y193-A246 HydrophobicContact CE2-CB 3.85Å
194	K	96.4	Very high	95.3	Very high	78 Å²	78	39.8 Å²	39.8	34%	0.339	22%	0.219	S	C	.	.	H	α-helix	trans	-63.3	-45.4	178.4	178.8	-178.8	156.1	-139.5	0	111.7	P190 E191 M192 F196 T197 M198	P190-K194 PolarHBondContact O-N 3.15Å; E191-K194 PolarHBondContact O-N 3.26Å; E191-K194 IonicContact OE1-NZ 3.36Å; E191-K194 PolarHBondContact OE1-NZ 2.88Å; E191-K194 IonicContact OE2-NZ 3.05Å; E191-K194 PolarHBondContact OE2-NZ 3.13Å; M192-K194 PolarHBondContact O-N 2.75Å; K194-F196 VanDerWaalsContact C-N 3.35Å; K194-T197 PolarHBondContact O-N 3.01Å; K194-T197 PolarHBondContact O-OG1 3.05Å; K194-M198 HydrophobicContact CD-SD 4.48Å; K194-M198 HydrophobicContact CG-SD 3.64Å; K194-M198 WeakPolarHBondContact O-CB 3.39Å; K194-M198 VanDerWaalsContact O-CG 3.23Å; K194-M198 WeakPolarHBondContact O-CG 3.37Å; K194-M198 PolarHBondContact O-N 2.92Å
195	I	96.6	Very high	95	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61.9	-46	176.7	-69.6	171.7	0	0	0	110.3	L154 V162 M166 E191 M192 T197 Y202 T206 R207 A210	L154-I195 HydrophobicContact CD1-CD1 4.33Å; L154-I195 HydrophobicContact CD2-CD1 4.03Å; V162-I195 HydrophobicContact CG1-CD1 4.04Å; M166-I195 HydrophobicContact CG-CD1 4.23Å; M166-I195 HydrophobicContact SD-CD1 3.64Å; E191-I195 HydrophobicContact CG-CD1 4.25Å; E191-I195 WeakPolarHBondContact O-CG1 3.41Å; E191-I195 PolarHBondContact O-N 2.74Å; M192-I195 HydrophobicContact CE-CD1 4.08Å; M192-I195 PolarHBondContact O-N 3.05Å; I195-T197 VanDerWaalsContact C-N 3.35Å; I195-T197 PolarHBondContact O-N 2.92Å; I195-Y202 HydrophobicContact CB-CD2 4.22Å; I195-Y202 HydrophobicContact CB-CE2 4.28Å; I195-Y202 HydrophobicContact CG1-CD2 4.35Å; I195-Y202 HydrophobicContact CG1-CE2 3.97Å; I195-Y202 HydrophobicContact CG2-CD2 3.99Å; I195-Y202 HydrophobicContact CG2-CE2 4.46Å; I195-Y202 HydrophobicContact CG2-CG 4.12Å; I195-Y202 WeakPolarHBondContact O-CD2 3.5Å; I195-T206 HydrophobicContact CG2-CG2 3.99Å; I195-R207 WeakPolarHBondContact O-CG 3.23Å; I195-A210 HydrophobicContact CB-CB 4.42Å; I195-A210 HydrophobicContact CG2-CB 4.15Å
196	F	97.8	Very high	94.9	Very high	3 Å²	3	41.8 Å²	41.8	1%	0.013	23%	0.227	C	C	.	.	H	α-helix	trans	-62	-38.5	-178.4	177.5	-110.2	0	0	0	113.5	M192 Y193 K194 R207 A210 V211 A246 F247 A250 L263 V267	M192-F196 VanDerWaalsContact O-CB 3.23Å; M192-F196 WeakPolarHBondContact O-CB 3.44Å; M192-F196 PolarHBondContact O-N 2.76Å; Y193-F196 PolarHBondContact O-N 2.73Å; K194-F196 VanDerWaalsContact C-N 3.35Å; F196-R207 HydrophobicContact CD2-CB 4.39Å; F196-R207 PolarHBondContact O-NE 3.01Å; F196-R207 PolarHBondContact O-NH2 3.32Å; F196-A210 HydrophobicContact CB-CB 4.38Å; F196-V211 HydrophobicContact CD2-CG2 3.49Å; F196-V211 VanDerWaalsContact CD2-CG2 3.49Å; F196-V211 HydrophobicContact CE2-CG2 3.47Å; F196-V211 VanDerWaalsContact CE2-CG2 3.47Å; F196-V211 HydrophobicContact CG-CG2 4.4Å; F196-V211 HydrophobicContact CZ-CG2 4.38Å; F196-A246 HydrophobicContact CD1-CB 3.97Å; F196-A246 HydrophobicContact CE1-CB 3.67Å; F196-F247 HydrophobicContact CD1-CD1 4.45Å; F196-F247 HydrophobicContact CD1-CE1 4.44Å; F196-F247 AromaticContact CE1-CD1 3.66Å; F196-F247 HydrophobicContact CE1-CD1 3.66Å; F196-F247 HydrophobicContact CE1-CE1 4.07Å; F196-F247 HydrophobicContact CE2-CD1 4.36Å; F196-F247 AromaticContact CZ-CD1 3.62Å; F196-F247 HydrophobicContact CZ-CD1 3.62Å; F196-F247 HydrophobicContact CZ-CE1 4.11Å; F196-A250 HydrophobicContact CE1-CB 4.38Å; F196-A250 HydrophobicContact CE2-CB 4.33Å; F196-A250 HydrophobicContact CZ-CB 3.57Å; F196-L263 HydrophobicContact CE2-CD1 4.29Å; F196-V267 HydrophobicContact CE2-CG2 3.73Å; F196-V267 HydrophobicContact CZ-CG2 3.81Å
197	T	96.6	Very high	94.9	Very high	60 Å²	60	39.3 Å²	39.3	37%	0.368	21%	0.209	S	C	.	.	H	α-helix	trans	-83.5	-22.2	-176.1	51.6	0	0	0	0	114.3	Y193 K194 I195 A199 A246	Y193-T197 HydrophobicContact CD1-CG2 4.43Å; Y193-T197 HydrophobicContact CD2-CG2 4.4Å; Y193-T197 HydrophobicContact CE1-CG2 4.03Å; Y193-T197 HydrophobicContact CE2-CG2 3.98Å; Y193-T197 WeakPolarHBondContact O-CB 3.38Å; Y193-T197 WeakPolarHBondContact O-CG2 3.42Å; Y193-T197 PolarHBondContact O-N 3.1Å; Y193-T197 PolarHBondContact O-OG1 3.29Å; K194-T197 PolarHBondContact O-N 3.01Å; K194-T197 PolarHBondContact O-OG1 3.05Å; I195-T197 VanDerWaalsContact C-N 3.35Å; I195-T197 PolarHBondContact O-N 2.92Å; T197-A199 PolarHBondContact O-N 3.22Å; T197-A199 VanDerWaalsContact O-N 3.1Å; T197-A246 HydrophobicContact CG2-CB 4Å
198	M	95	Very high	94.9	Very high	53 Å²	53	36.6 Å²	36.6	26%	0.261	19%	0.193	S	C	.	.			trans	-87	66	-179.7	-66.2	176.1	72.5	0	0	112.6	K194 E200 V201 Y202	K194-M198 HydrophobicContact CD-SD 4.48Å; K194-M198 HydrophobicContact CG-SD 3.64Å; K194-M198 WeakPolarHBondContact O-CB 3.39Å; K194-M198 VanDerWaalsContact O-CG 3.23Å; K194-M198 WeakPolarHBondContact O-CG 3.37Å; K194-M198 PolarHBondContact O-N 2.92Å; M198-E200 PolarHBondContact O-N 3.37Å; M198-V201 HydrophobicContact CB-CB 4.33Å; M198-V201 HydrophobicContact CB-CG2 4.49Å; M198-V201 HydrophobicContact CE-CB 4.26Å; M198-V201 HydrophobicContact CE-CG2 3.7Å; M198-V201 PolarHBondContact O-N 3.24Å; M198-V201 VanDerWaalsContact O-N 3.11Å; M198-Y202 HydrophobicContact CB-CD2 3.84Å; M198-Y202 HydrophobicContact CB-CE2 3.96Å; M198-Y202 PolarHBondContact O-N 2.79Å; M198-Y202 VanDerWaalsContact O-N 3.08Å; M198-Y202 HydrophobicContact SD-CE2 4.08Å
199	A	92.9	Very high	94.8	Very high	29 Å²	29	37.7 Å²	37.7	24%	0.24	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-22.1	-177.3	0	0	0	0	0	114.5	T197 T258	T197-A199 PolarHBondContact O-N 3.22Å; T197-A199 VanDerWaalsContact O-N 3.1Å; A199-T258 HydrophobicContact CB-CG2 4.13Å
200	E	91.9	Very high	94.8	Very high	150 Å²	150	37.6 Å²	37.6	70%	0.701	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-16.1	177.2	72.6	-69	167.1	0	0	113.7	M198	M198-E200 PolarHBondContact O-N 3.37Å
201	V	92.4	Very high	94.9	Very high	63 Å²	63	34.4 Å²	34.4	38%	0.382	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-44.6	-178.1	-178.4	0	0	0	0	111.5	M198	M198-V201 HydrophobicContact CB-CB 4.33Å; M198-V201 HydrophobicContact CB-CG2 4.49Å; M198-V201 HydrophobicContact CE-CB 4.26Å; M198-V201 HydrophobicContact CE-CG2 3.7Å; M198-V201 PolarHBondContact O-N 3.24Å; M198-V201 VanDerWaalsContact O-N 3.11Å
202	Y	93.7	Very high	94.9	Very high	20 Å²	20	35.2 Å²	35.2	8%	0.078	18%	0.18	C	C	.	.	S	Bend	trans	-106	142.5	-172.7	-56.7	-64.4	0	0	0	112.5	V162 I195 M198 R207	V162-Y202 HydrophobicContact CB-CE1 4.18Å; V162-Y202 HydrophobicContact CG1-CD1 4.06Å; V162-Y202 HydrophobicContact CG1-CE1 3.75Å; V162-Y202 HydrophobicContact CG2-CE1 4.04Å; I195-Y202 HydrophobicContact CB-CD2 4.22Å; I195-Y202 HydrophobicContact CB-CE2 4.28Å; I195-Y202 HydrophobicContact CG1-CD2 4.35Å; I195-Y202 HydrophobicContact CG1-CE2 3.97Å; I195-Y202 HydrophobicContact CG2-CD2 3.99Å; I195-Y202 HydrophobicContact CG2-CE2 4.46Å; I195-Y202 HydrophobicContact CG2-CG 4.12Å; I195-Y202 WeakPolarHBondContact O-CD2 3.5Å; M198-Y202 HydrophobicContact CB-CD2 3.84Å; M198-Y202 HydrophobicContact CB-CE2 3.96Å; M198-Y202 PolarHBondContact O-N 2.79Å; M198-Y202 VanDerWaalsContact O-N 3.08Å; M198-Y202 HydrophobicContact SD-CE2 4.08Å; Y202-R207 WeakPolarHBondContact O-CD 3.41Å
203	S	91.9	Very high	94.9	Very high	58 Å²	58	35.2 Å²	35.2	41%	0.406	18%	0.18	S	C	.	.			trans	-66	158.1	178.6	68.3	0	0	0	0	112.4	R205 T206 R207	S203-R205 VanDerWaalsContact C-N 3.3Å; S203-R205 PolarHBondContact O-N 3.46Å; S203-T206 PolarHBondContact O-N 3.3Å; S203-T206 PolarHBondContact OG-N 3.21Å; S203-T206 PolarHBondContact OG-OG1 2.89Å; S203-R207 WeakPolarHBondContact O-CG 3.3Å; S203-R207 PolarHBondContact O-N 2.81Å
204	I	92.1	Very high	95	Very high	24 Å²	24	32.1 Å²	32.1	12%	0.123	17%	0.168	C	C	.	.	H	α-helix	trans	-50.7	-49	176	-56	178.3	0	0	0	111.2	T206 R207 S208 D260 L263	I204-T206 VanDerWaalsContact C-N 3.34Å; I204-T206 PolarHBondContact O-N 2.53Å; I204-R207 PolarHBondContact O-N 3.07Å; I204-S208 WeakPolarHBondContact O-CB 3.27Å; I204-S208 PolarHBondContact O-N 2.88Å; I204-D260 HydrophobicContact CD1-CB 4.46Å; I204-D260 WeakPolarHBondContact CG2-OD1 3.39Å; I204-L263 HydrophobicContact CG2-CB 3.61Å; I204-L263 HydrophobicContact CG2-CD2 4.01Å; I204-L263 HydrophobicContact CG2-CG 4.34Å
205	R	89.9	Confident	95	Very high	41 Å²	41	29.4 Å²	29.4	16%	0.155	16%	0.157	C	C	.	.	H	α-helix	trans	-61.3	-38	178.8	-56.6	-70.5	80.6	87.1	1.3	113	S203 R209 D260 L326	S203-R205 VanDerWaalsContact C-N 3.3Å; S203-R205 PolarHBondContact O-N 3.46Å; R205-R209 PolarHBondContact O-N 2.91Å; R205-R209 VanDerWaalsContact O-N 3.11Å; R205-D260 IonicContact CZ-OD1 3.19Å; R205-D260 IonicContact CZ-OD2 3.59Å; R205-D260 IonicContact NH1-OD2 4Å; R205-D260 PolarHBondContact NH1-OD2 2.84Å; R205-D260 IonicContact NH2-OD1 3.7Å; R205-D260 PolarHBondContact NH2-OD1 3.38Å; R205-D260 IonicContact NH2-OD2 2.65Å; R205-D260 PolarHBondContact NH2-OD2 3.46Å; R205-L326 VanDerWaalsContact CZ-CD1 3.41Å
206	T	93	Very high	95.1	Very high	3 Å²	3	30.7 Å²	30.7	2%	0.018	17%	0.165	C	C	.	.	H	α-helix	trans	-68.4	-40.6	178.3	-52.7	0	0	0	0	110.9	V162 M166 I195 S203 I204 R209 A210	V162-T206 HydrophobicContact CG1-CG2 4.1Å; M166-T206 HydrophobicContact CB-CG2 4.41Å; M166-T206 HydrophobicContact CG-CG2 3.95Å; I195-T206 HydrophobicContact CG2-CG2 3.99Å; S203-T206 PolarHBondContact O-N 3.3Å; S203-T206 PolarHBondContact OG-N 3.21Å; S203-T206 PolarHBondContact OG-OG1 2.89Å; I204-T206 VanDerWaalsContact C-N 3.34Å; I204-T206 PolarHBondContact O-N 2.53Å; T206-R209 PolarHBondContact O-N 3.36Å; T206-A210 PolarHBondContact O-N 2.69Å
207	R	95.9	Very high	95	Very high	15 Å²	15	30.5 Å²	30.5	6%	0.057	17%	0.165	C	C	.	.	H	α-helix	trans	-68.1	-39.4	176.7	-67.1	171.6	58.5	-133.4	-7.6	111.9	I195 F196 Y202 S203 I204 A210 V211 T258 L263	I195-R207 WeakPolarHBondContact O-CG 3.23Å; F196-R207 HydrophobicContact CD2-CB 4.39Å; F196-R207 PolarHBondContact O-NE 3.01Å; F196-R207 PolarHBondContact O-NH2 3.32Å; Y202-R207 WeakPolarHBondContact O-CD 3.41Å; S203-R207 WeakPolarHBondContact O-CG 3.3Å; S203-R207 PolarHBondContact O-N 2.81Å; I204-R207 PolarHBondContact O-N 3.07Å; R207-A210 VanDerWaalsContact O-CB 3.31Å; R207-A210 WeakPolarHBondContact O-CB 3.33Å; R207-A210 PolarHBondContact O-N 3.31Å; R207-A210 VanDerWaalsContact O-N 3.12Å; R207-V211 WeakPolarHBondContact O-CG2 3.28Å; R207-V211 PolarHBondContact O-N 3.21Å; R207-T258 PolarHBondContact NH1-O 3.17Å; R207-L263 HydrophobicContact CB-CD1 4.35Å
208	S	95	Very high	95	Very high	16 Å²	16	27.7 Å²	27.7	11%	0.112	15%	0.147	C	C	.	.	H	α-helix	trans	-60.4	-44.6	174.4	162.6	0	0	0	0	111.8	I204 A210 V211 E212	I204-S208 WeakPolarHBondContact O-CB 3.27Å; I204-S208 PolarHBondContact O-N 2.88Å; S208-A210 VanDerWaalsContact C-N 3.26Å; S208-A210 PolarHBondContact O-N 3.11Å; S208-V211 WeakPolarHBondContact O-CA 3.28Å; S208-V211 WeakPolarHBondContact O-CB 3.35Å; S208-V211 PolarHBondContact O-N 2.83Å; S208-E212 PolarHBondContact O-N 3.37Å
209	R	95.4	Very high	95.1	Very high	22 Å²	22	28.6 Å²	28.6	8%	0.083	15%	0.153	C	C	.	.	H	α-helix	trans	-61	-31.7	172.6	-70.9	-177.5	-175.9	110.7	2.1	113.5	M166 R205 T206 V211 E212 I213 S321 D322	M166-R209 HydrophobicContact CE-CB 3.94Å; R205-R209 PolarHBondContact O-N 2.91Å; R205-R209 VanDerWaalsContact O-N 3.11Å; T206-R209 PolarHBondContact O-N 3.36Å; R209-V211 VanDerWaalsContact C-N 3.26Å; R209-V211 PolarHBondContact O-N 3.43Å; R209-E212 PolarHBondContact O-N 3.15Å; R209-I213 WeakPolarHBondContact O-CB 3.37Å; R209-I213 VanDerWaalsContact O-CG1 3.29Å; R209-I213 WeakPolarHBondContact O-CG1 3.34Å; R209-I213 PolarHBondContact O-N 3.12Å; R209-S321 PolarHBondContact NH2-OG 2.96Å; R209-D322 IonicContact NH2-OD2 2.86Å
210	A	97.8	Very high	95.3	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-65.3	-33.9	174.5	0	0	0	0	0	112.1	M166 M192 I195 F196 T206 R207 S208 F214	M166-A210 HydrophobicContact CE-CB 3.71Å; M166-A210 VanDerWaalsContact CE-N 3.33Å; M192-A210 HydrophobicContact CB-CB 4.15Å; M192-A210 HydrophobicContact SD-CB 3.96Å; I195-A210 HydrophobicContact CB-CB 4.42Å; I195-A210 HydrophobicContact CG2-CB 4.15Å; F196-A210 HydrophobicContact CB-CB 4.38Å; T206-A210 PolarHBondContact O-N 2.69Å; R207-A210 VanDerWaalsContact O-CB 3.31Å; R207-A210 WeakPolarHBondContact O-CB 3.33Å; R207-A210 PolarHBondContact O-N 3.31Å; R207-A210 VanDerWaalsContact O-N 3.12Å; S208-A210 VanDerWaalsContact C-N 3.26Å; S208-A210 PolarHBondContact O-N 3.11Å; A210-F214 WeakPolarHBondContact O-CB 3.41Å; A210-F214 PolarHBondContact O-N 3.22Å; A210-F214 VanDerWaalsContact O-N 3.1Å
211	V	97.9	Very high	95.5	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-70.6	-43.7	173.1	-174.3	0	0	0	0	111.1	F196 R207 S208 R209 I213 F214 T215 F247 E266 V267 A270	F196-V211 HydrophobicContact CD2-CG2 3.49Å; F196-V211 VanDerWaalsContact CD2-CG2 3.49Å; F196-V211 HydrophobicContact CE2-CG2 3.47Å; F196-V211 VanDerWaalsContact CE2-CG2 3.47Å; F196-V211 HydrophobicContact CG-CG2 4.4Å; F196-V211 HydrophobicContact CZ-CG2 4.38Å; R207-V211 WeakPolarHBondContact O-CG2 3.28Å; R207-V211 PolarHBondContact O-N 3.21Å; S208-V211 WeakPolarHBondContact O-CA 3.28Å; S208-V211 WeakPolarHBondContact O-CB 3.35Å; S208-V211 PolarHBondContact O-N 2.83Å; R209-V211 VanDerWaalsContact C-N 3.26Å; R209-V211 PolarHBondContact O-N 3.43Å; V211-I213 VanDerWaalsContact C-N 3.35Å; V211-I213 PolarHBondContact O-N 2.94Å; V211-F214 WeakPolarHBondContact O-CB 3.49Å; V211-F214 PolarHBondContact O-N 3.06Å; V211-F214 VanDerWaalsContact O-N 3.15Å; V211-T215 PolarHBondContact O-N 3.46Å; V211-T215 PolarHBondContact O-OG1 3.1Å; V211-T215 VanDerWaalsContact O-OG1 3.09Å; V211-F247 HydrophobicContact CG1-CE1 3.98Å; V211-F247 HydrophobicContact CG1-CZ 4.23Å; V211-F247 HydrophobicContact CG2-CE1 3.99Å; V211-E266 HydrophobicContact CB-CB 4.39Å; V211-E266 HydrophobicContact CG1-CB 4.31Å; V211-E266 VanDerWaalsContact CG1-O 3.22Å; V211-E266 WeakPolarHBondContact CG1-O 3.49Å; V211-V267 HydrophobicContact CG2-CG2 4.02Å; V211-A270 HydrophobicContact CG1-CB 3.48Å; V211-A270 VanDerWaalsContact CG1-CB 3.48Å
212	E	96.4	Very high	95.6	Very high	40 Å²	40	19.8 Å²	19.8	19%	0.187	11%	0.105	C	C	.	.	H	α-helix	trans	-58.1	-45.3	176.2	-177	-176	-167.1	0	0	112.2	T170 R174 S208 R209 T215 T216	T170-E212 HydrophobicContact CG2-CG 4.3Å; T170-E212 WeakPolarHBondContact CG2-OE1 3.17Å; T170-E212 WeakPolarHBondContact CG2-OE2 3.29Å; T170-E212 PolarHBondContact OG1-OE2 3.27Å; R174-E212 IonicContact CZ-OE1 3.33Å; R174-E212 IonicContact NH1-OE1 2.76Å; R174-E212 PolarHBondContact NH1-OE1 2.78Å; R174-E212 IonicContact NH2-OE1 2.83Å; R174-E212 PolarHBondContact NH2-OE1 3.24Å; S208-E212 PolarHBondContact O-N 3.37Å; R209-E212 PolarHBondContact O-N 3.15Å; E212-T215 PolarHBondContact O-N 2.91Å; E212-T216 WeakPolarHBondContact O-CB 3.46Å; E212-T216 PolarHBondContact O-N 3.24Å; E212-T216 PolarHBondContact O-OG1 3.02Å
213	I	97.8	Very high	95.7	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.4	-43.8	175.4	-71	164.1	0	0	0	110.5	M166 L169 T173 I188 M192 R209 V211 T215 T216 C217	M166-I213 HydrophobicContact CE-CD1 3.69Å; M166-I213 HydrophobicContact SD-CD1 4.2Å; L169-I213 HydrophobicContact CB-CD1 3.66Å; T173-I213 HydrophobicContact CG2-CG2 3.84Å; I188-I213 HydrophobicContact CD1-CG2 3.62Å; I188-I213 HydrophobicContact CG1-CG2 4.17Å; M192-I213 HydrophobicContact CG-CB 4.25Å; M192-I213 HydrophobicContact CG-CG2 3.76Å; M192-I213 HydrophobicContact SD-CB 3.95Å; M192-I213 HydrophobicContact SD-CD1 3.62Å; M192-I213 HydrophobicContact SD-CG1 4.39Å; M192-I213 HydrophobicContact SD-CG2 3.8Å; R209-I213 WeakPolarHBondContact O-CB 3.37Å; R209-I213 VanDerWaalsContact O-CG1 3.29Å; R209-I213 WeakPolarHBondContact O-CG1 3.34Å; R209-I213 PolarHBondContact O-N 3.12Å; V211-I213 VanDerWaalsContact C-N 3.35Å; V211-I213 PolarHBondContact O-N 2.94Å; I213-T215 VanDerWaalsContact C-N 3.35Å; I213-T215 PolarHBondContact O-N 3.42Å; I213-T216 PolarHBondContact O-N 3.46Å; I213-C217 PolarHBondContact O-N 3.29Å; I213-C217 PolarHBondContact O-SG 3.18Å
214	F	98	Very high	95.8	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-56.7	-48.7	174.9	171.7	-86.4	0	0	0	111.4	L189 A210 V211 T216 C217 A218 I236 F243 F247 A270 L274	L189-F214 HydrophobicContact CD2-CB 4.5Å; L189-F214 HydrophobicContact CD2-CD2 3.96Å; A210-F214 WeakPolarHBondContact O-CB 3.41Å; A210-F214 PolarHBondContact O-N 3.22Å; A210-F214 VanDerWaalsContact O-N 3.1Å; V211-F214 WeakPolarHBondContact O-CB 3.49Å; V211-F214 PolarHBondContact O-N 3.06Å; V211-F214 VanDerWaalsContact O-N 3.15Å; F214-T216 PolarHBondContact O-N 2.85Å; F214-C217 PolarHBondContact O-N 3.13Å; F214-A218 HydrophobicContact CE1-CB 4.45Å; F214-A218 WeakPolarHBondContact O-CB 3.28Å; F214-A218 PolarHBondContact O-N 3.37Å; F214-I236 HydrophobicContact CE2-CD1 4.32Å; F214-I236 HydrophobicContact CE2-CG1 4.5Å; F214-I236 HydrophobicContact CZ-CD1 4.21Å; F214-F243 HydrophobicContact CB-CE1 4.34Å; F214-F243 HydrophobicContact CD2-CB 4.44Å; F214-F243 AromaticContact CD2-CD1 3.69Å; F214-F243 HydrophobicContact CD2-CD1 3.69Å; F214-F243 AromaticContact CD2-CD2 3.78Å; F214-F243 HydrophobicContact CD2-CD2 3.78Å; F214-F243 AromaticContact CD2-CE1 3.69Å; F214-F243 HydrophobicContact CD2-CE1 3.69Å; F214-F243 AromaticContact CD2-CE2 3.78Å; F214-F243 HydrophobicContact CD2-CE2 3.78Å; F214-F243 AromaticContact CD2-CG 3.71Å; F214-F243 HydrophobicContact CD2-CG 3.71Å; F214-F243 AromaticContact CD2-CZ 3.71Å; F214-F243 HydrophobicContact CD2-CZ 3.71Å; F214-F243 HydrophobicContact CE2-CB 3.83Å; F214-F243 AromaticContact CE2-CD1 3.95Å; F214-F243 HydrophobicContact CE2-CD1 3.95Å; F214-F243 AromaticContact CE2-CD2 3.53Å; F214-F243 HydrophobicContact CE2-CD2 3.53Å; F214-F243 HydrophobicContact CE2-CE1 4.35Å; F214-F243 AromaticContact CE2-CE2 3.97Å; F214-F243 HydrophobicContact CE2-CE2 3.97Å; F214-F243 AromaticContact CE2-CG 3.5Å; F214-F243 HydrophobicContact CE2-CG 3.5Å; F214-F243 VanDerWaalsContact CE2-CG 3.5Å; F214-F243 HydrophobicContact CE2-CZ 4.33Å; F214-F243 HydrophobicContact CG-CD1 4.2Å; F214-F243 HydrophobicContact CG-CE1 4.2Å; F214-F243 HydrophobicContact CZ-CB 4.05Å; F214-F243 HydrophobicContact CZ-CG 4.19Å; F214-F247 AromaticContact CD1-CE2 3.94Å; F214-F247 HydrophobicContact CD1-CE2 3.94Å; F214-F247 AromaticContact CD1-CZ 3.68Å; F214-F247 HydrophobicContact CD1-CZ 3.68Å; F214-F247 AromaticContact CE1-CE2 3.65Å; F214-F247 HydrophobicContact CE1-CE2 3.65Å; F214-F247 AromaticContact CE1-CZ 3.89Å; F214-F247 HydrophobicContact CE1-CZ 3.89Å; F214-F247 HydrophobicContact CG-CZ 4.07Å; F214-F247 HydrophobicContact CZ-CE2 4.12Å; F214-F247 HydrophobicContact CZ-CZ 4.43Å; F214-A270 HydrophobicContact CD1-CB 4.25Å; F214-L274 HydrophobicContact CE1-CD1 3.86Å; F214-L274 HydrophobicContact CE1-CD2 3.95Å; F214-L274 HydrophobicContact CE1-CG 3.97Å; F214-L274 HydrophobicContact CZ-CD1 3.89Å; F214-L274 HydrophobicContact CZ-CD2 3.87Å; F214-L274 HydrophobicContact CZ-CG 4.23Å
215	T	97.6	Very high	95.8	Very high	20 Å²	20	20 Å²	20	12%	0.123	11%	0.108	C	C	.	.	H	α-helix	trans	-62.8	-41.9	-180	-57.9	0	0	0	0	111.7	V211 E212 I213 A218 N219 A270 A273	V211-T215 PolarHBondContact O-N 3.46Å; V211-T215 PolarHBondContact O-OG1 3.1Å; V211-T215 VanDerWaalsContact O-OG1 3.09Å; E212-T215 PolarHBondContact O-N 2.91Å; I213-T215 VanDerWaalsContact C-N 3.35Å; I213-T215 PolarHBondContact O-N 3.42Å; T215-A218 PolarHBondContact O-N 3.34Å; T215-N219 PolarHBondContact O-N 2.77Å; T215-N219 PolarHBondContact O-ND2 2.85Å; T215-A270 WeakPolarHBondContact OG1-CA 3.28Å; T215-A270 VanDerWaalsContact OG1-CB 3.24Å; T215-A270 WeakPolarHBondContact OG1-CB 3.46Å; T215-A273 HydrophobicContact CG2-CB 3.94Å
216	T	97.5	Very high	95.8	Very high	27 Å²	27	25.8 Å²	25.8	17%	0.166	14%	0.137	C	C	.	.	H	α-helix	trans	-60.2	-48	176.6	-57.7	0	0	0	0	111.1	R174 E212 I213 F214 A218 N219 L220	R174-T216 HydrophobicContact CG-CG2 4.04Å; E212-T216 WeakPolarHBondContact O-CB 3.46Å; E212-T216 PolarHBondContact O-N 3.24Å; E212-T216 PolarHBondContact O-OG1 3.02Å; I213-T216 PolarHBondContact O-N 3.46Å; F214-T216 PolarHBondContact O-N 2.85Å; T216-A218 PolarHBondContact O-N 3.26Å; T216-N219 PolarHBondContact O-N 2.93Å; T216-L220 PolarHBondContact O-N 2.99Å
217	C	97.3	Very high	95.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.4	-42.9	174.2	-70.3	0	0	0	0	112.1	M181 L189 I213 F214 N219 L220 I221	M181-C217 HydrophobicContact CE-CB 4.35Å; M181-C217 HydrophobicContact SD-CB 4.35Å; L189-C217 HydrophobicContact CD2-CB 3.92Å; I213-C217 PolarHBondContact O-N 3.29Å; I213-C217 PolarHBondContact O-SG 3.18Å; F214-C217 PolarHBondContact O-N 3.13Å; C217-N219 PolarHBondContact O-N 2.97Å; C217-L220 PolarHBondContact O-N 3.49Å; C217-I221 HydrophobicContact CB-CD1 4.48Å; C217-I221 WeakPolarHBondContact O-CB 3.45Å; C217-I221 WeakPolarHBondContact O-CD1 3.42Å; C217-I221 WeakPolarHBondContact O-CG1 3.45Å; C217-I221 PolarHBondContact O-N 3.06Å
218	A	96.3	Very high	95.1	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.8	-43.7	-179.5	0	0	0	0	0	112.6	F214 T215 T216 I221 C222 I236 L274 F278	F214-A218 HydrophobicContact CE1-CB 4.45Å; F214-A218 WeakPolarHBondContact O-CB 3.28Å; F214-A218 PolarHBondContact O-N 3.37Å; T215-A218 PolarHBondContact O-N 3.34Å; T216-A218 PolarHBondContact O-N 3.26Å; A218-I221 PolarHBondContact O-N 3.13Å; A218-C222 PolarHBondContact O-N 3Å; A218-I236 HydrophobicContact CB-CD1 3.45Å; A218-I236 VanDerWaalsContact CB-CD1 3.45Å; A218-L274 HydrophobicContact CB-CD2 4.46Å; A218-F278 HydrophobicContact CB-CE2 4.24Å; A218-F278 WeakPolarHBondContact O-CZ 3.26Å
219	N	96.7	Very high	94.8	Very high	73 Å²	73	47.8 Å²	47.8	39%	0.39	24%	0.24	S	C	.	.	H	α-helix	trans	-63.5	-46.7	177.4	-71.2	-18.7	0	0	0	111.5	T215 T216 C217 C222 A223 N277	T215-N219 PolarHBondContact O-N 2.77Å; T215-N219 PolarHBondContact O-ND2 2.85Å; T216-N219 PolarHBondContact O-N 2.93Å; C217-N219 PolarHBondContact O-N 2.97Å; N219-C222 WeakPolarHBondContact O-CB 3.42Å; N219-C222 PolarHBondContact O-N 3.32Å; N219-A223 PolarHBondContact O-N 3Å; N219-A223 VanDerWaalsContact O-N 3.11Å; N219-N277 PolarHBondContact OD1-ND2 3.22Å
220	L	95.9	Very high	94.6	Very high	42 Å²	42	48.2 Å²	48.2	22%	0.22	25%	0.251	C	S	.	.	H	α-helix	trans	-66.7	-39.9	178.4	-175.4	60.4	0	0	0	112.1	V176 M181 T216 C217 C222 A223 I224	V176-L220 WeakPolarHBondContact O-CD2 3.48Å; M181-L220 HydrophobicContact CB-CD2 4.03Å; M181-L220 HydrophobicContact CE-CB 4.11Å; M181-L220 HydrophobicContact CE-CD2 3.41Å; M181-L220 VanDerWaalsContact CE-CD2 3.41Å; M181-L220 HydrophobicContact CE-CG 4.22Å; M181-L220 HydrophobicContact CG-CD2 4.18Å; T216-L220 PolarHBondContact O-N 2.99Å; C217-L220 PolarHBondContact O-N 3.49Å; L220-C222 PolarHBondContact O-N 3.12Å; L220-A223 PolarHBondContact O-N 3.32Å; L220-I224 HydrophobicContact CG-CD1 4.27Å; L220-I224 VanDerWaalsContact O-CG1 3.3Å; L220-I224 WeakPolarHBondContact O-CG1 3.3Å; L220-I224 PolarHBondContact O-N 3.14Å
221	I	96.4	Very high	94.3	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.4	-34.4	175.8	-68.9	165	0	0	0	111.1	M181 A185 C217 A218 I224 E225 A232 L235 I236 F278	M181-I221 HydrophobicContact CG-CD1 4.49Å; M181-I221 HydrophobicContact CG-CG1 3.85Å; M181-I221 HydrophobicContact SD-CG1 4.45Å; A185-I221 HydrophobicContact CB-CD1 3.92Å; C217-I221 HydrophobicContact CB-CD1 4.48Å; C217-I221 WeakPolarHBondContact O-CB 3.45Å; C217-I221 WeakPolarHBondContact O-CD1 3.42Å; C217-I221 WeakPolarHBondContact O-CG1 3.45Å; C217-I221 PolarHBondContact O-N 3.06Å; A218-I221 PolarHBondContact O-N 3.13Å; I221-I224 PolarHBondContact O-N 3.47Å; I221-E225 PolarHBondContact O-N 3.45Å; I221-A232 HydrophobicContact CG2-CB 4.1Å; I221-L235 HydrophobicContact CD1-CB 3.8Å; I221-L235 HydrophobicContact CG1-CB 4.23Å; I221-L235 HydrophobicContact CG1-CD1 4.16Å; I221-L235 HydrophobicContact CG2-CB 4.34Å; I221-I236 HydrophobicContact CD1-CB 3.94Å; I221-I236 HydrophobicContact CD1-CD1 4.47Å; I221-I236 HydrophobicContact CG2-CB 4.3Å; I221-I236 HydrophobicContact CG2-CG2 3.87Å; I221-F278 HydrophobicContact CG2-CZ 4.3Å
222	C	95.3	Very high	94.1	Very high	14 Å²	14	49 Å²	49	10%	0.095	26%	0.257	C	S	.	.	H	α-helix	trans	-62.1	-49.6	172.7	-170.3	0	0	0	0	111.2	A218 N219 L220 I224 E225 E226 N277 F278	A218-C222 PolarHBondContact O-N 3Å; N219-C222 WeakPolarHBondContact O-CB 3.42Å; N219-C222 PolarHBondContact O-N 3.32Å; L220-C222 PolarHBondContact O-N 3.12Å; C222-I224 VanDerWaalsContact C-N 3.25Å; C222-I224 PolarHBondContact O-N 2.91Å; C222-E225 PolarHBondContact O-N 3.32Å; C222-E225 VanDerWaalsContact O-N 3.07Å; C222-E226 PolarHBondContact O-N 2.97Å; C222-E226 VanDerWaalsContact O-N 3.15Å; C222-N277 HydrophobicContact CB-CB 3.85Å; C222-N277 VanDerWaalsContact SG-CB 3.53Å; C222-F278 HydrophobicContact CB-CE1 4.12Å; C222-F278 HydrophobicContact CB-CE2 4.44Å; C222-F278 HydrophobicContact CB-CZ 3.74Å
223	A	94.7	Very high	93.9	Very high	43 Å²	43	54.2 Å²	54.2	36%	0.355	28%	0.279	S	S	.	.	H	α-helix	trans	-58.3	-37.8	177	0	0	0	0	0	112.2	N219 L220	N219-A223 PolarHBondContact O-N 3Å; N219-A223 VanDerWaalsContact O-N 3.11Å; L220-A223 PolarHBondContact O-N 3.32Å
224	I	94.4	Very high	93.6	Very high	16 Å²	16	57.5 Å²	57.5	8%	0.082	31%	0.306	C	S	.	.	H	α-helix	trans	-67	-42.9	174.8	-60.1	165.5	0	0	0	111.3	D178 M181 L220 I221 C222 E226 L227 E228 A231	D178-I224 HydrophobicContact CB-CD1 4.11Å; D178-I224 HydrophobicContact CB-CG1 3.8Å; M181-I224 HydrophobicContact CB-CD1 3.87Å; M181-I224 HydrophobicContact CG-CD1 4.06Å; L220-I224 HydrophobicContact CG-CD1 4.27Å; L220-I224 VanDerWaalsContact O-CG1 3.3Å; L220-I224 WeakPolarHBondContact O-CG1 3.3Å; L220-I224 PolarHBondContact O-N 3.14Å; I221-I224 PolarHBondContact O-N 3.47Å; C222-I224 VanDerWaalsContact C-N 3.25Å; C222-I224 PolarHBondContact O-N 2.91Å; I224-E226 VanDerWaalsContact C-N 3.26Å; I224-E226 PolarHBondContact O-N 3.38Å; I224-L227 PolarHBondContact O-N 2.92Å; I224-L227 VanDerWaalsContact O-N 3.1Å; I224-E228 PolarHBondContact O-N 2.64Å; I224-A231 HydrophobicContact CB-CB 4.26Å; I224-A231 HydrophobicContact CG2-CB 3.57Å
225	E	92.8	Very high	93.5	Very high	49 Å²	49	58.4 Å²	58.4	23%	0.229	31%	0.311	C	S	.	.	H	α-helix	trans	-62	-32.3	-179.4	-178.7	68.7	-162.1	0	0	112.6	I221 C222 L227 E228 G230 A231 A232	I221-E225 PolarHBondContact O-N 3.45Å; C222-E225 PolarHBondContact O-N 3.32Å; C222-E225 VanDerWaalsContact O-N 3.07Å; E225-L227 VanDerWaalsContact C-N 3.28Å; E225-L227 PolarHBondContact O-N 2.79Å; E225-E228 CarbonylContact O-C 3.17Å; E225-G230 VanDerWaalsContact CD-N 3.29Å; E225-G230 PolarHBondContact OE1-N 3.02Å; E225-G230 VanDerWaalsContact OE2-C 3.31Å; E225-G230 WeakPolarHBondContact OE2-CA 3.28Å; E225-G230 PolarHBondContact OE2-N 3.32Å; E225-A231 PolarHBondContact OE2-N 3.23Å; E225-A232 HydrophobicContact CB-CB 4.11Å; E225-A232 HydrophobicContact CG-CB 3.97Å; E225-A232 WeakPolarHBondContact OE2-CB 3.04Å; E225-A232 PolarHBondContact OE2-N 2.97Å
226	E	89	Confident	93.3	Very high	162 Å²	162	57.4 Å²	57.4	76%	0.757	31%	0.305	S	S	*	.	H	α-helix	trans	-64.2	-32.4	175.1	-71.4	179.2	-176.6	0	0	112.5	C222 I224	C222-E226 PolarHBondContact O-N 2.97Å; C222-E226 VanDerWaalsContact O-N 3.15Å; I224-E226 VanDerWaalsContact C-N 3.26Å; I224-E226 PolarHBondContact O-N 3.38Å
227	L	87.6	Confident	93	Very high	160 Å²	160	59.3 Å²	59.3	84%	0.838	31%	0.311	S	S	*	.	H	α-helix	trans	-90	-42.3	178.6	-76.5	144.2	0	0	0	112.4	I224 E225	I224-L227 PolarHBondContact O-N 2.92Å; I224-L227 VanDerWaalsContact O-N 3.1Å; E225-L227 VanDerWaalsContact C-N 3.28Å; E225-L227 PolarHBondContact O-N 2.79Å
228	E	87.3	Confident	92.6	Very high	139 Å²	139	63.4 Å²	63.4	65%	0.65	34%	0.337	S	S	*	.	S	Bend	trans	-130.6	98.9	-176.8	-170.9	178.9	178.3	0	0	110.9	I224 E225 G230 A231	I224-E228 PolarHBondContact O-N 2.64Å; E225-E228 CarbonylContact O-C 3.17Å; E228-G230 PolarHBondContact O-N 3.23Å; E228-A231 PolarHBondContact O-N 2.9Å
229	K	89.6	Confident	92.4	Very high	197 Å²	197	64.4 Å²	64.4	86%	0.857	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	128.6	178.6	-67.1	-171.4	177.6	-177	0	111.5
230	G	89.9	Confident	92.1	Very high	31 Å²	31	61.3 Å²	61.3	32%	0.32	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	110.5	-11	176.6	0	0	0	0	0	115.1	E225 E228 K233 A234	E225-G230 VanDerWaalsContact CD-N 3.29Å; E225-G230 PolarHBondContact OE1-N 3.02Å; E225-G230 VanDerWaalsContact OE2-C 3.31Å; E225-G230 WeakPolarHBondContact OE2-CA 3.28Å; E225-G230 PolarHBondContact OE2-N 3.32Å; E228-G230 PolarHBondContact O-N 3.23Å; G230-K233 PolarHBondContact O-N 2.96Å; G230-A234 PolarHBondContact O-N 3.08Å
231	A	92.4	Very high	91.9	Very high	15 Å²	15	65 Å²	65	12%	0.124	34%	0.344	C	S	.	.	H	α-helix	trans	-59.3	-46.5	174.9	0	0	0	0	0	112.5	I224 E225 E228 K233 A234 L235	I224-A231 HydrophobicContact CB-CB 4.26Å; I224-A231 HydrophobicContact CG2-CB 3.57Å; E225-A231 PolarHBondContact OE2-N 3.23Å; E228-A231 PolarHBondContact O-N 2.9Å; A231-K233 VanDerWaalsContact C-N 3.33Å; A231-K233 PolarHBondContact O-N 3.49Å; A231-A234 PolarHBondContact O-N 3.16Å; A231-A234 VanDerWaalsContact O-N 3.13Å; A231-L235 WeakPolarHBondContact O-CB 3.47Å; A231-L235 WeakPolarHBondContact O-CG 3.34Å; A231-L235 PolarHBondContact O-N 2.93Å
232	A	93	Very high	91.8	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-63.6	-39.1	179.8	0	0	0	0	0	112.1	I221 E225 A234 L235 I236 F237 F278	I221-A232 HydrophobicContact CG2-CB 4.1Å; E225-A232 HydrophobicContact CB-CB 4.11Å; E225-A232 HydrophobicContact CG-CB 3.97Å; E225-A232 WeakPolarHBondContact OE2-CB 3.04Å; E225-A232 PolarHBondContact OE2-N 2.97Å; A232-A234 VanDerWaalsContact C-N 3.27Å; A232-A234 PolarHBondContact O-N 3.29Å; A232-L235 PolarHBondContact O-N 3.4Å; A232-I236 HydrophobicContact CB-CG2 4.28Å; A232-I236 PolarHBondContact O-N 3.47Å; A232-I236 VanDerWaalsContact O-N 3.09Å; A232-F237 HydrophobicContact CB-CD1 4.3Å; A232-F237 HydrophobicContact CB-CE1 3.76Å; A232-F237 HydrophobicContact CB-CE2 4.43Å; A232-F237 HydrophobicContact CB-CZ 3.82Å; A232-F237 WeakPolarHBondContact O-CG 3.34Å; A232-F237 PolarHBondContact O-N 3.18Å; A232-F278 HydrophobicContact CB-CD1 4.36Å; A232-F278 HydrophobicContact CB-CE1 3.77Å
233	K	92.8	Very high	91.8	Very high	150 Å²	150	69 Å²	69	65%	0.652	36%	0.361	S	S	*	.	H	α-helix	trans	-61.6	-36.3	175.1	-72	-179.7	-179.7	173.8	0	112.1	G230 A231 F237	G230-K233 PolarHBondContact O-N 2.96Å; A231-K233 VanDerWaalsContact C-N 3.33Å; A231-K233 PolarHBondContact O-N 3.49Å; K233-F237 HydrophobicContact CB-CD2 4.23Å; K233-F237 HydrophobicContact CG-CD2 3.67Å; K233-F237 HydrophobicContact CG-CE2 3.76Å
234	A	92.3	Very high	91.8	Very high	70 Å²	70	67 Å²	67	58%	0.579	34%	0.344	S	S	*	.	H	α-helix	trans	-81.1	-39	-179.3	0	0	0	0	0	112.9	G230 A231 A232	G230-A234 PolarHBondContact O-N 3.08Å; A231-A234 PolarHBondContact O-N 3.16Å; A231-A234 VanDerWaalsContact O-N 3.13Å; A232-A234 VanDerWaalsContact C-N 3.27Å; A232-A234 PolarHBondContact O-N 3.29Å
235	L	93.9	Very high	91.9	Very high	18 Å²	18	69.8 Å²	69.8	9%	0.094	36%	0.357	C	S	.	.	H	α-helix	trans	-100.8	-40.3	-164.8	-60.2	179.2	0	0	0	114.6	P182 A185 P186 I221 A231 A232	P182-L235 HydrophobicContact CB-CD2 4.35Å; P182-L235 HydrophobicContact CG-CD1 4.38Å; A185-L235 HydrophobicContact CB-CB 4.43Å; P186-L235 HydrophobicContact CG-CD2 3.82Å; I221-L235 HydrophobicContact CD1-CB 3.8Å; I221-L235 HydrophobicContact CG1-CB 4.23Å; I221-L235 HydrophobicContact CG1-CD1 4.16Å; I221-L235 HydrophobicContact CG2-CB 4.34Å; A231-L235 WeakPolarHBondContact O-CB 3.47Å; A231-L235 WeakPolarHBondContact O-CG 3.34Å; A231-L235 PolarHBondContact O-N 2.93Å; A232-L235 PolarHBondContact O-N 3.4Å
236	I	93.7	Very high	92.1	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-38.7	-171.7	-160.4	170.7	0	0	0	114	L189 F214 A218 I221 A232 P238 V239 V240 L274 F278	L189-I236 HydrophobicContact CD1-CG1 4.38Å; F214-I236 HydrophobicContact CE2-CD1 4.32Å; F214-I236 HydrophobicContact CE2-CG1 4.5Å; F214-I236 HydrophobicContact CZ-CD1 4.21Å; A218-I236 HydrophobicContact CB-CD1 3.45Å; A218-I236 VanDerWaalsContact CB-CD1 3.45Å; I221-I236 HydrophobicContact CD1-CB 3.94Å; I221-I236 HydrophobicContact CD1-CD1 4.47Å; I221-I236 HydrophobicContact CG2-CB 4.3Å; I221-I236 HydrophobicContact CG2-CG2 3.87Å; A232-I236 HydrophobicContact CB-CG2 4.28Å; A232-I236 PolarHBondContact O-N 3.47Å; A232-I236 VanDerWaalsContact O-N 3.09Å; I236-P238 VanDerWaalsContact C-N 3.27Å; I236-P238 VanDerWaalsContact O-N 3.1Å; I236-V239 HydrophobicContact CG1-CG2 4.3Å; I236-V239 WeakPolarHBondContact O-CG2 3.3Å; I236-V239 PolarHBondContact O-N 2.93Å; I236-V240 HydrophobicContact CB-CG2 4.42Å; I236-V240 HydrophobicContact CD1-CG2 4.42Å; I236-V240 HydrophobicContact CG1-CG2 3.79Å; I236-V240 HydrophobicContact CG2-CG2 4.25Å; I236-V240 WeakPolarHBondContact O-CG2 3.45Å; I236-V240 PolarHBondContact O-N 3.14Å; I236-L274 HydrophobicContact CD1-CD2 4.46Å; I236-F278 HydrophobicContact CD1-CE2 4.22Å; I236-F278 HydrophobicContact CG2-CE2 4.28Å; I236-F278 HydrophobicContact CG2-CZ 4.11Å
237	F	92.1	Very high	92.5	Very high	67 Å²	67	60 Å²	60	29%	0.294	31%	0.312	S	S	.	.	H	α-helix	trans	-54.4	-32.6	-177.6	-70.5	2	0	0	0	115.2	A232 K233 V239 V240 F278 P281	A232-F237 HydrophobicContact CB-CD1 4.3Å; A232-F237 HydrophobicContact CB-CE1 3.76Å; A232-F237 HydrophobicContact CB-CE2 4.43Å; A232-F237 HydrophobicContact CB-CZ 3.82Å; A232-F237 WeakPolarHBondContact O-CG 3.34Å; A232-F237 PolarHBondContact O-N 3.18Å; K233-F237 HydrophobicContact CB-CD2 4.23Å; K233-F237 HydrophobicContact CG-CD2 3.67Å; K233-F237 HydrophobicContact CG-CE2 3.76Å; F237-V239 PolarHBondContact O-N 3.28Å; F237-V240 HydrophobicContact CD1-CG2 4.19Å; F237-F278 HydrophobicContact CE1-CB 4.28Å; F237-F278 AromaticContact CE1-CD1 3.72Å; F237-F278 HydrophobicContact CE1-CD1 3.72Å; F237-F278 HydrophobicContact CE1-CE1 4.29Å; F237-F278 HydrophobicContact CE1-CG 4.06Å; F237-F278 HydrophobicContact CZ-CD1 4.21Å; F237-P281 HydrophobicContact CD1-CG 4.18Å; F237-P281 HydrophobicContact CD2-CG 4.45Å; F237-P281 HydrophobicContact CE1-CG 3.64Å; F237-P281 HydrophobicContact CE2-CG 3.94Å; F237-P281 HydrophobicContact CZ-CG 3.52Å
238	P	89.3	Confident	92.8	Very high	85 Å²	85	52.4 Å²	52.4	55%	0.552	27%	0.272	S	S	*	.	H	α-helix	trans	-59.9	-24.7	174.2	-25.9	36.4	0	0	0	114.4	I236	I236-P238 VanDerWaalsContact C-N 3.27Å; I236-P238 VanDerWaalsContact O-N 3.1Å
239	V	91.7	Very high	93.1	Very high	22 Å²	22	51.5 Å²	51.5	13%	0.133	27%	0.268	C	S	.	.	H	α-helix	trans	-112.1	-18.6	-176.6	-58.3	0	0	0	0	113.7	L189 I236 F237 Q241 Q242 F243	L189-V239 HydrophobicContact CB-CG2 4.34Å; L189-V239 HydrophobicContact CD1-CG2 4.03Å; I236-V239 HydrophobicContact CG1-CG2 4.3Å; I236-V239 WeakPolarHBondContact O-CG2 3.3Å; I236-V239 PolarHBondContact O-N 2.93Å; F237-V239 PolarHBondContact O-N 3.28Å; V239-Q241 VanDerWaalsContact C-N 3.32Å; V239-Q241 PolarHBondContact O-N 2.96Å; V239-Q242 PolarHBondContact O-N 3.48Å; V239-Q242 VanDerWaalsContact O-N 3.1Å; V239-F243 HydrophobicContact CB-CD2 3.88Å; V239-F243 HydrophobicContact CB-CE2 4.05Å; V239-F243 HydrophobicContact CG2-CD2 4.01Å; V239-F243 HydrophobicContact CG2-CE2 4.09Å; V239-F243 WeakPolarHBondContact O-CD2 3.16Å; V239-F243 PolarHBondContact O-N 3.39Å
240	V	91	Very high	93.4	Very high	8 Å²	8	42.6 Å²	42.6	5%	0.048	23%	0.231	C	C	.	.	H	α-helix	trans	-49.5	-50.8	-178.1	169.5	0	0	0	0	111.5	I236 F237 Q242 F243 T244 L274 M282	I236-V240 HydrophobicContact CB-CG2 4.42Å; I236-V240 HydrophobicContact CD1-CG2 4.42Å; I236-V240 HydrophobicContact CG1-CG2 3.79Å; I236-V240 HydrophobicContact CG2-CG2 4.25Å; I236-V240 WeakPolarHBondContact O-CG2 3.45Å; I236-V240 PolarHBondContact O-N 3.14Å; F237-V240 HydrophobicContact CD1-CG2 4.19Å; V240-Q242 VanDerWaalsContact C-N 3.35Å; V240-Q242 PolarHBondContact O-N 3.04Å; V240-F243 PolarHBondContact O-N 3.04Å; V240-T244 WeakPolarHBondContact O-CB 3.48Å; V240-T244 PolarHBondContact O-N 3.36Å; V240-T244 PolarHBondContact O-OG1 3.06Å; V240-L274 HydrophobicContact CG1-CD1 4.44Å; V240-L274 HydrophobicContact CG2-CD2 4.34Å; V240-M282 HydrophobicContact CG1-SD 3.93Å
241	Q	90.8	Very high	93.6	Very high	119 Å²	119	41.4 Å²	41.4	56%	0.556	22%	0.218	S	C	*	.	H	α-helix	trans	-60.3	-44.6	-177.2	-176.7	177.9	-4.2	0	0	112.1	V239 T244 E245	V239-Q241 VanDerWaalsContact C-N 3.32Å; V239-Q241 PolarHBondContact O-N 2.96Å; Q241-T244 PolarHBondContact O-N 3.45Å; Q241-E245 WeakPolarHBondContact CG-OE1 3.38Å; Q241-E245 PolarHBondContact NE2-OE1 3.17Å; Q241-E245 WeakPolarHBondContact O-CG 3.39Å; Q241-E245 PolarHBondContact O-N 3.01Å
242	Q	93.8	Very high	93.6	Very high	97 Å²	97	46.2 Å²	46.2	45%	0.453	24%	0.237	S	C	.	.	H	α-helix	trans	-63.9	-45.4	-179.6	-65.5	-178.7	-6.3	0	0	111.2	Y193 V239 V240 E245 A246	Y193-Q242 HydrophobicContact CD2-CB 4.37Å; Y193-Q242 HydrophobicContact CE2-CB 3.8Å; Y193-Q242 WeakPolarHBondContact CE2-O 3.33Å; V239-Q242 PolarHBondContact O-N 3.48Å; V239-Q242 VanDerWaalsContact O-N 3.1Å; V240-Q242 VanDerWaalsContact C-N 3.35Å; V240-Q242 PolarHBondContact O-N 3.04Å; Q242-E245 PolarHBondContact O-N 2.86Å; Q242-A246 WeakPolarHBondContact O-CB 3.38Å; Q242-A246 PolarHBondContact O-N 3.47Å; Q242-A246 VanDerWaalsContact O-N 3.07Å
243	F	96.6	Very high	93.6	Very high	1 Å²	1	50.4 Å²	50.4	0%	0.004	26%	0.258	C	S	.	.	H	α-helix	trans	-63.2	-46	176.5	-89.4	-82.3	0	0	0	111.8	L189 M192 Y193 F214 V239 V240 E245 A246 F247	L189-F243 HydrophobicContact CB-CE2 4.47Å; L189-F243 VanDerWaalsContact O-CZ 3.27Å; L189-F243 WeakPolarHBondContact O-CZ 3.23Å; M192-F243 HydrophobicContact CB-CZ 4.13Å; Y193-F243 VanDerWaalsContact CB-CZ 3.49Å; Y193-F243 HydrophobicContact CD2-CD1 4.08Å; Y193-F243 HydrophobicContact CD2-CD2 4.01Å; Y193-F243 HydrophobicContact CD2-CE1 4.15Å; Y193-F243 HydrophobicContact CD2-CE2 4.08Å; Y193-F243 HydrophobicContact CD2-CG 4.04Å; Y193-F243 HydrophobicContact CD2-CZ 4.16Å; Y193-F243 HydrophobicContact CG-CE2 4.35Å; Y193-F243 HydrophobicContact CG-CZ 4.35Å; F214-F243 HydrophobicContact CB-CE1 4.34Å; F214-F243 HydrophobicContact CD2-CB 4.44Å; F214-F243 AromaticContact CD2-CD1 3.69Å; F214-F243 HydrophobicContact CD2-CD1 3.69Å; F214-F243 AromaticContact CD2-CD2 3.78Å; F214-F243 HydrophobicContact CD2-CD2 3.78Å; F214-F243 AromaticContact CD2-CE1 3.69Å; F214-F243 HydrophobicContact CD2-CE1 3.69Å; F214-F243 AromaticContact CD2-CE2 3.78Å; F214-F243 HydrophobicContact CD2-CE2 3.78Å; F214-F243 AromaticContact CD2-CG 3.71Å; F214-F243 HydrophobicContact CD2-CG 3.71Å; F214-F243 AromaticContact CD2-CZ 3.71Å; F214-F243 HydrophobicContact CD2-CZ 3.71Å; F214-F243 HydrophobicContact CE2-CB 3.83Å; F214-F243 AromaticContact CE2-CD1 3.95Å; F214-F243 HydrophobicContact CE2-CD1 3.95Å; F214-F243 AromaticContact CE2-CD2 3.53Å; F214-F243 HydrophobicContact CE2-CD2 3.53Å; F214-F243 HydrophobicContact CE2-CE1 4.35Å; F214-F243 AromaticContact CE2-CE2 3.97Å; F214-F243 HydrophobicContact CE2-CE2 3.97Å; F214-F243 AromaticContact CE2-CG 3.5Å; F214-F243 HydrophobicContact CE2-CG 3.5Å; F214-F243 VanDerWaalsContact CE2-CG 3.5Å; F214-F243 HydrophobicContact CE2-CZ 4.33Å; F214-F243 HydrophobicContact CG-CD1 4.2Å; F214-F243 HydrophobicContact CG-CE1 4.2Å; F214-F243 HydrophobicContact CZ-CB 4.05Å; F214-F243 HydrophobicContact CZ-CG 4.19Å; V239-F243 HydrophobicContact CB-CD2 3.88Å; V239-F243 HydrophobicContact CB-CE2 4.05Å; V239-F243 HydrophobicContact CG2-CD2 4.01Å; V239-F243 HydrophobicContact CG2-CE2 4.09Å; V239-F243 WeakPolarHBondContact O-CD2 3.16Å; V239-F243 PolarHBondContact O-N 3.39Å; V240-F243 PolarHBondContact O-N 3.04Å; F243-E245 VanDerWaalsContact C-N 3.34Å; F243-E245 PolarHBondContact O-N 2.6Å; F243-A246 CarbonylContact O-C 3.49Å; F243-A246 PolarHBondContact O-N 3.48Å; F243-A246 VanDerWaalsContact O-N 3.12Å; F243-F247 HydrophobicContact CB-CD2 4.37Å; F243-F247 HydrophobicContact CB-CE2 3.87Å; F243-F247 HydrophobicContact CB-CZ 4.07Å; F243-F247 AromaticContact CD1-CE1 3.91Å; F243-F247 HydrophobicContact CD1-CE1 3.91Å; F243-F247 HydrophobicContact CD1-CE2 4.26Å; F243-F247 AromaticContact CD1-CZ 3.59Å; F243-F247 HydrophobicContact CD1-CZ 3.59Å; F243-F247 HydrophobicContact CE1-CZ 4.47Å; F243-F247 HydrophobicContact CG-CZ 4.25Å; F243-F247 WeakPolarHBondContact O-CB 3.13Å; F243-F247 VanDerWaalsContact O-CD2 3.3Å; F243-F247 WeakPolarHBondContact O-CD2 3.35Å; F243-F247 WeakPolarHBondContact O-CG 3.29Å; F243-F247 PolarHBondContact O-N 2.98Å
244	T	95	Very high	93.4	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-58.4	-45.4	177.7	-61.6	0	0	0	0	111.5	V240 Q241 A246 F247 V248 M282 I289	V240-T244 WeakPolarHBondContact O-CB 3.48Å; V240-T244 PolarHBondContact O-N 3.36Å; V240-T244 PolarHBondContact O-OG1 3.06Å; Q241-T244 PolarHBondContact O-N 3.45Å; T244-A246 VanDerWaalsContact C-N 3.32Å; T244-A246 PolarHBondContact O-N 2.88Å; T244-F247 PolarHBondContact O-N 3.47Å; T244-V248 HydrophobicContact CG2-CG2 4.43Å; T244-V248 WeakPolarHBondContact O-CB 3.29Å; T244-V248 WeakPolarHBondContact O-CG2 3.46Å; T244-V248 PolarHBondContact O-N 2.9Å; T244-M282 HydrophobicContact CG2-CE 3.83Å; T244-M282 HydrophobicContact CG2-SD 4.43Å; T244-I289 HydrophobicContact CG2-CD1 3.87Å; T244-I289 HydrophobicContact CG2-CG1 4.32Å
245	E	94.9	Very high	93.1	Very high	75 Å²	75	48.7 Å²	48.7	35%	0.35	25%	0.251	S	S	.	.	H	α-helix	trans	-60.6	-41.4	175.9	-72.9	171	-167.1	0	0	111.9	Q241 Q242 F243 Q249	Q241-E245 WeakPolarHBondContact CG-OE1 3.38Å; Q241-E245 PolarHBondContact NE2-OE1 3.17Å; Q241-E245 WeakPolarHBondContact O-CG 3.39Å; Q241-E245 PolarHBondContact O-N 3.01Å; Q242-E245 PolarHBondContact O-N 2.86Å; F243-E245 VanDerWaalsContact C-N 3.34Å; F243-E245 PolarHBondContact O-N 2.6Å; E245-Q249 WeakPolarHBondContact O-CG 3.37Å; E245-Q249 PolarHBondContact O-N 2.75Å; E245-Q249 VanDerWaalsContact O-N 3.13Å
246	A	96.9	Very high	92.8	Very high	6 Å²	6	49.6 Å²	49.6	5%	0.05	27%	0.265	C	S	.	.	H	α-helix	trans	-70.5	-39.3	178.1	0	0	0	0	0	112.8	Y193 F196 T197 Q242 F243 T244 V248 Q249 A250	Y193-A246 HydrophobicContact CE2-CB 3.85Å; F196-A246 HydrophobicContact CD1-CB 3.97Å; F196-A246 HydrophobicContact CE1-CB 3.67Å; T197-A246 HydrophobicContact CG2-CB 4Å; Q242-A246 WeakPolarHBondContact O-CB 3.38Å; Q242-A246 PolarHBondContact O-N 3.47Å; Q242-A246 VanDerWaalsContact O-N 3.07Å; F243-A246 CarbonylContact O-C 3.49Å; F243-A246 PolarHBondContact O-N 3.48Å; F243-A246 VanDerWaalsContact O-N 3.12Å; T244-A246 VanDerWaalsContact C-N 3.32Å; T244-A246 PolarHBondContact O-N 2.88Å; A246-V248 VanDerWaalsContact C-N 3.34Å; A246-Q249 PolarHBondContact O-N 3.43Å; A246-A250 WeakPolarHBondContact O-CB 3.46Å; A246-A250 PolarHBondContact O-N 3.02Å
247	F	97.4	Very high	92.4	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-60.1	-47.3	175.1	-70.8	-25.8	0	0	0	110.9	F196 V211 F214 F243 T244 Q249 A250 L251 V267 A270 V271 L274	F196-F247 HydrophobicContact CD1-CD1 4.45Å; F196-F247 HydrophobicContact CD1-CE1 4.44Å; F196-F247 AromaticContact CE1-CD1 3.66Å; F196-F247 HydrophobicContact CE1-CD1 3.66Å; F196-F247 HydrophobicContact CE1-CE1 4.07Å; F196-F247 HydrophobicContact CE2-CD1 4.36Å; F196-F247 AromaticContact CZ-CD1 3.62Å; F196-F247 HydrophobicContact CZ-CD1 3.62Å; F196-F247 HydrophobicContact CZ-CE1 4.11Å; V211-F247 HydrophobicContact CG1-CE1 3.98Å; V211-F247 HydrophobicContact CG1-CZ 4.23Å; V211-F247 HydrophobicContact CG2-CE1 3.99Å; F214-F247 AromaticContact CD1-CE2 3.94Å; F214-F247 HydrophobicContact CD1-CE2 3.94Å; F214-F247 AromaticContact CD1-CZ 3.68Å; F214-F247 HydrophobicContact CD1-CZ 3.68Å; F214-F247 AromaticContact CE1-CE2 3.65Å; F214-F247 HydrophobicContact CE1-CE2 3.65Å; F214-F247 AromaticContact CE1-CZ 3.89Å; F214-F247 HydrophobicContact CE1-CZ 3.89Å; F214-F247 HydrophobicContact CG-CZ 4.07Å; F214-F247 HydrophobicContact CZ-CE2 4.12Å; F214-F247 HydrophobicContact CZ-CZ 4.43Å; F243-F247 HydrophobicContact CB-CD2 4.37Å; F243-F247 HydrophobicContact CB-CE2 3.87Å; F243-F247 HydrophobicContact CB-CZ 4.07Å; F243-F247 AromaticContact CD1-CE1 3.91Å; F243-F247 HydrophobicContact CD1-CE1 3.91Å; F243-F247 HydrophobicContact CD1-CE2 4.26Å; F243-F247 AromaticContact CD1-CZ 3.59Å; F243-F247 HydrophobicContact CD1-CZ 3.59Å; F243-F247 HydrophobicContact CE1-CZ 4.47Å; F243-F247 HydrophobicContact CG-CZ 4.25Å; F243-F247 WeakPolarHBondContact O-CB 3.13Å; F243-F247 VanDerWaalsContact O-CD2 3.3Å; F243-F247 WeakPolarHBondContact O-CD2 3.35Å; F243-F247 WeakPolarHBondContact O-CG 3.29Å; F243-F247 PolarHBondContact O-N 2.98Å; T244-F247 PolarHBondContact O-N 3.47Å; F247-Q249 VanDerWaalsContact C-N 3.31Å; F247-Q249 PolarHBondContact O-N 2.93Å; F247-A250 PolarHBondContact O-N 2.94Å; F247-A250 VanDerWaalsContact O-N 3.1Å; F247-L251 PolarHBondContact O-N 3.46Å; F247-V267 HydrophobicContact CB-CG1 3.55Å; F247-V267 HydrophobicContact CD1-CG1 3.89Å; F247-V267 HydrophobicContact CD1-CG2 4.27Å; F247-V267 HydrophobicContact CG-CG1 3.93Å; F247-V267 WeakPolarHBondContact O-CG1 3.36Å; F247-A270 HydrophobicContact CD2-CB 4.5Å; F247-A270 HydrophobicContact CE2-CB 3.88Å; F247-A270 HydrophobicContact CZ-CB 3.91Å; F247-V271 HydrophobicContact CB-CG2 3.86Å; F247-V271 HydrophobicContact CD2-CG2 3.93Å; F247-V271 HydrophobicContact CG-CG2 4.23Å; F247-L274 HydrophobicContact CE2-CD1 4.24Å
248	V	93.9	Very high	92.3	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.006	31%	0.305	C	S	.	.	H	α-helix	trans	-62.3	-39.7	178.8	172.9	0	0	0	0	111.6	T244 A246 Q252 Q288 I289 I292	T244-V248 HydrophobicContact CG2-CG2 4.43Å; T244-V248 WeakPolarHBondContact O-CB 3.29Å; T244-V248 WeakPolarHBondContact O-CG2 3.46Å; T244-V248 PolarHBondContact O-N 2.9Å; A246-V248 VanDerWaalsContact C-N 3.34Å; V248-Q252 WeakPolarHBondContact O-CG 3.38Å; V248-Q288 HydrophobicContact CG1-CG 3.92Å; V248-I289 HydrophobicContact CG2-CG1 3.67Å; V248-I292 HydrophobicContact CB-CD1 4.5Å; V248-I292 HydrophobicContact CG1-CD1 3.06Å; V248-I292 HydrophobicContact CG1-CG1 4.32Å; V248-I292 HydrophobicContact CG1-CG2 4.5Å
249	Q	94.8	Very high	92.4	Very high	120 Å²	120	51 Å²	51	56%	0.561	28%	0.28	S	S	*	.	H	α-helix	trans	-65	-39.8	172.9	-72.5	175.1	11	0	0	112.5	E245 A246 F247 Q252	E245-Q249 WeakPolarHBondContact O-CG 3.37Å; E245-Q249 PolarHBondContact O-N 2.75Å; E245-Q249 VanDerWaalsContact O-N 3.13Å; A246-Q249 PolarHBondContact O-N 3.43Å; F247-Q249 VanDerWaalsContact C-N 3.31Å; F247-Q249 PolarHBondContact O-N 2.93Å; Q249-Q252 PolarHBondContact O-N 2.8Å
250	A	95.3	Very high	92.4	Very high	9 Å²	9	50.8 Å²	50.8	7%	0.074	28%	0.279	C	S	.	.	H	α-helix	trans	-66.5	-37.9	179.8	0	0	0	0	0	112.6	F196 A246 F247 Q252 M253 V267	F196-A250 HydrophobicContact CE1-CB 4.38Å; F196-A250 HydrophobicContact CE2-CB 4.33Å; F196-A250 HydrophobicContact CZ-CB 3.57Å; A246-A250 WeakPolarHBondContact O-CB 3.46Å; A246-A250 PolarHBondContact O-N 3.02Å; F247-A250 PolarHBondContact O-N 2.94Å; F247-A250 VanDerWaalsContact O-N 3.1Å; A250-Q252 PolarHBondContact O-N 3.42Å; A250-M253 WeakPolarHBondContact O-CB 3.35Å; A250-M253 PolarHBondContact O-N 2.69Å; A250-M253 VanDerWaalsContact O-N 3.14Å; A250-V267 HydrophobicContact CB-CG2 4.32Å
251	L	94.1	Very high	92.2	Very high	7 Å²	7	50.9 Å²	50.9	4%	0.037	28%	0.28	C	S	.	.	H	α-helix	trans	-63.3	-28.5	176.6	-71.7	173.9	0	0	0	113.1	F247 M253 K264 V267 L268 I292 V293	F247-L251 PolarHBondContact O-N 3.46Å; L251-M253 VanDerWaalsContact C-N 3.29Å; L251-M253 PolarHBondContact O-N 3.18Å; L251-K264 HydrophobicContact CD2-CB 4.15Å; L251-K264 HydrophobicContact CD2-CG 4.37Å; L251-V267 HydrophobicContact CD1-CG1 4.21Å; L251-V267 HydrophobicContact CD2-CB 4.2Å; L251-V267 HydrophobicContact CD2-CG1 3.94Å; L251-V267 HydrophobicContact CG-CG1 3.71Å; L251-L268 HydrophobicContact CD1-CD1 4.48Å; L251-L268 HydrophobicContact CD2-CB 4.42Å; L251-I292 HydrophobicContact CB-CG2 3.81Å; L251-V293 HydrophobicContact CD1-CG2 4.26Å
252	Q	93.3	Very high	92.2	Very high	116 Å²	116	45.4 Å²	45.4	54%	0.542	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-11.8	177.6	-66.1	179.8	-37.6	0	0	113.7	V248 Q249 A250 I292	V248-Q252 WeakPolarHBondContact O-CG 3.38Å; Q249-Q252 PolarHBondContact O-N 2.8Å; A250-Q252 PolarHBondContact O-N 3.42Å; Q252-I292 HydrophobicContact CG-CD1 3.98Å; Q252-I292 HydrophobicContact CG-CG1 4.04Å; Q252-I292 HydrophobicContact CG-CG2 3.74Å
253	M	91.7	Very high	92.2	Very high	87 Å²	87	40.9 Å²	40.9	43%	0.429	23%	0.233	S	C	.	.	S	Bend	trans	-75	127.1	-177.5	-66.7	-62.5	-63.6	0	0	110.2	A250 L251 K264	A250-M253 WeakPolarHBondContact O-CB 3.35Å; A250-M253 PolarHBondContact O-N 2.69Å; A250-M253 VanDerWaalsContact O-N 3.14Å; L251-M253 VanDerWaalsContact C-N 3.29Å; L251-M253 PolarHBondContact O-N 3.18Å; M253-K264 WeakPolarHBondContact O-CE 3.29Å; M253-K264 PolarHBondContact O-NZ 2.83Å
254	P	88.1	Confident	92	Very high	97 Å²	97	41.8 Å²	41.8	63%	0.63	24%	0.237	S	C	*	.	P	Polyproline II helix	trans	-66.8	158.5	173.8	30	-34.9	0	0	0	110.4
255	D	87.3	Confident	92	Very high	87 Å²	87	42.4 Å²	42.4	47%	0.465	24%	0.24	S	C	.	.	S	Bend	trans	-64	140	178.9	-66.9	-14.7	0	0	0	111.3	S259 D260 K264	D255-S259 CarbonylContact C-O 3.6Å; D255-S259 WeakPolarHBondContact CA-O 3.36Å; D255-D260 WeakPolarHBondContact OD1-CA 3.46Å; D255-K264 IonicContact OD1-NZ 3.22Å; D255-K264 PolarHBondContact OD1-NZ 2.91Å
256	G	87.1	Confident	92	Very high	37 Å²	37	40.2 Å²	40.2	38%	0.381	23%	0.23	S	C	.	.	B	Isolated β-bridge	trans	166.4	-156.9	-173.2	0	0	0	0	0	112.8	T258 S259	G256-T258 PolarHBondContact O-N 2.83Å; G256-S259 PolarHBondContact N-O 2.79Å; G256-S259 PolarHBondContact O-N 3.09Å
257	P	86.3	Confident	92.1	Very high	130 Å²	130	40 Å²	40	84%	0.844	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-19.7	-174.3	-24.6	34.7	0	0	0	115
258	T	89.8	Confident	92	Very high	48 Å²	48	40 Å²	40	29%	0.294	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.2	-1.9	-173.8	55.3	0	0	0	0	113.8	A199 R207 G256	A199-T258 HydrophobicContact CB-CG2 4.13Å; R207-T258 PolarHBondContact NH1-O 3.17Å; G256-T258 PolarHBondContact O-N 2.83Å
259	S	91.5	Very high	92.1	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.021	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-156.2	145.6	179	-169.2	0	0	0	0	111	D255 G256	D255-S259 CarbonylContact C-O 3.6Å; D255-S259 WeakPolarHBondContact CA-O 3.36Å; G256-S259 PolarHBondContact N-O 2.79Å; G256-S259 PolarHBondContact O-N 3.09Å
260	D	90.1	Very high	92.3	Very high	19 Å²	19	37.7 Å²	37.7	10%	0.102	22%	0.216	C	C	.	.			trans	-148.3	177.7	169.2	63.5	14.8	0	0	0	110.1	I204 R205 D255 G262 L263 K264	I204-D260 HydrophobicContact CD1-CB 4.46Å; I204-D260 WeakPolarHBondContact CG2-OD1 3.39Å; R205-D260 IonicContact CZ-OD1 3.19Å; R205-D260 IonicContact CZ-OD2 3.59Å; R205-D260 IonicContact NH1-OD2 4Å; R205-D260 PolarHBondContact NH1-OD2 2.84Å; R205-D260 IonicContact NH2-OD1 3.7Å; R205-D260 PolarHBondContact NH2-OD1 3.38Å; R205-D260 IonicContact NH2-OD2 2.65Å; R205-D260 PolarHBondContact NH2-OD2 3.46Å; D255-D260 WeakPolarHBondContact OD1-CA 3.46Å; D260-G262 VanDerWaalsContact C-N 3.27Å; D260-G262 PolarHBondContact O-N 2.84Å; D260-G262 PolarHBondContact OD1-N 2.87Å; D260-L263 PolarHBondContact O-N 3.5Å; D260-L263 PolarHBondContact OD1-N 2.96Å; D260-K264 PolarHBondContact O-N 2.76Å; D260-K264 VanDerWaalsContact O-N 3.11Å
261	S	88.4	Confident	92.4	Very high	10 Å²	10	37.2 Å²	37.2	7%	0.07	21%	0.213	C	C	.	.	H	α-helix	trans	-54.8	-40.4	179.8	-50.4	0	0	0	0	113.1	K264 M265	S261-K264 PolarHBondContact O-N 2.87Å; S261-M265 WeakPolarHBondContact O-CB 3.46Å; S261-M265 PolarHBondContact O-N 3.29Å
262	G	89.8	Confident	92.5	Very high	3 Å²	3	37.1 Å²	37.1	3%	0.031	21%	0.212	C	C	.	.	H	α-helix	trans	-66.1	-41.9	-179.5	0	0	0	0	0	113.2	D260 E266	D260-G262 VanDerWaalsContact C-N 3.27Å; D260-G262 PolarHBondContact O-N 2.84Å; D260-G262 PolarHBondContact OD1-N 2.87Å; G262-E266 PolarHBondContact O-N 2.86Å
263	L	93.1	Very high	92.7	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-65.8	-43.2	174.1	178.1	63.8	0	0	0	111.6	F196 I204 R207 D260 M265 E266 V267	F196-L263 HydrophobicContact CE2-CD1 4.29Å; I204-L263 HydrophobicContact CG2-CB 3.61Å; I204-L263 HydrophobicContact CG2-CD2 4.01Å; I204-L263 HydrophobicContact CG2-CG 4.34Å; R207-L263 HydrophobicContact CB-CD1 4.35Å; D260-L263 PolarHBondContact O-N 3.5Å; D260-L263 PolarHBondContact OD1-N 2.96Å; L263-M265 VanDerWaalsContact C-N 3.3Å; L263-M265 PolarHBondContact O-N 3.34Å; L263-E266 PolarHBondContact O-N 2.72Å; L263-V267 HydrophobicContact CD1-CG2 4.28Å; L263-V267 HydrophobicContact CG-CG2 4.42Å; L263-V267 VanDerWaalsContact O-CG2 3.28Å; L263-V267 WeakPolarHBondContact O-CG2 3.47Å; L263-V267 PolarHBondContact O-N 3Å
264	K	94.1	Very high	92.9	Very high	20 Å²	20	28 Å²	28	9%	0.087	17%	0.171	C	C	.	.	H	α-helix	trans	-61.1	-41	178	-74.5	172.5	175.1	158.5	0	111.8	L251 M253 D255 D260 S261 V267 L268 L331	L251-K264 HydrophobicContact CD2-CB 4.15Å; L251-K264 HydrophobicContact CD2-CG 4.37Å; M253-K264 WeakPolarHBondContact O-CE 3.29Å; M253-K264 PolarHBondContact O-NZ 2.83Å; D255-K264 IonicContact OD1-NZ 3.22Å; D255-K264 PolarHBondContact OD1-NZ 2.91Å; D260-K264 PolarHBondContact O-N 2.76Å; D260-K264 VanDerWaalsContact O-N 3.11Å; S261-K264 PolarHBondContact O-N 2.87Å; K264-V267 PolarHBondContact O-N 3.28Å; K264-L268 WeakPolarHBondContact O-CB 3.46Å; K264-L268 PolarHBondContact O-N 3.04Å; K264-L331 HydrophobicContact CB-CD1 3.88Å; K264-L331 HydrophobicContact CB-CD2 4.3Å; K264-L331 HydrophobicContact CD-CD2 4.45Å
265	M	94.4	Very high	93.3	Very high	13 Å²	13	23.4 Å²	23.4	6%	0.064	14%	0.141	C	C	.	.	H	α-helix	trans	-58.4	-52	175.8	176.3	-160.9	57.4	0	0	110.6	S261 L263 V267 L268 K269 N330 L331	S261-M265 WeakPolarHBondContact O-CB 3.46Å; S261-M265 PolarHBondContact O-N 3.29Å; L263-M265 VanDerWaalsContact C-N 3.3Å; L263-M265 PolarHBondContact O-N 3.34Å; M265-V267 VanDerWaalsContact C-N 3.32Å; M265-V267 PolarHBondContact O-N 3.01Å; M265-L268 PolarHBondContact O-N 3.26Å; M265-L268 VanDerWaalsContact O-N 3.14Å; M265-K269 HydrophobicContact CG-CD 4.35Å; M265-K269 WeakPolarHBondContact O-CG 3.42Å; M265-K269 PolarHBondContact O-N 3Å; M265-K269 PolarHBondContact SD-NZ 3.47Å; M265-N330 HydrophobicContact SD-CB 3.5Å; M265-N330 WeakPolarHBondContact SD-CB 3.23Å; M265-L331 HydrophobicContact CB-CB 4.38Å; M265-L331 HydrophobicContact CB-CD1 4.22Å
266	E	95.3	Very high	93.6	Very high	30 Å²	30	25.3 Å²	25.3	14%	0.14	15%	0.145	C	C	.	.	H	α-helix	trans	-63.3	-38.9	180	-71.9	-54.9	125.9	0	0	112.4	V211 G262 L263 L268 K269 A270	V211-E266 HydrophobicContact CB-CB 4.39Å; V211-E266 HydrophobicContact CG1-CB 4.31Å; V211-E266 VanDerWaalsContact CG1-O 3.22Å; V211-E266 WeakPolarHBondContact CG1-O 3.49Å; G262-E266 PolarHBondContact O-N 2.86Å; L263-E266 PolarHBondContact O-N 2.72Å; E266-L268 VanDerWaalsContact C-N 3.34Å; E266-L268 PolarHBondContact O-N 3.07Å; E266-K269 PolarHBondContact O-N 2.79Å; E266-K269 IonicContact OE1-NZ 3.96Å; E266-K269 PolarHBondContact OE1-NZ 3.45Å; E266-A270 PolarHBondContact O-N 3.22Å
267	V	97.4	Very high	94	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.1	-43.8	173.2	172.5	0	0	0	0	111.2	F196 V211 F247 A250 L251 L263 K264 M265 A270 V271	F196-V267 HydrophobicContact CE2-CG2 3.73Å; F196-V267 HydrophobicContact CZ-CG2 3.81Å; V211-V267 HydrophobicContact CG2-CG2 4.02Å; F247-V267 HydrophobicContact CB-CG1 3.55Å; F247-V267 HydrophobicContact CD1-CG1 3.89Å; F247-V267 HydrophobicContact CD1-CG2 4.27Å; F247-V267 HydrophobicContact CG-CG1 3.93Å; F247-V267 WeakPolarHBondContact O-CG1 3.36Å; A250-V267 HydrophobicContact CB-CG2 4.32Å; L251-V267 HydrophobicContact CD1-CG1 4.21Å; L251-V267 HydrophobicContact CD2-CB 4.2Å; L251-V267 HydrophobicContact CD2-CG1 3.94Å; L251-V267 HydrophobicContact CG-CG1 3.71Å; L263-V267 HydrophobicContact CD1-CG2 4.28Å; L263-V267 HydrophobicContact CG-CG2 4.42Å; L263-V267 VanDerWaalsContact O-CG2 3.28Å; L263-V267 WeakPolarHBondContact O-CG2 3.47Å; L263-V267 PolarHBondContact O-N 3Å; K264-V267 PolarHBondContact O-N 3.28Å; M265-V267 VanDerWaalsContact C-N 3.32Å; M265-V267 PolarHBondContact O-N 3.01Å; V267-A270 PolarHBondContact O-N 2.87Å; V267-V271 WeakPolarHBondContact O-CG2 3.33Å; V267-V271 PolarHBondContact O-N 3.22Å
268	L	96.7	Very high	94.3	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-67	-44.3	179.8	-171.5	54.4	0	0	0	111.3	L251 K264 M265 E266 A270 V271 T272 V293 I335 F338	L251-L268 HydrophobicContact CD1-CD1 4.48Å; L251-L268 HydrophobicContact CD2-CB 4.42Å; K264-L268 WeakPolarHBondContact O-CB 3.46Å; K264-L268 PolarHBondContact O-N 3.04Å; M265-L268 PolarHBondContact O-N 3.26Å; M265-L268 VanDerWaalsContact O-N 3.14Å; E266-L268 VanDerWaalsContact C-N 3.34Å; E266-L268 PolarHBondContact O-N 3.07Å; L268-A270 VanDerWaalsContact C-N 3.29Å; L268-A270 PolarHBondContact O-N 3.39Å; L268-V271 CarbonylContact O-C 3.57Å; L268-V271 PolarHBondContact O-N 2.96Å; L268-V271 VanDerWaalsContact O-N 3.1Å; L268-T272 PolarHBondContact O-N 3Å; L268-T272 PolarHBondContact O-OG1 2.91Å; L268-V293 HydrophobicContact CD1-CG1 4.05Å; L268-V293 HydrophobicContact CD1-CG2 3.8Å; L268-I335 HydrophobicContact CD2-CB 4.16Å; L268-I335 HydrophobicContact CD2-CG1 3.44Å; L268-I335 VanDerWaalsContact CD2-CG1 3.44Å; L268-F338 HydrophobicContact CD1-CB 4.19Å; L268-F338 HydrophobicContact CD1-CD2 4.16Å; L268-F338 HydrophobicContact CD1-CG 4.1Å; L268-F338 HydrophobicContact CG-CB 4.42Å
269	K	96.6	Very high	94.4	Very high	72 Å²	72	18.8 Å²	18.8	31%	0.313	9%	0.093	S	C	.	.	H	α-helix	trans	-56	-41.7	172.8	-72.5	177.7	-176.6	169.3	0	112.4	M265 E266 T272 A273	M265-K269 HydrophobicContact CG-CD 4.35Å; M265-K269 WeakPolarHBondContact O-CG 3.42Å; M265-K269 PolarHBondContact O-N 3Å; M265-K269 PolarHBondContact SD-NZ 3.47Å; E266-K269 PolarHBondContact O-N 2.79Å; E266-K269 IonicContact OE1-NZ 3.96Å; E266-K269 PolarHBondContact OE1-NZ 3.45Å; K269-T272 WeakPolarHBondContact O-CB 3.43Å; K269-T272 PolarHBondContact O-N 3.24Å; K269-A273 WeakPolarHBondContact O-CB 3.33Å; K269-A273 PolarHBondContact O-N 3.43Å
270	A	97.8	Very high	94.4	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-63.5	-43	175.6	0	0	0	0	0	112.2	V211 F214 T215 F247 E266 V267 L268 A273 L274	V211-A270 HydrophobicContact CG1-CB 3.48Å; V211-A270 VanDerWaalsContact CG1-CB 3.48Å; F214-A270 HydrophobicContact CD1-CB 4.25Å; T215-A270 WeakPolarHBondContact OG1-CA 3.28Å; T215-A270 VanDerWaalsContact OG1-CB 3.24Å; T215-A270 WeakPolarHBondContact OG1-CB 3.46Å; F247-A270 HydrophobicContact CD2-CB 4.5Å; F247-A270 HydrophobicContact CE2-CB 3.88Å; F247-A270 HydrophobicContact CZ-CB 3.91Å; E266-A270 PolarHBondContact O-N 3.22Å; V267-A270 PolarHBondContact O-N 2.87Å; L268-A270 VanDerWaalsContact C-N 3.29Å; L268-A270 PolarHBondContact O-N 3.39Å; A270-A273 PolarHBondContact O-N 3.23Å; A270-L274 WeakPolarHBondContact O-CG 3.29Å; A270-L274 PolarHBondContact O-N 2.93Å
271	V	97.6	Very high	94.3	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63.2	-44	174.7	174.7	0	0	0	0	110.6	F247 V267 L268 A273 L274 V275 I289 F338	F247-V271 HydrophobicContact CB-CG2 3.86Å; F247-V271 HydrophobicContact CD2-CG2 3.93Å; F247-V271 HydrophobicContact CG-CG2 4.23Å; V267-V271 WeakPolarHBondContact O-CG2 3.33Å; V267-V271 PolarHBondContact O-N 3.22Å; L268-V271 CarbonylContact O-C 3.57Å; L268-V271 PolarHBondContact O-N 2.96Å; L268-V271 VanDerWaalsContact O-N 3.1Å; V271-A273 PolarHBondContact O-N 2.74Å; V271-L274 PolarHBondContact O-N 3.1Å; V271-V275 HydrophobicContact CG1-CG2 4.44Å; V271-V275 WeakPolarHBondContact O-CG2 3.48Å; V271-V275 PolarHBondContact O-N 2.93Å; V271-I289 HydrophobicContact CG1-CD1 4.23Å; V271-I289 HydrophobicContact CG1-CG2 3.9Å; V271-F338 HydrophobicContact CG1-CE2 3.94Å
272	T	97.3	Very high	94.5	Very high	4 Å²	4	26.1 Å²	26.1	3%	0.025	13%	0.127	C	C	.	.	H	α-helix	trans	-57.3	-48.7	175.3	-57.2	0	0	0	0	111.2	L268 K269 L274 V275 K276 E337 F338 T341	L268-T272 PolarHBondContact O-N 3Å; L268-T272 PolarHBondContact O-OG1 2.91Å; K269-T272 WeakPolarHBondContact O-CB 3.43Å; K269-T272 PolarHBondContact O-N 3.24Å; T272-L274 VanDerWaalsContact C-N 3.32Å; T272-L274 PolarHBondContact O-N 3.46Å; T272-V275 PolarHBondContact O-N 3.32Å; T272-V275 VanDerWaalsContact O-N 3.14Å; T272-K276 WeakPolarHBondContact O-CB 3.39Å; T272-K276 PolarHBondContact O-N 3.01Å; T272-E337 HydrophobicContact CG2-CG 4.32Å; T272-F338 WeakPolarHBondContact OG1-CD2 3.37Å; T272-T341 HydrophobicContact CG2-CG2 4.11Å; T272-T341 WeakPolarHBondContact CG2-OG1 3.46Å
273	A	96.9	Very high	94.6	Very high	12 Å²	12	29.4 Å²	29.4	10%	0.099	15%	0.147	C	C	.	.	H	α-helix	trans	-59.5	-41	176.6	0	0	0	0	0	112.1	T215 K269 A270 V271 K276 N277	T215-A273 HydrophobicContact CG2-CB 3.94Å; K269-A273 WeakPolarHBondContact O-CB 3.33Å; K269-A273 PolarHBondContact O-N 3.43Å; A270-A273 PolarHBondContact O-N 3.23Å; V271-A273 PolarHBondContact O-N 2.74Å; A273-K276 PolarHBondContact O-N 3.28Å; A273-N277 WeakPolarHBondContact O-CB 3.28Å; A273-N277 PolarHBondContact O-N 3.33Å; A273-N277 PolarHBondContact O-ND2 3.43Å
274	L	96.1	Very high	94.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65.6	-39.5	175.1	-70.4	176.7	0	0	0	112.8	F214 A218 I236 V240 F247 A270 V271 T272 F278 M282	F214-L274 HydrophobicContact CE1-CD1 3.86Å; F214-L274 HydrophobicContact CE1-CD2 3.95Å; F214-L274 HydrophobicContact CE1-CG 3.97Å; F214-L274 HydrophobicContact CZ-CD1 3.89Å; F214-L274 HydrophobicContact CZ-CD2 3.87Å; F214-L274 HydrophobicContact CZ-CG 4.23Å; A218-L274 HydrophobicContact CB-CD2 4.46Å; I236-L274 HydrophobicContact CD1-CD2 4.46Å; V240-L274 HydrophobicContact CG1-CD1 4.44Å; V240-L274 HydrophobicContact CG2-CD2 4.34Å; F247-L274 HydrophobicContact CE2-CD1 4.24Å; A270-L274 WeakPolarHBondContact O-CG 3.29Å; A270-L274 PolarHBondContact O-N 2.93Å; V271-L274 PolarHBondContact O-N 3.1Å; T272-L274 VanDerWaalsContact C-N 3.32Å; T272-L274 PolarHBondContact O-N 3.46Å; L274-F278 HydrophobicContact CD2-CD2 3.85Å; L274-F278 HydrophobicContact CD2-CE2 4.39Å; L274-F278 CarbonylContact O-C 3.59Å; L274-F278 VanDerWaalsContact O-CA 3.27Å; L274-F278 WeakPolarHBondContact O-CA 3.22Å; L274-F278 WeakPolarHBondContact O-CB 3.26Å; L274-F278 PolarHBondContact O-N 2.67Å; L274-M282 HydrophobicContact CB-CE 4.01Å; L274-M282 HydrophobicContact CB-CG 4.14Å; L274-M282 HydrophobicContact CB-SD 3.96Å; L274-M282 HydrophobicContact CD1-CE 4.33Å; L274-M282 HydrophobicContact CD1-SD 4.24Å
275	V	95.6	Very high	94.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-66.9	-41	177.5	171.7	0	0	0	0	110.9	V271 T272 P279 M282 M286 F338 T341 L342 F348	V271-V275 HydrophobicContact CG1-CG2 4.44Å; V271-V275 WeakPolarHBondContact O-CG2 3.48Å; V271-V275 PolarHBondContact O-N 2.93Å; T272-V275 PolarHBondContact O-N 3.32Å; T272-V275 VanDerWaalsContact O-N 3.14Å; V275-P279 WeakPolarHBondContact O-CA 3.31Å; V275-P279 WeakPolarHBondContact O-CB 3.47Å; V275-M282 HydrophobicContact CG2-CE 4.24Å; V275-M286 HydrophobicContact CG2-SD 3.98Å; V275-F338 HydrophobicContact CG2-CE2 4.18Å; V275-T341 HydrophobicContact CB-CG2 4.3Å; V275-T341 HydrophobicContact CG1-CG2 3.94Å; V275-L342 HydrophobicContact CG1-CD2 3.92Å; V275-F348 HydrophobicContact CG1-CD2 3.73Å; V275-F348 HydrophobicContact CG1-CE2 3.76Å
276	K	94.8	Very high	94.3	Very high	128 Å²	128	33.4 Å²	33.4	56%	0.557	18%	0.177	S	C	*	.	H	α-helix	trans	-66.5	-54	177.4	-173.7	171.9	-179.5	167	0	111.8	T272 A273 T341	T272-K276 WeakPolarHBondContact O-CB 3.39Å; T272-K276 PolarHBondContact O-N 3.01Å; A273-K276 PolarHBondContact O-N 3.28Å; K276-T341 HydrophobicContact CB-CG2 3.8Å
277	N	94.4	Very high	94.1	Very high	38 Å²	38	40.3 Å²	40.3	20%	0.203	21%	0.21	C	C	.	.	H	α-helix	trans	-84	-32.6	-169.8	-63.2	-8.2	0	0	0	112.9	N219 C222 A273 P279	N219-N277 PolarHBondContact OD1-ND2 3.22Å; C222-N277 HydrophobicContact CB-CB 3.85Å; C222-N277 VanDerWaalsContact SG-CB 3.53Å; A273-N277 WeakPolarHBondContact O-CB 3.28Å; A273-N277 PolarHBondContact O-N 3.33Å; A273-N277 PolarHBondContact O-ND2 3.43Å; N277-P279 VanDerWaalsContact C-CD 3.45Å
278	F	93	Very high	93.9	Very high	10 Å²	10	44.3 Å²	44.3	4%	0.044	23%	0.228	C	C	.	.			trans	-131.7	58.9	-174.8	-51	-67	0	0	0	112.1	A218 I221 C222 A232 I236 F237 L274 K280 P281 M282	A218-F278 HydrophobicContact CB-CE2 4.24Å; A218-F278 WeakPolarHBondContact O-CZ 3.26Å; I221-F278 HydrophobicContact CG2-CZ 4.3Å; C222-F278 HydrophobicContact CB-CE1 4.12Å; C222-F278 HydrophobicContact CB-CE2 4.44Å; C222-F278 HydrophobicContact CB-CZ 3.74Å; A232-F278 HydrophobicContact CB-CD1 4.36Å; A232-F278 HydrophobicContact CB-CE1 3.77Å; I236-F278 HydrophobicContact CD1-CE2 4.22Å; I236-F278 HydrophobicContact CG2-CE2 4.28Å; I236-F278 HydrophobicContact CG2-CZ 4.11Å; F237-F278 HydrophobicContact CE1-CB 4.28Å; F237-F278 AromaticContact CE1-CD1 3.72Å; F237-F278 HydrophobicContact CE1-CD1 3.72Å; F237-F278 HydrophobicContact CE1-CE1 4.29Å; F237-F278 HydrophobicContact CE1-CG 4.06Å; F237-F278 HydrophobicContact CZ-CD1 4.21Å; L274-F278 HydrophobicContact CD2-CD2 3.85Å; L274-F278 HydrophobicContact CD2-CE2 4.39Å; L274-F278 CarbonylContact O-C 3.59Å; L274-F278 VanDerWaalsContact O-CA 3.27Å; L274-F278 WeakPolarHBondContact O-CA 3.22Å; L274-F278 WeakPolarHBondContact O-CB 3.26Å; L274-F278 PolarHBondContact O-N 2.67Å; F278-K280 VanDerWaalsContact C-N 3.34Å; F278-K280 PolarHBondContact O-N 2.75Å; F278-P281 HydrophobicContact CB-CG 4.32Å; F278-P281 VanDerWaalsContact O-CD 3.29Å; F278-P281 WeakPolarHBondContact O-CD 3.37Å; F278-M282 VanDerWaalsContact O-CG 3.3Å; F278-M282 WeakPolarHBondContact O-CG 3.45Å; F278-M282 PolarHBondContact O-N 3.11Å
279	P	92.4	Very high	93.9	Very high	29 Å²	29	44.3 Å²	44.3	19%	0.188	23%	0.228	C	C	.	.	H	α-helix	trans	-64	-36.5	-174.3	23.8	-33.8	0	0	0	113	V275 N277 M282 V283 N345 F348	V275-P279 WeakPolarHBondContact O-CA 3.31Å; V275-P279 WeakPolarHBondContact O-CB 3.47Å; N277-P279 VanDerWaalsContact C-CD 3.45Å; P279-M282 PolarHBondContact O-N 2.82Å; P279-V283 WeakPolarHBondContact O-CG2 3.3Å; P279-V283 PolarHBondContact O-N 2.98Å; P279-N345 WeakPolarHBondContact CB-ND2 3.18Å; P279-F348 HydrophobicContact CB-CE2 3.84Å; P279-F348 HydrophobicContact CB-CZ 4.32Å
280	K	90.1	Very high	93.8	Very high	141 Å²	141	43 Å²	43	61%	0.613	23%	0.225	S	C	*	.	H	α-helix	trans	-60.8	-52.1	-176.3	-66.3	176.5	-173.9	174.7	0	112	F278 M282 V283	F278-K280 VanDerWaalsContact C-N 3.34Å; F278-K280 PolarHBondContact O-N 2.75Å; K280-M282 VanDerWaalsContact C-N 3.31Å; K280-M282 PolarHBondContact O-N 3.15Å; K280-V283 WeakPolarHBondContact O-CG2 3.48Å
281	P	88.8	Confident	93.7	Very high	45 Å²	45	46.2 Å²	46.2	29%	0.292	25%	0.246	S	C	.	.	H	α-helix	trans	-59.4	-36.6	172.8	-25.8	31.5	0	0	0	114.7	F237 F278 V283 S284	F237-P281 HydrophobicContact CD1-CG 4.18Å; F237-P281 HydrophobicContact CD2-CG 4.45Å; F237-P281 HydrophobicContact CE1-CG 3.64Å; F237-P281 HydrophobicContact CE2-CG 3.94Å; F237-P281 HydrophobicContact CZ-CG 3.52Å; F278-P281 HydrophobicContact CB-CG 4.32Å; F278-P281 VanDerWaalsContact O-CD 3.29Å; F278-P281 WeakPolarHBondContact O-CD 3.37Å; P281-V283 VanDerWaalsContact C-N 3.3Å; P281-V283 PolarHBondContact O-N 3.45Å; P281-S284 PolarHBondContact O-OG 3.08Å
282	M	93.1	Very high	93.6	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-72.5	-19.3	-172.6	-68.2	-60.5	-73	0	0	114	V240 T244 L274 V275 F278 P279 K280 S284 S285 M286 I289	V240-M282 HydrophobicContact CG1-SD 3.93Å; T244-M282 HydrophobicContact CG2-CE 3.83Å; T244-M282 HydrophobicContact CG2-SD 4.43Å; L274-M282 HydrophobicContact CB-CE 4.01Å; L274-M282 HydrophobicContact CB-CG 4.14Å; L274-M282 HydrophobicContact CB-SD 3.96Å; L274-M282 HydrophobicContact CD1-CE 4.33Å; L274-M282 HydrophobicContact CD1-SD 4.24Å; V275-M282 HydrophobicContact CG2-CE 4.24Å; F278-M282 VanDerWaalsContact O-CG 3.3Å; F278-M282 WeakPolarHBondContact O-CG 3.45Å; F278-M282 PolarHBondContact O-N 3.11Å; P279-M282 PolarHBondContact O-N 2.82Å; K280-M282 VanDerWaalsContact C-N 3.31Å; K280-M282 PolarHBondContact O-N 3.15Å; M282-S284 PolarHBondContact O-N 3.44Å; M282-S284 VanDerWaalsContact O-N 3.1Å; M282-S285 PolarHBondContact O-N 3.3Å; M282-M286 WeakPolarHBondContact O-CG 3.26Å; M282-M286 PolarHBondContact O-N 3.41Å; M282-M286 VanDerWaalsContact O-N 3.08Å; M282-I289 HydrophobicContact CE-CD1 3.49Å; M282-I289 VanDerWaalsContact CE-CD1 3.49Å
283	V	92.3	Very high	93.5	Very high	72 Å²	72	46.8 Å²	46.8	44%	0.436	25%	0.248	S	C	.	.	H	α-helix	trans	-48.2	-42.7	179	177.2	0	0	0	0	112.5	P279 K280 P281 S285 M286 F348	P279-V283 WeakPolarHBondContact O-CG2 3.3Å; P279-V283 PolarHBondContact O-N 2.98Å; K280-V283 WeakPolarHBondContact O-CG2 3.48Å; P281-V283 VanDerWaalsContact C-N 3.3Å; P281-V283 PolarHBondContact O-N 3.45Å; V283-S285 VanDerWaalsContact C-N 3.29Å; V283-S285 PolarHBondContact O-N 3.48Å; V283-M286 PolarHBondContact O-N 3.32Å; V283-F348 HydrophobicContact CG2-CE1 4.04Å; V283-F348 HydrophobicContact CG2-CZ 4.06Å
284	S	88.9	Confident	93.5	Very high	96 Å²	96	49.6 Å²	49.6	67%	0.671	26%	0.257	S	S	*	.	H	α-helix	trans	-66.1	-30.2	-178.4	65.2	0	0	0	0	113.5	P281 M282	P281-S284 PolarHBondContact O-OG 3.08Å; M282-S284 PolarHBondContact O-N 3.44Å; M282-S284 VanDerWaalsContact O-N 3.1Å
285	S	93	Very high	93.4	Very high	13 Å²	13	53.5 Å²	53.5	9%	0.091	28%	0.278	C	S	.	.	H	α-helix	trans	-93.1	-15.7	-178.3	-54.9	0	0	0	0	113.3	M282 V283 Q287 Q288 I289	M282-S285 PolarHBondContact O-N 3.3Å; V283-S285 VanDerWaalsContact C-N 3.29Å; V283-S285 PolarHBondContact O-N 3.48Å; S285-Q287 PolarHBondContact O-N 3.12Å; S285-Q288 WeakPolarHBondContact O-CB 3.27Å; S285-Q288 PolarHBondContact O-N 3.41Å; S285-I289 WeakPolarHBondContact O-CG1 3.33Å; S285-I289 PolarHBondContact O-N 2.9Å
286	M	92.4	Very high	93.3	Very high	10 Å²	10	54 Å²	54	5%	0.049	28%	0.281	C	S	.	.	H	α-helix	trans	-58.6	-33.9	-176.7	-74.4	-51	-69.5	0	0	113.8	V275 M282 V283 Q288 I289 L290 F338 L342 F348	V275-M286 HydrophobicContact CG2-SD 3.98Å; M282-M286 WeakPolarHBondContact O-CG 3.26Å; M282-M286 PolarHBondContact O-N 3.41Å; M282-M286 VanDerWaalsContact O-N 3.08Å; V283-M286 PolarHBondContact O-N 3.32Å; M286-Q288 PolarHBondContact O-N 2.91Å; M286-I289 PolarHBondContact O-N 3.46Å; M286-I289 HydrophobicContact SD-CD1 4.01Å; M286-L290 HydrophobicContact CE-CD1 4.17Å; M286-L290 HydrophobicContact CE-CD2 3.67Å; M286-L290 HydrophobicContact CE-CG 3.79Å; M286-L290 WeakPolarHBondContact O-CG 3.46Å; M286-L290 PolarHBondContact O-N 3.18Å; M286-F338 HydrophobicContact CE-CZ 4.4Å; M286-L342 HydrophobicContact CE-CD2 3.46Å; M286-L342 VanDerWaalsContact CE-CD2 3.46Å; M286-F348 HydrophobicContact CE-CD1 4.37Å; M286-F348 HydrophobicContact CE-CG 4.42Å; M286-F348 HydrophobicContact CG-CD1 4.01Å; M286-F348 HydrophobicContact CG-CE1 3.51Å; M286-F348 HydrophobicContact CG-CZ 3.87Å; M286-F348 HydrophobicContact SD-CE1 4.48Å; M286-F348 HydrophobicContact SD-CZ 4.47Å
287	Q	91	Very high	93.3	Very high	175 Å²	175	48.2 Å²	48.2	82%	0.818	26%	0.256	S	S	*	.	H	α-helix	trans	-61.6	-27	176.2	-65.8	-175.4	3.9	0	0	112.7	S285 P291	S285-Q287 PolarHBondContact O-N 3.12Å; Q287-P291 VanDerWaalsContact O-CD 3.26Å; Q287-P291 WeakPolarHBondContact O-CD 3.24Å; Q287-P291 WeakPolarHBondContact O-CG 3.32Å
288	Q	93.5	Very high	93.3	Very high	84 Å²	84	47.4 Å²	47.4	39%	0.393	25%	0.252	S	S	.	.	H	α-helix	trans	-90.5	-39.2	176.5	-164.1	-170.9	-13.2	0	0	111.9	V248 S285 M286 P291 I292	V248-Q288 HydrophobicContact CG1-CG 3.92Å; S285-Q288 WeakPolarHBondContact O-CB 3.27Å; S285-Q288 PolarHBondContact O-N 3.41Å; M286-Q288 PolarHBondContact O-N 2.91Å; Q288-P291 WeakPolarHBondContact O-CD 3.11Å; Q288-I292 HydrophobicContact CG-CD1 4.28Å; Q288-I292 WeakPolarHBondContact O-CD1 3.39Å
289	I	95.6	Very high	93.3	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-65.9	-49.2	-176.8	-64.7	162.6	0	0	0	111.1	T244 V248 V271 M282 S285 M286 I292 V293 F338	T244-I289 HydrophobicContact CG2-CD1 3.87Å; T244-I289 HydrophobicContact CG2-CG1 4.32Å; V248-I289 HydrophobicContact CG2-CG1 3.67Å; V271-I289 HydrophobicContact CG1-CD1 4.23Å; V271-I289 HydrophobicContact CG1-CG2 3.9Å; M282-I289 HydrophobicContact CE-CD1 3.49Å; M282-I289 VanDerWaalsContact CE-CD1 3.49Å; S285-I289 WeakPolarHBondContact O-CG1 3.33Å; S285-I289 PolarHBondContact O-N 2.9Å; M286-I289 PolarHBondContact O-N 3.46Å; M286-I289 HydrophobicContact SD-CD1 4.01Å; I289-I292 PolarHBondContact O-N 2.96Å; I289-V293 HydrophobicContact CG2-CG2 3.84Å; I289-V293 PolarHBondContact O-N 2.99Å; I289-F338 HydrophobicContact CG2-CE2 4.22Å; I289-F338 HydrophobicContact CG2-CZ 3.75Å
290	L	94.8	Very high	93.4	Very high	44 Å²	44	52.3 Å²	52.3	23%	0.23	27%	0.274	C	S	.	.	H	α-helix	trans	-58.1	-48.8	-171	-68	170.5	0	0	0	113.6	M286 I292 W294 F338 L342 T351	M286-L290 HydrophobicContact CE-CD1 4.17Å; M286-L290 HydrophobicContact CE-CD2 3.67Å; M286-L290 HydrophobicContact CE-CG 3.79Å; M286-L290 WeakPolarHBondContact O-CG 3.46Å; M286-L290 PolarHBondContact O-N 3.18Å; L290-I292 PolarHBondContact O-N 2.76Å; L290-W294 WeakPolarHBondContact O-CB 3.09Å; L290-W294 PolarHBondContact O-N 2.92Å; L290-F338 HydrophobicContact CD2-CE1 4.24Å; L290-F338 HydrophobicContact CD2-CZ 4.38Å; L290-L342 HydrophobicContact CD2-CD1 3.56Å; L290-T351 HydrophobicContact CD1-CG2 3.83Å
291	P	95.8	Very high	93.6	Very high	68 Å²	68	45.6 Å²	45.6	44%	0.442	24%	0.244	S	C	.	.	H	α-helix	trans	-61.7	-28.8	178.3	-23.6	35	0	0	0	113.6	Q287 Q288 N295	Q287-P291 VanDerWaalsContact O-CD 3.26Å; Q287-P291 WeakPolarHBondContact O-CD 3.24Å; Q287-P291 WeakPolarHBondContact O-CG 3.32Å; Q288-P291 WeakPolarHBondContact O-CD 3.11Å; P291-N295 PolarHBondContact O-N 2.81Å; P291-N295 PolarHBondContact O-ND2 3.13Å; P291-N295 PolarHBondContact O-OD1 3.22Å
292	I	95.9	Very high	93.7	Very high	11 Å²	11	45.7 Å²	45.7	6%	0.056	25%	0.249	C	C	.	.	H	α-helix	trans	-81.6	-46.7	-175.3	-70.4	166.6	0	0	0	110.2	V248 L251 Q252 Q288 I289 L290 W294 N295 T296	V248-I292 HydrophobicContact CB-CD1 4.5Å; V248-I292 HydrophobicContact CG1-CD1 3.06Å; V248-I292 HydrophobicContact CG1-CG1 4.32Å; V248-I292 HydrophobicContact CG1-CG2 4.5Å; L251-I292 HydrophobicContact CB-CG2 3.81Å; Q252-I292 HydrophobicContact CG-CD1 3.98Å; Q252-I292 HydrophobicContact CG-CG1 4.04Å; Q252-I292 HydrophobicContact CG-CG2 3.74Å; Q288-I292 HydrophobicContact CG-CD1 4.28Å; Q288-I292 WeakPolarHBondContact O-CD1 3.39Å; I289-I292 PolarHBondContact O-N 2.96Å; L290-I292 PolarHBondContact O-N 2.76Å; I292-W294 PolarHBondContact O-N 3.49Å; I292-N295 PolarHBondContact O-N 3.46Å; I292-N295 VanDerWaalsContact O-N 3.15Å; I292-T296 PolarHBondContact O-N 2.66Å; I292-T296 PolarHBondContact O-OG1 2.64Å; I292-T296 VanDerWaalsContact O-OG1 3.1Å
293	V	95.6	Very high	93.6	Very high	5 Å²	5	48 Å²	48	3%	0.03	26%	0.259	C	S	.	.	H	α-helix	trans	-62.7	-35	172.6	-178.5	0	0	0	0	110.7	L251 L268 I289 T296 L297 F338	L251-V293 HydrophobicContact CD1-CG2 4.26Å; L268-V293 HydrophobicContact CD1-CG1 4.05Å; L268-V293 HydrophobicContact CD1-CG2 3.8Å; I289-V293 HydrophobicContact CG2-CG2 3.84Å; I289-V293 PolarHBondContact O-N 2.99Å; V293-T296 WeakPolarHBondContact O-CB 3.37Å; V293-T296 PolarHBondContact O-N 3.14Å; V293-L297 WeakPolarHBondContact O-CB 3.46Å; V293-L297 PolarHBondContact O-N 3.27Å; V293-F338 HydrophobicContact CB-CD1 4.32Å; V293-F338 HydrophobicContact CB-CE1 4.01Å; V293-F338 HydrophobicContact CG1-CD1 3.59Å; V293-F338 HydrophobicContact CG1-CE1 3.79Å; V293-F338 HydrophobicContact CG1-CG 4.33Å; V293-F338 HydrophobicContact CG2-CD1 4.46Å; V293-F338 HydrophobicContact CG2-CE1 4.05Å; V293-F338 HydrophobicContact CG2-CZ 4.23Å
294	W	95.8	Very high	93.7	Very high	72 Å²	72	44.7 Å²	44.7	27%	0.273	24%	0.238	S	C	.	.	H	α-helix	trans	-60.2	-46.3	172.1	-179.6	-97.9	0	0	0	112.6	L290 I292 T296 L297 T298 E358 L359 Y362	L290-W294 WeakPolarHBondContact O-CB 3.09Å; L290-W294 PolarHBondContact O-N 2.92Å; I292-W294 PolarHBondContact O-N 3.49Å; W294-T296 VanDerWaalsContact C-N 3.31Å; W294-T296 PolarHBondContact O-N 2.97Å; W294-L297 HydrophobicContact CZ3-CD2 4.48Å; W294-L297 WeakPolarHBondContact O-CB 3.44Å; W294-L297 PolarHBondContact O-N 3.15Å; W294-T298 HydrophobicContact CD2-CG2 4.31Å; W294-T298 HydrophobicContact CZ2-CG2 3.85Å; W294-T298 WeakPolarHBondContact O-CG2 3.23Å; W294-T298 PolarHBondContact O-N 3.29Å; W294-T298 PolarHBondContact O-OG1 3.17Å; W294-T298 VanDerWaalsContact O-OG1 3.07Å; W294-E358 HydrophobicContact CH2-CB 3.52Å; W294-E358 HydrophobicContact CZ2-CB 3.58Å; W294-E358 HydrophobicContact CZ2-CG 4.48Å; W294-L359 HydrophobicContact CZ3-CB 4.23Å; W294-L359 HydrophobicContact CZ3-CD1 4.36Å; W294-Y362 AromaticContact CH2-CD2 3.99Å; W294-Y362 HydrophobicContact CH2-CD2 3.99Å; W294-Y362 HydrophobicContact CH2-CE2 4.41Å; W294-Y362 HydrophobicContact CZ2-CD2 4.01Å; W294-Y362 AromaticContact CZ2-CE2 3.97Å; W294-Y362 HydrophobicContact CZ2-CE2 3.97Å
295	N	94.8	Very high	93.9	Very high	82 Å²	82	41.4 Å²	41.4	44%	0.439	21%	0.214	S	C	.	.	H	α-helix	trans	-60.8	-43.4	174.5	-69.7	-13.7	0	0	0	111	P291 I292 L297 T298 E299	P291-N295 PolarHBondContact O-N 2.81Å; P291-N295 PolarHBondContact O-ND2 3.13Å; P291-N295 PolarHBondContact O-OD1 3.22Å; I292-N295 PolarHBondContact O-N 3.46Å; I292-N295 VanDerWaalsContact O-N 3.15Å; N295-L297 VanDerWaalsContact C-N 3.35Å; N295-L297 PolarHBondContact O-N 3.33Å; N295-T298 PolarHBondContact O-N 3.35Å; N295-T298 PolarHBondContact O-OG1 2.86Å; N295-T298 VanDerWaalsContact O-OG1 3.07Å; N295-E299 WeakPolarHBondContact O-CB 3.35Å; N295-E299 WeakPolarHBondContact O-CG 3.19Å; N295-E299 PolarHBondContact O-N 3.05Å
296	T	93.4	Very high	93.9	Very high	11 Å²	11	45.2 Å²	45.2	7%	0.067	23%	0.227	C	C	.	.	H	α-helix	trans	-58.9	-44.1	174.6	-51.9	0	0	0	0	111.9	I292 V293 W294 T298 S300 I335	I292-T296 PolarHBondContact O-N 2.66Å; I292-T296 PolarHBondContact O-OG1 2.64Å; I292-T296 VanDerWaalsContact O-OG1 3.1Å; V293-T296 WeakPolarHBondContact O-CB 3.37Å; V293-T296 PolarHBondContact O-N 3.14Å; W294-T296 VanDerWaalsContact C-N 3.31Å; W294-T296 PolarHBondContact O-N 2.97Å; T296-T298 PolarHBondContact O-N 3.08Å; T296-S300 WeakPolarHBondContact O-CB 3.48Å; T296-S300 PolarHBondContact O-N 3Å; T296-S300 PolarHBondContact O-OG 2.95Å; T296-I335 HydrophobicContact CG2-CD1 3.96Å
297	L	95	Very high	93.7	Very high	6 Å²	6	44.9 Å²	44.9	3%	0.031	23%	0.225	C	C	.	.	H	α-helix	trans	-58.7	-47.5	177.1	-176.2	157.4	0	0	0	111.7	V293 W294 N295 A301 I335 L359 Y362 Y366	V293-L297 WeakPolarHBondContact O-CB 3.46Å; V293-L297 PolarHBondContact O-N 3.27Å; W294-L297 HydrophobicContact CZ3-CD2 4.48Å; W294-L297 WeakPolarHBondContact O-CB 3.44Å; W294-L297 PolarHBondContact O-N 3.15Å; N295-L297 VanDerWaalsContact C-N 3.35Å; N295-L297 PolarHBondContact O-N 3.33Å; L297-A301 PolarHBondContact O-N 3.43Å; L297-I335 HydrophobicContact CB-CG2 3.81Å; L297-I335 HydrophobicContact CD1-CG2 3.73Å; L297-I335 HydrophobicContact CG-CG2 3.85Å; L297-L359 HydrophobicContact CD1-CD1 3.93Å; L297-Y362 HydrophobicContact CD2-CD1 4.47Å; L297-Y362 HydrophobicContact CD2-CD2 4.43Å; L297-Y362 HydrophobicContact CD2-CG 3.93Å; L297-Y366 HydrophobicContact CD2-CE2 4.46Å; L297-Y366 PolarHBondContact O-OH 2.98Å
298	T	94.9	Very high	93.7	Very high	20 Å²	20	38.4 Å²	38.4	12%	0.123	20%	0.195	C	C	.	.	H	α-helix	trans	-75.7	-40.7	-175	55.8	0	0	0	0	113.2	W294 N295 T296 S300 A301 A302 Y362	W294-T298 HydrophobicContact CD2-CG2 4.31Å; W294-T298 HydrophobicContact CZ2-CG2 3.85Å; W294-T298 WeakPolarHBondContact O-CG2 3.23Å; W294-T298 PolarHBondContact O-N 3.29Å; W294-T298 PolarHBondContact O-OG1 3.17Å; W294-T298 VanDerWaalsContact O-OG1 3.07Å; N295-T298 PolarHBondContact O-N 3.35Å; N295-T298 PolarHBondContact O-OG1 2.86Å; N295-T298 VanDerWaalsContact O-OG1 3.07Å; T296-T298 PolarHBondContact O-N 3.08Å; T298-S300 VanDerWaalsContact C-N 3.35Å; T298-A301 PolarHBondContact O-N 2.81Å; T298-A302 PolarHBondContact O-N 3.34Å; T298-Y362 HydrophobicContact CG2-CD1 3.99Å; T298-Y362 HydrophobicContact CG2-CD2 3.71Å; T298-Y362 HydrophobicContact CG2-CE1 3.63Å; T298-Y362 HydrophobicContact CG2-CE2 3.36Å; T298-Y362 HydrophobicContact CG2-CG 4.03Å
299	E	93.3	Very high	93.8	Very high	135 Å²	135	34.4 Å²	34.4	63%	0.631	18%	0.176	S	C	*	.	H	α-helix	trans	-64.6	-41.7	173	-72.4	179.1	178.7	0	0	111.2	N295 A301 A302 F303	N295-E299 WeakPolarHBondContact O-CB 3.35Å; N295-E299 WeakPolarHBondContact O-CG 3.19Å; N295-E299 PolarHBondContact O-N 3.05Å; E299-A301 VanDerWaalsContact C-N 3.31Å; E299-A301 PolarHBondContact O-N 2.88Å; E299-A302 PolarHBondContact O-N 2.89Å; E299-F303 PolarHBondContact O-N 3.34Å
300	S	93.1	Very high	93.6	Very high	8 Å²	8	35.5 Å²	35.5	6%	0.056	18%	0.182	C	C	.	.	H	α-helix	trans	-62.6	-37.8	176.1	-63.3	0	0	0	0	111.5	T296 T298 A302 F303 Y304 F328 Y366	T296-S300 WeakPolarHBondContact O-CB 3.48Å; T296-S300 PolarHBondContact O-N 3Å; T296-S300 PolarHBondContact O-OG 2.95Å; T298-S300 VanDerWaalsContact C-N 3.35Å; S300-A302 PolarHBondContact O-N 3.48Å; S300-F303 PolarHBondContact O-N 3.34Å; S300-Y304 VanDerWaalsContact O-CB 3.24Å; S300-Y304 WeakPolarHBondContact O-CB 3.33Å; S300-Y304 PolarHBondContact O-N 2.88Å; S300-F328 WeakPolarHBondContact O-CZ 3.2Å; S300-Y366 VanDerWaalsContact C-OH 3.24Å; S300-Y366 WeakPolarHBondContact CB-OH 3.37Å
301	A	94.7	Very high	93.2	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.4	-43.8	178.5	0	0	0	0	0	111	L297 T298 E299 F303 V305 Y362 L365 Y366	L297-A301 PolarHBondContact O-N 3.43Å; T298-A301 PolarHBondContact O-N 2.81Å; E299-A301 VanDerWaalsContact C-N 3.31Å; E299-A301 PolarHBondContact O-N 2.88Å; A301-F303 VanDerWaalsContact C-N 3.33Å; A301-F303 PolarHBondContact O-N 3.48Å; A301-V305 WeakPolarHBondContact O-CB 3.4Å; A301-V305 VanDerWaalsContact O-CG2 3.23Å; A301-V305 WeakPolarHBondContact O-CG2 3.42Å; A301-V305 PolarHBondContact O-N 3.05Å; A301-Y362 HydrophobicContact CB-CD1 3.7Å; A301-Y362 HydrophobicContact CB-CE1 4.35Å; A301-L365 HydrophobicContact CB-CD1 4.42Å; A301-Y366 VanDerWaalsContact CA-CZ 3.46Å; A301-Y366 WeakPolarHBondContact CA-OH 3.45Å; A301-Y366 HydrophobicContact CB-CD2 4.36Å; A301-Y366 HydrophobicContact CB-CE1 4.23Å; A301-Y366 HydrophobicContact CB-CE2 3.64Å; A301-Y366 PolarHBondContact N-OH 3.14Å
302	A	91.6	Very high	92.2	Very high	46 Å²	46	39.9 Å²	39.9	38%	0.38	20%	0.198	S	C	.	.	H	α-helix	trans	-65.2	-37.6	177.4	0	0	0	0	0	112.1	T298 E299 S300 R306	T298-A302 PolarHBondContact O-N 3.34Å; E299-A302 PolarHBondContact O-N 2.89Å; S300-A302 PolarHBondContact O-N 3.48Å; A302-R306 WeakPolarHBondContact O-CG 3.41Å; A302-R306 PolarHBondContact O-N 3.5Å; A302-R306 PolarHBondContact O-NH1 3.25Å
303	F	91.3	Very high	91.3	Very high	48 Å²	48	43.6 Å²	43.6	21%	0.211	22%	0.215	C	C	.	.	H	α-helix	trans	-68	-51.6	175.8	-175	-95.5	0	0	0	111.5	E299 S300 A301 V305 R306 T307 V315 F328	E299-F303 PolarHBondContact O-N 3.34Å; S300-F303 PolarHBondContact O-N 3.34Å; A301-F303 VanDerWaalsContact C-N 3.33Å; A301-F303 PolarHBondContact O-N 3.48Å; F303-V305 VanDerWaalsContact C-N 3.26Å; F303-V305 PolarHBondContact O-N 3.45Å; F303-R306 WeakPolarHBondContact O-CA 3.3Å; F303-R306 PolarHBondContact O-N 3.23Å; F303-T307 HydrophobicContact CD1-CG2 4.16Å; F303-T307 HydrophobicContact CD2-CG2 4.2Å; F303-T307 HydrophobicContact CE1-CG2 3.79Å; F303-T307 HydrophobicContact CE2-CG2 3.82Å; F303-T307 HydrophobicContact CG-CG2 4.37Å; F303-T307 HydrophobicContact CZ-CG2 3.62Å; F303-T307 PolarHBondContact O-N 2.97Å; F303-T307 PolarHBondContact O-OG1 3.49Å; F303-V315 HydrophobicContact CE2-CG2 4.31Å; F303-V315 HydrophobicContact CZ-CB 4.48Å; F303-V315 HydrophobicContact CZ-CG1 4.28Å; F303-V315 HydrophobicContact CZ-CG2 3.99Å; F303-F328 HydrophobicContact CB-CE2 4.48Å; F303-F328 HydrophobicContact CB-CZ 4.18Å; F303-F328 AromaticContact CD1-CD1 3.88Å; F303-F328 HydrophobicContact CD1-CD1 3.88Å; F303-F328 AromaticContact CD1-CD2 3.7Å; F303-F328 HydrophobicContact CD1-CD2 3.7Å; F303-F328 AromaticContact CD1-CE1 3.74Å; F303-F328 HydrophobicContact CD1-CE1 3.74Å; F303-F328 AromaticContact CD1-CE2 3.53Å; F303-F328 HydrophobicContact CD1-CE2 3.53Å; F303-F328 AromaticContact CD1-CG 3.87Å; F303-F328 HydrophobicContact CD1-CG 3.87Å; F303-F328 AromaticContact CD1-CZ 3.55Å; F303-F328 HydrophobicContact CD1-CZ 3.55Å; F303-F328 HydrophobicContact CE1-CB 4.33Å; F303-F328 HydrophobicContact CE1-CD1 4.1Å; F303-F328 AromaticContact CE1-CD2 3.79Å; F303-F328 HydrophobicContact CE1-CD2 3.79Å; F303-F328 HydrophobicContact CE1-CE1 4.42Å; F303-F328 HydrophobicContact CE1-CE2 4.11Å; F303-F328 AromaticContact CE1-CG 3.79Å; F303-F328 HydrophobicContact CE1-CG 3.79Å; F303-F328 HydrophobicContact CE1-CZ 4.41Å; F303-F328 HydrophobicContact CG-CE2 4.32Å; F303-F328 HydrophobicContact CG-CZ 4.31Å
304	Y	92.9	Very high	90.1	Very high	3 Å²	3	52.8 Å²	52.8	1%	0.012	26%	0.257	C	S	.	.	H	α-helix	trans	-50.4	-45.2	175.6	-175.6	-111.8	0	0	0	112.2	S300 R306 E308 V309 F328 Y366 T370 V397	S300-Y304 VanDerWaalsContact O-CB 3.24Å; S300-Y304 WeakPolarHBondContact O-CB 3.33Å; S300-Y304 PolarHBondContact O-N 2.88Å; Y304-R306 VanDerWaalsContact C-N 3.27Å; Y304-R306 PolarHBondContact O-N 3.44Å; Y304-E308 HydrophobicContact CD2-CB 3.71Å; Y304-E308 HydrophobicContact CD2-CG 3.44Å; Y304-E308 VanDerWaalsContact CD2-CG 3.44Å; Y304-E308 HydrophobicContact CE2-CB 3.52Å; Y304-E308 HydrophobicContact CE2-CG 3.53Å; Y304-E308 HydrophobicContact CG-CB 4.44Å; Y304-E308 HydrophobicContact CG-CG 4.42Å; Y304-E308 WeakPolarHBondContact O-CA 3.28Å; Y304-E308 WeakPolarHBondContact O-CB 3.32Å; Y304-E308 PolarHBondContact O-N 2.92Å; Y304-V309 HydrophobicContact CD1-CG2 3.62Å; Y304-V309 HydrophobicContact CE1-CG2 3.41Å; Y304-V309 VanDerWaalsContact CE1-CG2 3.41Å; Y304-V309 PolarHBondContact O-N 3.17Å; Y304-F328 HydrophobicContact CD2-CD1 4.47Å; Y304-F328 HydrophobicContact CD2-CE1 4.09Å; Y304-F328 HydrophobicContact CG-CE1 4.4Å; Y304-Y366 AromaticContact CD1-CD1 3.58Å; Y304-Y366 HydrophobicContact CD1-CD1 3.58Å; Y304-Y366 HydrophobicContact CD1-CE1 4.11Å; Y304-Y366 HydrophobicContact CE1-CD1 4.09Å; Y304-Y366 AromaticContact CG-CD1 3.98Å; Y304-Y366 HydrophobicContact CG-CD1 3.98Å; Y304-Y366 HydrophobicContact CG-CE1 4.06Å; Y304-T370 WeakPolarHBondContact OH-CG2 3.48Å; Y304-V397 HydrophobicContact CD1-CG1 4.44Å; Y304-V397 HydrophobicContact CE1-CB 4.49Å; Y304-V397 HydrophobicContact CE1-CG1 3.83Å; Y304-V397 HydrophobicContact CE2-CB 4.05Å; Y304-V397 HydrophobicContact CE2-CG1 3.98Å; Y304-V397 HydrophobicContact CE2-CG2 4.02Å
305	V	94.6	Very high	88.8	Confident	27 Å²	27	53.1 Å²	53.1	16%	0.164	27%	0.267	C	S	.	.	I	π-helix	trans	-65.9	-32.1	-179.6	171.8	0	0	0	0	112.2	A301 F303 V309 N310 L365	A301-V305 WeakPolarHBondContact O-CB 3.4Å; A301-V305 VanDerWaalsContact O-CG2 3.23Å; A301-V305 WeakPolarHBondContact O-CG2 3.42Å; A301-V305 PolarHBondContact O-N 3.05Å; F303-V305 VanDerWaalsContact C-N 3.26Å; F303-V305 PolarHBondContact O-N 3.45Å; V305-V309 HydrophobicContact CB-CB 4.5Å; V305-V309 HydrophobicContact CB-CG2 4.48Å; V305-V309 HydrophobicContact CG1-CB 4.48Å; V305-V309 HydrophobicContact CG2-CG2 4.17Å; V305-N310 WeakPolarHBondContact CG1-ND2 3.29Å; V305-N310 WeakPolarHBondContact O-CB 3.38Å; V305-N310 PolarHBondContact O-N 2.89Å; V305-N310 VanDerWaalsContact O-N 3.12Å; V305-N310 PolarHBondContact O-ND2 3.37Å; V305-L365 HydrophobicContact CG2-CB 4.32Å
306	R	91.3	Very high	87.5	Confident	94 Å²	94	56.8 Å²	56.8	36%	0.355	29%	0.287	S	S	.	.	I	π-helix	trans	-81.4	-39.8	179.4	-73.3	-165.1	-53.3	-78.5	-1.4	112.9	A302 F303 Y304 Y311 T312 E313	A302-R306 WeakPolarHBondContact O-CG 3.41Å; A302-R306 PolarHBondContact O-N 3.5Å; A302-R306 PolarHBondContact O-NH1 3.25Å; F303-R306 WeakPolarHBondContact O-CA 3.3Å; F303-R306 PolarHBondContact O-N 3.23Å; Y304-R306 VanDerWaalsContact C-N 3.27Å; Y304-R306 PolarHBondContact O-N 3.44Å; R306-Y311 PolarHBondContact O-N 3.12Å; R306-T312 WeakPolarHBondContact CA-OG1 3.38Å; R306-T312 WeakPolarHBondContact CB-OG1 3.49Å; R306-T312 PolarHBondContact O-N 3.18Å; R306-T312 PolarHBondContact O-OG1 3.08Å; R306-E313 IonicContact CZ-OE2 3.62Å; R306-E313 IonicContact NE-OE1 3.42Å; R306-E313 IonicContact NE-OE2 3.64Å; R306-E313 PolarHBondContact NE-OE2 3.49Å; R306-E313 IonicContact NH2-OE2 3.35Å; R306-E313 PolarHBondContact O-N 3.22Å
307	T	88.8	Confident	86.4	Confident	3 Å²	3	60 Å²	60	2%	0.018	30%	0.303	C	S	.	.	I	π-helix	trans	-90.5	-45.6	-174.3	63.3	0	0	0	0	112.2	F303 Y311 E313 V315	F303-T307 HydrophobicContact CD1-CG2 4.16Å; F303-T307 HydrophobicContact CD2-CG2 4.2Å; F303-T307 HydrophobicContact CE1-CG2 3.79Å; F303-T307 HydrophobicContact CE2-CG2 3.82Å; F303-T307 HydrophobicContact CG-CG2 4.37Å; F303-T307 HydrophobicContact CZ-CG2 3.62Å; F303-T307 PolarHBondContact O-N 2.97Å; F303-T307 PolarHBondContact O-OG1 3.49Å; T307-Y311 WeakPolarHBondContact O-CA 3.29Å; T307-E313 HydrophobicContact CG2-CB 4.35Å; T307-V315 HydrophobicContact CG2-CG2 3.68Å
308	E	91.3	Very high	85.1	Confident	38 Å²	38	61.5 Å²	61.5	18%	0.178	31%	0.314	C	S	.	.	I	π-helix	trans	-98.4	-51.5	-173.8	-49.4	-45.2	131.5	0	0	112.4	Y304 N310 Y311	Y304-E308 HydrophobicContact CD2-CB 3.71Å; Y304-E308 HydrophobicContact CD2-CG 3.44Å; Y304-E308 VanDerWaalsContact CD2-CG 3.44Å; Y304-E308 HydrophobicContact CE2-CB 3.52Å; Y304-E308 HydrophobicContact CE2-CG 3.53Å; Y304-E308 HydrophobicContact CG-CB 4.44Å; Y304-E308 HydrophobicContact CG-CG 4.42Å; Y304-E308 WeakPolarHBondContact O-CA 3.28Å; Y304-E308 WeakPolarHBondContact O-CB 3.32Å; Y304-E308 PolarHBondContact O-N 2.92Å; E308-N310 PolarHBondContact O-N 3.13Å; E308-Y311 VanDerWaalsContact O-CD2 3.27Å; E308-Y311 WeakPolarHBondContact O-CD2 3.3Å; E308-Y311 WeakPolarHBondContact O-CE2 3.19Å
309	V	94.8	Very high	83.7	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.335	C	S	.	.	I	π-helix	trans	-66.5	-47.8	-172.1	179.4	0	0	0	0	110.4	Y304 V305 Q368 T370 E371 K444	Y304-V309 HydrophobicContact CD1-CG2 3.62Å; Y304-V309 HydrophobicContact CE1-CG2 3.41Å; Y304-V309 VanDerWaalsContact CE1-CG2 3.41Å; Y304-V309 PolarHBondContact O-N 3.17Å; V305-V309 HydrophobicContact CB-CB 4.5Å; V305-V309 HydrophobicContact CB-CG2 4.48Å; V305-V309 HydrophobicContact CG1-CB 4.48Å; V305-V309 HydrophobicContact CG2-CG2 4.17Å; V309-Q368 HydrophobicContact CG1-CB 3.66Å; V309-Q368 HydrophobicContact CG2-CB 4.27Å; V309-T370 HydrophobicContact CG2-CG2 4.45Å; V309-E371 PolarHBondContact O-N 3.44Å; V309-K444 HydrophobicContact CG1-CD 3.76Å; V309-K444 PolarHBondContact O-NZ 2.85Å
310	N	93.1	Very high	82.4	Confident	25 Å²	25	61 Å²	61	13%	0.134	31%	0.314	C	S	.	.	S	Bend	trans	-117	-0.8	-172.8	-61.6	-46.5	0	0	0	115	V305 E308 T312 H441 K444	V305-N310 WeakPolarHBondContact CG1-ND2 3.29Å; V305-N310 WeakPolarHBondContact O-CB 3.38Å; V305-N310 PolarHBondContact O-N 2.89Å; V305-N310 VanDerWaalsContact O-N 3.12Å; V305-N310 PolarHBondContact O-ND2 3.37Å; E308-N310 PolarHBondContact O-N 3.13Å; N310-T312 HydrophobicContact CB-CG2 3.98Å; N310-T312 PolarHBondContact O-N 2.75Å; N310-H441 WeakPolarHBondContact OD1-CB 3.32Å; N310-K444 WeakPolarHBondContact OD1-CD 2.99Å; N310-K444 PolarHBondContact OD1-NZ 3.1Å
311	Y	85.1	Confident	80.8	Confident	114 Å²	114	63 Å²	63	45%	0.447	33%	0.328	S	S	.	.			trans	48.9	38.6	177.6	-91.4	-96.3	0	0	0	114.2	R306 T307 E308 E371 D372	R306-Y311 PolarHBondContact O-N 3.12Å; T307-Y311 WeakPolarHBondContact O-CA 3.29Å; E308-Y311 VanDerWaalsContact O-CD2 3.27Å; E308-Y311 WeakPolarHBondContact O-CD2 3.3Å; E308-Y311 WeakPolarHBondContact O-CE2 3.19Å; Y311-E371 HydrophobicContact CD2-CB 3.89Å; Y311-E371 HydrophobicContact CD2-CG 4.33Å; Y311-E371 HydrophobicContact CE2-CB 4.45Å; Y311-D372 WeakPolarHBondContact CE2-OD2 3.25Å; Y311-D372 PolarHBondContact OH-OD2 2.73Å
312	T	75.9	Confident	78.9	Confident	89 Å²	89	66.7 Å²	66.7	55%	0.546	35%	0.347	S	S	.	.			trans	-79.9	-21.1	179.2	55.5	0	0	0	0	113.1	R306 N310	R306-T312 WeakPolarHBondContact CA-OG1 3.38Å; R306-T312 WeakPolarHBondContact CB-OG1 3.49Å; R306-T312 PolarHBondContact O-N 3.18Å; R306-T312 PolarHBondContact O-OG1 3.08Å; N310-T312 HydrophobicContact CB-CG2 3.98Å; N310-T312 PolarHBondContact O-N 2.75Å
313	E	77.1	Confident	77.2	Confident	90 Å²	90	66.7 Å²	66.7	42%	0.421	35%	0.352	S	S	.	.	S	Bend	trans	-133	125	-179.8	-66.5	179.1	164.9	0	0	108.6	R306 T307	R306-E313 IonicContact CZ-OE2 3.62Å; R306-E313 IonicContact NE-OE1 3.42Å; R306-E313 IonicContact NE-OE2 3.64Å; R306-E313 PolarHBondContact NE-OE2 3.49Å; R306-E313 IonicContact NH2-OE2 3.35Å; R306-E313 PolarHBondContact O-N 3.22Å; T307-E313 HydrophobicContact CG2-CB 4.35Å
314	E	69.4	Low	75.9	Confident	197 Å²	197	70.4 Å²	70.4	92%	0.921	37%	0.37	S	S	*	.			trans	-83.3	124.3	171.5	-69.5	177.7	-178.9	0	0	109
315	V	68.1	Low	74.6	Confident	79 Å²	79	74 Å²	74	48%	0.479	39%	0.392	S	S	.	.			trans	-126.8	130.7	177	-176	0	0	0	0	108.9	F303 T307	F303-V315 HydrophobicContact CE2-CG2 4.31Å; F303-V315 HydrophobicContact CZ-CB 4.48Å; F303-V315 HydrophobicContact CZ-CG1 4.28Å; F303-V315 HydrophobicContact CZ-CG2 3.99Å; T307-V315 HydrophobicContact CG2-CG2 3.68Å
316	D	68.3	Low	73.3	Confident	160 Å²	160	74.2 Å²	74.2	86%	0.856	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-76.8	124.7	173	-70.2	-40.9	0	0	0	109.5
317	D	70.1	Confident	72.3	Confident	77 Å²	77	70.4 Å²	70.4	41%	0.412	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-65.9	138.2	174.8	-76.6	-47.7	0	0	0	111.8	I319 V325	D317-I319 PolarHBondContact O-N 3.31Å; D317-V325 HydrophobicContact CB-CG1 3.35Å
318	P	68.3	Low	72.1	Confident	39 Å²	39	71 Å²	71	25%	0.253	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-68.6	122.7	174.8	24.3	-27.1	0	0	0	110.3	L326	P318-L326 HydrophobicContact CG-CB 4.12Å; P318-L326 WeakPolarHBondContact CG-O 3.43Å; P318-L326 WeakPolarHBondContact O-CB 3.37Å; P318-L326 PolarHBondContact O-N 3.48Å
319	I	65.4	Low	71.9	Confident	109 Å²	109	72.8 Å²	72.8	56%	0.559	39%	0.393	S	S	*	.	B	Isolated β-bridge	trans	-96.3	135	173.9	-55	176.1	0	0	0	109.3	D317 E324 V325	D317-I319 PolarHBondContact O-N 3.31Å; I319-E324 WeakPolarHBondContact CA-O 3.39Å; I319-V325 HydrophobicContact CG1-CG2 4.47Å
320	D	65.9	Low	71.7	Confident	36 Å²	36	76 Å²	76	19%	0.193	41%	0.411	C	S	.	.			trans	-80.9	-173.9	178	87.4	-11.1	0	0	0	113.5	D322 G323 E324 L326	D320-D322 PolarHBondContact O-N 3Å; D320-D322 VanDerWaalsContact OD1-CA 3.3Å; D320-D322 WeakPolarHBondContact OD1-CA 3.19Å; D320-D322 WeakPolarHBondContact OD1-CB 3.32Å; D320-D322 PolarHBondContact OD1-N 3.4Å; D320-G323 PolarHBondContact O-N 3.09Å; D320-G323 PolarHBondContact OD1-N 3.35Å; D320-E324 PolarHBondContact N-O 3.49Å; D320-E324 PolarHBondContact OD1-N 3.42Å; D320-L326 HydrophobicContact CB-CD1 3.99Å; D320-L326 HydrophobicContact CB-CG 4.27Å
321	S	58.4	Low	71.6	Confident	50 Å²	50	75 Å²	75	35%	0.35	41%	0.405	S	S	.	.	S	Bend	trans	-71.1	-15.2	-179.9	54.2	0	0	0	0	114.5	R167 R209	R167-S321 PolarHBondContact NH1-OG 3.4Å; R209-S321 PolarHBondContact NH2-OG 2.96Å
322	D	54.3	Low	72.1	Confident	76 Å²	76	69.6 Å²	69.6	41%	0.406	38%	0.384	S	S	.	.	S	Bend	trans	-98.3	-11.1	-176.4	-66.4	-57.5	0	0	0	112	R167 R209 D320 E324	R167-D322 IonicContact CZ-OD1 2.61Å; R167-D322 IonicContact CZ-OD2 3.2Å; R167-D322 VanDerWaalsContact NH1-CG 3.32Å; R167-D322 IonicContact NH1-OD1 3.8Å; R167-D322 PolarHBondContact NH1-OD1 3.09Å; R167-D322 IonicContact NH1-OD2 3.92Å; R167-D322 PolarHBondContact NH1-OD2 3.14Å; R167-D322 VanDerWaalsContact NH1-OD2 3.07Å; R167-D322 IonicContact NH2-OD1 3.99Å; R167-D322 PolarHBondContact NH2-OD1 3.02Å; R167-D322 IonicContact NH2-OD2 3.02Å; R209-D322 IonicContact NH2-OD2 2.86Å; D320-D322 PolarHBondContact O-N 3Å; D320-D322 VanDerWaalsContact OD1-CA 3.3Å; D320-D322 WeakPolarHBondContact OD1-CA 3.19Å; D320-D322 WeakPolarHBondContact OD1-CB 3.32Å; D320-D322 PolarHBondContact OD1-N 3.4Å; D322-E324 HydrophobicContact CB-CG 4.37Å
323	G	57.2	Low	73.1	Confident	47 Å²	47	66.7 Å²	66.7	49%	0.485	36%	0.364	S	S	.	.	S	Bend	trans	95.5	6.6	-178.8	0	0	0	0	0	112.6	D320	D320-G323 PolarHBondContact O-N 3.09Å; D320-G323 PolarHBondContact OD1-N 3.35Å
324	E	63.5	Low	73.9	Confident	125 Å²	125	62.4 Å²	62.4	58%	0.584	34%	0.344	S	S	*	.			trans	-78.5	133	179.3	-60.2	-59.6	150.4	0	0	110.4	I319 D320 D322 L326	I319-E324 WeakPolarHBondContact CA-O 3.39Å; D320-E324 PolarHBondContact N-O 3.49Å; D320-E324 PolarHBondContact OD1-N 3.42Å; D322-E324 HydrophobicContact CB-CG 4.37Å; E324-L326 PolarHBondContact O-N 3.28Å
325	V	66.8	Low	75.2	Confident	78 Å²	78	53 Å²	53	47%	0.473	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	-80.9	110.9	177.3	-175.9	0	0	0	0	107.9	D317 I319 G327	D317-V325 HydrophobicContact CB-CG1 3.35Å; I319-V325 HydrophobicContact CG1-CG2 4.47Å; V325-G327 PolarHBondContact O-N 3.11Å
326	L	67.1	Low	76.7	Confident	32 Å²	32	49.5 Å²	49.5	17%	0.168	28%	0.278	C	S	.	.			trans	-82.1	64.7	176.1	-63.2	171.3	0	0	0	109.3	R205 P318 D320 E324	R205-L326 VanDerWaalsContact CZ-CD1 3.41Å; P318-L326 HydrophobicContact CG-CB 4.12Å; P318-L326 WeakPolarHBondContact CG-O 3.43Å; P318-L326 WeakPolarHBondContact O-CB 3.37Å; P318-L326 PolarHBondContact O-N 3.48Å; D320-L326 HydrophobicContact CB-CD1 3.99Å; D320-L326 HydrophobicContact CB-CG 4.27Å; E324-L326 PolarHBondContact O-N 3.28Å
327	G	69.1	Low	78	Confident	15 Å²	15	46.5 Å²	46.5	16%	0.155	26%	0.259	C	S	.	.			trans	-57.2	141	-175.9	0	0	0	0	0	112	V325 E329 N330	V325-G327 PolarHBondContact O-N 3.11Å; G327-E329 PolarHBondContact O-N 3.08Å; G327-N330 WeakPolarHBondContact O-CB 3.2Å; G327-N330 PolarHBondContact O-N 3.28Å; G327-N330 VanDerWaalsContact O-N 3.12Å
328	F	84.2	Confident	79.4	Confident	14 Å²	14	43 Å²	43	6%	0.061	24%	0.24	C	C	.	.	H	α-helix	trans	-57.5	-29.3	178.1	167.6	-94.5	0	0	0	112.8	S300 F303 Y304 N330 L331 V332	S300-F328 WeakPolarHBondContact O-CZ 3.2Å; F303-F328 HydrophobicContact CB-CE2 4.48Å; F303-F328 HydrophobicContact CB-CZ 4.18Å; F303-F328 AromaticContact CD1-CD1 3.88Å; F303-F328 HydrophobicContact CD1-CD1 3.88Å; F303-F328 AromaticContact CD1-CD2 3.7Å; F303-F328 HydrophobicContact CD1-CD2 3.7Å; F303-F328 AromaticContact CD1-CE1 3.74Å; F303-F328 HydrophobicContact CD1-CE1 3.74Å; F303-F328 AromaticContact CD1-CE2 3.53Å; F303-F328 HydrophobicContact CD1-CE2 3.53Å; F303-F328 AromaticContact CD1-CG 3.87Å; F303-F328 HydrophobicContact CD1-CG 3.87Å; F303-F328 AromaticContact CD1-CZ 3.55Å; F303-F328 HydrophobicContact CD1-CZ 3.55Å; F303-F328 HydrophobicContact CE1-CB 4.33Å; F303-F328 HydrophobicContact CE1-CD1 4.1Å; F303-F328 AromaticContact CE1-CD2 3.79Å; F303-F328 HydrophobicContact CE1-CD2 3.79Å; F303-F328 HydrophobicContact CE1-CE1 4.42Å; F303-F328 HydrophobicContact CE1-CE2 4.11Å; F303-F328 AromaticContact CE1-CG 3.79Å; F303-F328 HydrophobicContact CE1-CG 3.79Å; F303-F328 HydrophobicContact CE1-CZ 4.41Å; F303-F328 HydrophobicContact CG-CE2 4.32Å; F303-F328 HydrophobicContact CG-CZ 4.31Å; Y304-F328 HydrophobicContact CD2-CD1 4.47Å; Y304-F328 HydrophobicContact CD2-CE1 4.09Å; Y304-F328 HydrophobicContact CG-CE1 4.4Å; F328-N330 PolarHBondContact O-N 3.03Å; F328-L331 HydrophobicContact CD2-CD2 4.43Å; F328-L331 HydrophobicContact CE2-CD2 4.26Å; F328-L331 WeakPolarHBondContact O-CB 3.13Å; F328-L331 PolarHBondContact O-N 3.23Å; F328-V332 HydrophobicContact CD1-CG2 4.33Å; F328-V332 HydrophobicContact CE1-CG2 3.7Å; F328-V332 HydrophobicContact CZ-CG2 3.96Å; F328-V332 PolarHBondContact O-N 3.07Å
329	E	88.3	Confident	80.8	Confident	76 Å²	76	41.8 Å²	41.8	36%	0.355	23%	0.232	S	C	.	.	H	α-helix	trans	-55.8	-35.5	175.2	-60.7	-171.3	147.3	0	0	113.3	G327 L331 V332 F333 V397	G327-E329 PolarHBondContact O-N 3.08Å; E329-L331 VanDerWaalsContact C-N 3.26Å; E329-L331 PolarHBondContact O-N 2.71Å; E329-V332 WeakPolarHBondContact O-CA 3.36Å; E329-V332 WeakPolarHBondContact O-CB 3.49Å; E329-V332 PolarHBondContact O-N 3.38Å; E329-F333 HydrophobicContact CB-CE2 4.17Å; E329-F333 WeakPolarHBondContact O-CD2 3.13Å; E329-F333 PolarHBondContact O-N 3.47Å; E329-V397 HydrophobicContact CB-CG2 4Å; E329-V397 HydrophobicContact CG-CG2 4.11Å
330	N	90.4	Very high	82.3	Confident	69 Å²	69	38.8 Å²	38.8	37%	0.369	22%	0.216	S	C	.	.	H	α-helix	trans	-65.7	-30	178.7	-67.1	-50.6	0	0	0	112.9	M265 G327 F328 S334	M265-N330 HydrophobicContact SD-CB 3.5Å; M265-N330 WeakPolarHBondContact SD-CB 3.23Å; G327-N330 WeakPolarHBondContact O-CB 3.2Å; G327-N330 PolarHBondContact O-N 3.28Å; G327-N330 VanDerWaalsContact O-N 3.12Å; F328-N330 PolarHBondContact O-N 3.03Å; N330-S334 PolarHBondContact O-N 3.41Å; N330-S334 VanDerWaalsContact O-N 3.14Å
331	L	91.8	Very high	83.8	Confident	4 Å²	4	37.5 Å²	37.5	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-65.3	-44.1	170.3	174.4	62.3	0	0	0	110	K264 M265 F328 E329 F333 S334 I335	K264-L331 HydrophobicContact CB-CD1 3.88Å; K264-L331 HydrophobicContact CB-CD2 4.3Å; K264-L331 HydrophobicContact CD-CD2 4.45Å; M265-L331 HydrophobicContact CB-CB 4.38Å; M265-L331 HydrophobicContact CB-CD1 4.22Å; F328-L331 HydrophobicContact CD2-CD2 4.43Å; F328-L331 HydrophobicContact CE2-CD2 4.26Å; F328-L331 WeakPolarHBondContact O-CB 3.13Å; F328-L331 PolarHBondContact O-N 3.23Å; E329-L331 VanDerWaalsContact C-N 3.26Å; E329-L331 PolarHBondContact O-N 2.71Å; L331-F333 PolarHBondContact O-N 2.82Å; L331-S334 PolarHBondContact O-N 3.33Å; L331-S334 PolarHBondContact O-OG 3.41Å; L331-I335 HydrophobicContact CD1-CD1 4.49Å; L331-I335 HydrophobicContact CG-CD1 4.21Å; L331-I335 WeakPolarHBondContact O-CG1 3.37Å; L331-I335 PolarHBondContact O-N 3.26Å
332	V	94.9	Very high	85.6	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60.6	-44.9	178.2	-178.7	0	0	0	0	111.3	F328 E329 S334 I335 F336 Y366 V397	F328-V332 HydrophobicContact CD1-CG2 4.33Å; F328-V332 HydrophobicContact CE1-CG2 3.7Å; F328-V332 HydrophobicContact CZ-CG2 3.96Å; F328-V332 PolarHBondContact O-N 3.07Å; E329-V332 WeakPolarHBondContact O-CA 3.36Å; E329-V332 WeakPolarHBondContact O-CB 3.49Å; E329-V332 PolarHBondContact O-N 3.38Å; V332-S334 VanDerWaalsContact C-N 3.32Å; V332-S334 PolarHBondContact O-N 2.97Å; V332-I335 WeakPolarHBondContact O-CB 3.37Å; V332-I335 PolarHBondContact O-N 3.33Å; V332-I335 VanDerWaalsContact O-N 3.08Å; V332-F336 HydrophobicContact CG1-CD2 4.29Å; V332-F336 HydrophobicContact CG1-CE1 4.06Å; V332-F336 HydrophobicContact CG1-CE2 3.6Å; V332-F336 HydrophobicContact CG1-CZ 3.46Å; V332-F336 VanDerWaalsContact CG1-CZ 3.46Å; V332-F336 PolarHBondContact O-N 3.1Å; V332-F336 VanDerWaalsContact O-N 3.08Å; V332-Y366 HydrophobicContact CB-CE1 4.38Å; V332-Y366 HydrophobicContact CG1-CD1 3.81Å; V332-Y366 HydrophobicContact CG1-CE1 3.53Å; V332-Y366 HydrophobicContact CG1-CG 4.49Å; V332-Y366 HydrophobicContact CG2-CE1 3.86Å; V332-V397 HydrophobicContact CB-CG2 4.29Å; V332-V397 HydrophobicContact CG1-CG1 3.77Å; V332-V397 HydrophobicContact CG1-CG2 4.22Å
333	F	95.8	Very high	87.6	Confident	27 Å²	27	32.6 Å²	32.6	12%	0.118	18%	0.179	C	C	.	.	H	α-helix	trans	-57	-44.9	174.3	-62.9	-46	0	0	0	112.1	E329 L331 I335 F336 E337 Y395 V397 S400	E329-F333 HydrophobicContact CB-CE2 4.17Å; E329-F333 WeakPolarHBondContact O-CD2 3.13Å; E329-F333 PolarHBondContact O-N 3.47Å; L331-F333 PolarHBondContact O-N 2.82Å; F333-I335 VanDerWaalsContact C-N 3.26Å; F333-I335 PolarHBondContact O-N 2.91Å; F333-F336 PolarHBondContact O-N 3.31Å; F333-F336 VanDerWaalsContact O-N 3.15Å; F333-E337 PolarHBondContact O-N 3.12Å; F333-Y395 AromaticContact CD1-CE1 3.5Å; F333-Y395 HydrophobicContact CD1-CE1 3.5Å; F333-Y395 AromaticContact CD1-CZ 3.67Å; F333-Y395 WeakPolarHBondContact CD1-OH 3.36Å; F333-Y395 AromaticContact CD2-CE1 3.84Å; F333-Y395 HydrophobicContact CD2-CE1 3.84Å; F333-Y395 AromaticContact CE1-CD1 3.98Å; F333-Y395 HydrophobicContact CE1-CD1 3.98Å; F333-Y395 AromaticContact CE1-CE1 3.38Å; F333-Y395 HydrophobicContact CE1-CE1 3.38Å; F333-Y395 AromaticContact CE1-CZ 3.81Å; F333-Y395 HydrophobicContact CE2-CD1 4.18Å; F333-Y395 AromaticContact CE2-CE1 3.75Å; F333-Y395 HydrophobicContact CE2-CE1 3.75Å; F333-Y395 AromaticContact CG-CE1 3.76Å; F333-Y395 HydrophobicContact CG-CE1 3.76Å; F333-Y395 AromaticContact CZ-CD1 3.82Å; F333-Y395 HydrophobicContact CZ-CD1 3.82Å; F333-Y395 AromaticContact CZ-CE1 3.53Å; F333-Y395 HydrophobicContact CZ-CE1 3.53Å; F333-V397 HydrophobicContact CE1-CB 4.46Å; F333-V397 HydrophobicContact CE1-CG2 3.89Å; F333-V397 HydrophobicContact CZ-CG2 3.94Å; F333-S400 WeakPolarHBondContact CE1-OG 3.3Å
334	S	95.6	Very high	89.4	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.007	19%	0.185	C	C	.	.	H	α-helix	trans	-65.2	-27.3	177.7	70.9	0	0	0	0	113.8	N330 L331 V332 F338	N330-S334 PolarHBondContact O-N 3.41Å; N330-S334 VanDerWaalsContact O-N 3.14Å; L331-S334 PolarHBondContact O-N 3.33Å; L331-S334 PolarHBondContact O-OG 3.41Å; V332-S334 VanDerWaalsContact C-N 3.32Å; V332-S334 PolarHBondContact O-N 2.97Å; S334-F338 PolarHBondContact O-N 3.46Å
335	I	96.6	Very high	90.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-69.2	-45.4	172.8	-65.2	165.4	0	0	0	110.2	L268 T296 L297 L331 V332 F333 F338 V339	L268-I335 HydrophobicContact CD2-CB 4.16Å; L268-I335 HydrophobicContact CD2-CG1 3.44Å; L268-I335 VanDerWaalsContact CD2-CG1 3.44Å; T296-I335 HydrophobicContact CG2-CD1 3.96Å; L297-I335 HydrophobicContact CB-CG2 3.81Å; L297-I335 HydrophobicContact CD1-CG2 3.73Å; L297-I335 HydrophobicContact CG-CG2 3.85Å; L331-I335 HydrophobicContact CD1-CD1 4.49Å; L331-I335 HydrophobicContact CG-CD1 4.21Å; L331-I335 WeakPolarHBondContact O-CG1 3.37Å; L331-I335 PolarHBondContact O-N 3.26Å; V332-I335 WeakPolarHBondContact O-CB 3.37Å; V332-I335 PolarHBondContact O-N 3.33Å; V332-I335 VanDerWaalsContact O-N 3.08Å; F333-I335 VanDerWaalsContact C-N 3.26Å; F333-I335 PolarHBondContact O-N 2.91Å; I335-F338 WeakPolarHBondContact O-CB 3.14Å; I335-F338 PolarHBondContact O-N 2.82Å; I335-V339 WeakPolarHBondContact O-CG2 3.19Å; I335-V339 PolarHBondContact O-N 3.13Å; I335-V339 VanDerWaalsContact O-N 3.14Å
336	F	98	Very high	91.9	Very high	5 Å²	5	34.3 Å²	34.3	2%	0.022	17%	0.174	C	C	.	.	H	α-helix	trans	-64	-43.4	177	-60.2	-23	0	0	0	111.4	V332 F333 F338 V339 H340 Y366 V397 A401 L404	V332-F336 HydrophobicContact CG1-CD2 4.29Å; V332-F336 HydrophobicContact CG1-CE1 4.06Å; V332-F336 HydrophobicContact CG1-CE2 3.6Å; V332-F336 HydrophobicContact CG1-CZ 3.46Å; V332-F336 VanDerWaalsContact CG1-CZ 3.46Å; V332-F336 PolarHBondContact O-N 3.1Å; V332-F336 VanDerWaalsContact O-N 3.08Å; F333-F336 PolarHBondContact O-N 3.31Å; F333-F336 VanDerWaalsContact O-N 3.15Å; F336-F338 VanDerWaalsContact C-N 3.28Å; F336-F338 PolarHBondContact O-N 2.98Å; F336-V339 PolarHBondContact O-N 3.14Å; F336-H340 PolarHBondContact O-CD2 3.48Å; F336-H340 PolarHBondContact O-N 2.98Å; F336-Y366 AromaticContact CE1-CD2 3.91Å; F336-Y366 HydrophobicContact CE1-CD2 3.91Å; F336-Y366 HydrophobicContact CE1-CE2 4.1Å; F336-Y366 HydrophobicContact CE1-CG 4.36Å; F336-Y366 HydrophobicContact CZ-CD1 4.23Å; F336-Y366 AromaticContact CZ-CD2 3.74Å; F336-Y366 HydrophobicContact CZ-CD2 3.74Å; F336-Y366 HydrophobicContact CZ-CE2 4.23Å; F336-Y366 AromaticContact CZ-CG 3.73Å; F336-Y366 HydrophobicContact CZ-CG 3.73Å; F336-V397 HydrophobicContact CE2-CG1 4.27Å; F336-V397 HydrophobicContact CZ-CG1 4.48Å; F336-A401 HydrophobicContact CE2-CB 3.98Å; F336-A401 HydrophobicContact CZ-CB 3.95Å; F336-L404 HydrophobicContact CB-CD2 4.29Å; F336-L404 HydrophobicContact CD1-CD2 3.78Å; F336-L404 HydrophobicContact CE1-CD2 4.45Å; F336-L404 HydrophobicContact CG-CD2 4.21Å
337	E	97.4	Very high	93	Very high	97 Å²	97	38.4 Å²	38.4	45%	0.453	19%	0.19	S	C	.	.	H	α-helix	trans	-57.8	-40.1	175.1	-169.4	-172.4	176.5	0	0	112.2	T272 F333 V339 H340 T341	T272-E337 HydrophobicContact CG2-CG 4.32Å; F333-E337 PolarHBondContact O-N 3.12Å; E337-V339 PolarHBondContact O-N 3.42Å; E337-H340 PolarHBondContact O-N 3.14Å; E337-T341 WeakPolarHBondContact O-CB 3.47Å; E337-T341 PolarHBondContact O-N 3.45Å; E337-T341 PolarHBondContact O-OG1 3Å
338	F	97.9	Very high	94.2	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.018	19%	0.185	C	C	.	.	H	α-helix	trans	-60.8	-44.4	173.3	178	-100.5	0	0	0	111.6	L268 V271 T272 V275 M286 I289 L290 V293 S334 I335 F336 T341 L342	L268-F338 HydrophobicContact CD1-CB 4.19Å; L268-F338 HydrophobicContact CD1-CD2 4.16Å; L268-F338 HydrophobicContact CD1-CG 4.1Å; L268-F338 HydrophobicContact CG-CB 4.42Å; V271-F338 HydrophobicContact CG1-CE2 3.94Å; T272-F338 WeakPolarHBondContact OG1-CD2 3.37Å; V275-F338 HydrophobicContact CG2-CE2 4.18Å; M286-F338 HydrophobicContact CE-CZ 4.4Å; I289-F338 HydrophobicContact CG2-CE2 4.22Å; I289-F338 HydrophobicContact CG2-CZ 3.75Å; L290-F338 HydrophobicContact CD2-CE1 4.24Å; L290-F338 HydrophobicContact CD2-CZ 4.38Å; V293-F338 HydrophobicContact CB-CD1 4.32Å; V293-F338 HydrophobicContact CB-CE1 4.01Å; V293-F338 HydrophobicContact CG1-CD1 3.59Å; V293-F338 HydrophobicContact CG1-CE1 3.79Å; V293-F338 HydrophobicContact CG1-CG 4.33Å; V293-F338 HydrophobicContact CG2-CD1 4.46Å; V293-F338 HydrophobicContact CG2-CE1 4.05Å; V293-F338 HydrophobicContact CG2-CZ 4.23Å; S334-F338 PolarHBondContact O-N 3.46Å; I335-F338 WeakPolarHBondContact O-CB 3.14Å; I335-F338 PolarHBondContact O-N 2.82Å; F336-F338 VanDerWaalsContact C-N 3.28Å; F336-F338 PolarHBondContact O-N 2.98Å; F338-T341 PolarHBondContact O-N 3.18Å; F338-L342 HydrophobicContact CD1-CD1 4.08Å; F338-L342 HydrophobicContact CD1-CG 4.47Å; F338-L342 HydrophobicContact CE1-CD1 3.54Å; F338-L342 HydrophobicContact CE1-CD2 4.5Å; F338-L342 HydrophobicContact CE1-CG 4.14Å; F338-L342 HydrophobicContact CE2-CD2 4.47Å; F338-L342 HydrophobicContact CZ-CD1 3.97Å; F338-L342 HydrophobicContact CZ-CD2 4.12Å; F338-L342 HydrophobicContact CZ-CG 4.23Å; F338-L342 WeakPolarHBondContact O-CG 3.16Å; F338-L342 PolarHBondContact O-N 3.29Å; F338-L342 VanDerWaalsContact O-N 3.08Å
339	V	97.9	Very high	94.7	Very high	12 Å²	12	40 Å²	40	7%	0.073	19%	0.193	C	C	.	.	H	α-helix	trans	-64.9	-42.2	177.4	-177.6	0	0	0	0	111.4	I335 F336 E337 T341 L342 L343 V352 L359 L404	I335-V339 WeakPolarHBondContact O-CG2 3.19Å; I335-V339 PolarHBondContact O-N 3.13Å; I335-V339 VanDerWaalsContact O-N 3.14Å; F336-V339 PolarHBondContact O-N 3.14Å; E337-V339 PolarHBondContact O-N 3.42Å; V339-T341 VanDerWaalsContact C-N 3.33Å; V339-T341 PolarHBondContact O-N 2.8Å; V339-L342 WeakPolarHBondContact O-CB 3.28Å; V339-L342 PolarHBondContact O-N 3.06Å; V339-L342 VanDerWaalsContact O-N 3.17Å; V339-L343 PolarHBondContact O-N 3.41Å; V339-V352 HydrophobicContact CG1-CG1 4.24Å; V339-V352 HydrophobicContact CG1-CG2 4.24Å; V339-L359 HydrophobicContact CG1-CD2 4.03Å; V339-L404 HydrophobicContact CB-CD1 4.14Å; V339-L404 HydrophobicContact CB-CD2 4.24Å; V339-L404 HydrophobicContact CG1-CD1 3.79Å; V339-L404 HydrophobicContact CG1-CD2 4.24Å
340	H	97.4	Very high	95.1	Very high	47 Å²	47	39 Å²	39	22%	0.218	19%	0.194	C	C	.	.	H	α-helix	trans	-57.8	-45.4	173.5	-80.1	-74.6	0	0	0	111.6	F336 E337 L342 L343 E344	F336-H340 PolarHBondContact O-CD2 3.48Å; F336-H340 PolarHBondContact O-N 2.98Å; E337-H340 PolarHBondContact O-N 3.14Å; H340-L342 VanDerWaalsContact C-N 3.26Å; H340-L342 PolarHBondContact O-N 3.48Å; H340-L343 WeakPolarHBondContact O-CA 3.42Å; H340-L343 VanDerWaalsContact O-CB 3.32Å; H340-L343 WeakPolarHBondContact O-CB 3.42Å; H340-L343 PolarHBondContact O-N 2.84Å; H340-E344 WeakPolarHBondContact O-CG 3.25Å; H340-E344 PolarHBondContact O-N 3.48Å
341	T	97.3	Very high	95.3	Very high	9 Å²	9	37.8 Å²	37.8	6%	0.055	19%	0.189	C	C	.	.	H	α-helix	trans	-60.9	-35.1	177.4	-60.6	0	0	0	0	112.3	T272 V275 K276 E337 F338 V339 N345	T272-T341 HydrophobicContact CG2-CG2 4.11Å; T272-T341 WeakPolarHBondContact CG2-OG1 3.46Å; V275-T341 HydrophobicContact CB-CG2 4.3Å; V275-T341 HydrophobicContact CG1-CG2 3.94Å; K276-T341 HydrophobicContact CB-CG2 3.8Å; E337-T341 WeakPolarHBondContact O-CB 3.47Å; E337-T341 PolarHBondContact O-N 3.45Å; E337-T341 PolarHBondContact O-OG1 3Å; F338-T341 PolarHBondContact O-N 3.18Å; V339-T341 VanDerWaalsContact C-N 3.33Å; V339-T341 PolarHBondContact O-N 2.8Å; T341-N345 PolarHBondContact O-N 3.27Å
342	L	96.9	Very high	95.5	Very high	6 Å²	6	37.9 Å²	37.9	3%	0.031	19%	0.19	C	C	.	.	H	α-helix	trans	-69.7	-37	172.8	-61.9	178.5	0	0	0	112.2	V275 M286 L290 F338 V339 H340 N345 F348 K349 V352	V275-L342 HydrophobicContact CG1-CD2 3.92Å; M286-L342 HydrophobicContact CE-CD2 3.46Å; M286-L342 VanDerWaalsContact CE-CD2 3.46Å; L290-L342 HydrophobicContact CD2-CD1 3.56Å; F338-L342 HydrophobicContact CD1-CD1 4.08Å; F338-L342 HydrophobicContact CD1-CG 4.47Å; F338-L342 HydrophobicContact CE1-CD1 3.54Å; F338-L342 HydrophobicContact CE1-CD2 4.5Å; F338-L342 HydrophobicContact CE1-CG 4.14Å; F338-L342 HydrophobicContact CE2-CD2 4.47Å; F338-L342 HydrophobicContact CZ-CD1 3.97Å; F338-L342 HydrophobicContact CZ-CD2 4.12Å; F338-L342 HydrophobicContact CZ-CG 4.23Å; F338-L342 WeakPolarHBondContact O-CG 3.16Å; F338-L342 PolarHBondContact O-N 3.29Å; F338-L342 VanDerWaalsContact O-N 3.08Å; V339-L342 WeakPolarHBondContact O-CB 3.28Å; V339-L342 PolarHBondContact O-N 3.06Å; V339-L342 VanDerWaalsContact O-N 3.17Å; H340-L342 VanDerWaalsContact C-N 3.26Å; H340-L342 PolarHBondContact O-N 3.48Å; L342-N345 PolarHBondContact O-N 2.88Å; L342-F348 HydrophobicContact CB-CB 4.26Å; L342-F348 HydrophobicContact CD2-CB 3.74Å; L342-F348 HydrophobicContact CD2-CD2 4.17Å; L342-F348 HydrophobicContact CD2-CG 4.12Å; L342-F348 CarbonylContact O-C 3.57Å; L342-K349 VanDerWaalsContact O-CA 3.24Å; L342-K349 WeakPolarHBondContact O-CA 3.35Å; L342-K349 WeakPolarHBondContact O-CB 3.41Å; L342-K349 PolarHBondContact O-N 2.9Å; L342-V352 HydrophobicContact CB-CG2 3.75Å; L342-V352 HydrophobicContact CD1-CG2 4.26Å
343	L	95.9	Very high	95.6	Very high	16 Å²	16	43.6 Å²	43.6	8%	0.084	21%	0.212	C	C	.	.	H	α-helix	trans	-66.7	-42	-179.7	-169.9	65.9	0	0	0	111.8	V339 H340 N345 K349 V352 A407 V408 E411 F412	V339-L343 PolarHBondContact O-N 3.41Å; H340-L343 WeakPolarHBondContact O-CA 3.42Å; H340-L343 VanDerWaalsContact O-CB 3.32Å; H340-L343 WeakPolarHBondContact O-CB 3.42Å; H340-L343 PolarHBondContact O-N 2.84Å; L343-N345 PolarHBondContact O-N 3.12Å; L343-K349 VanDerWaalsContact O-CB 3.32Å; L343-K349 WeakPolarHBondContact O-CB 3.29Å; L343-V352 HydrophobicContact CD1-CG1 4.33Å; L343-A407 HydrophobicContact CD2-CB 3.81Å; L343-V408 HydrophobicContact CD1-CG1 4.35Å; L343-V408 HydrophobicContact CD2-CG1 4.1Å; L343-E411 HydrophobicContact CD1-CB 4.01Å; L343-E411 HydrophobicContact CD1-CG 3.82Å; L343-E411 HydrophobicContact CG-CB 4.44Å; L343-E411 HydrophobicContact CG-CG 4.4Å; L343-F412 HydrophobicContact CD1-CD2 4.11Å; L343-F412 HydrophobicContact CD1-CE2 3.29Å; L343-F412 HydrophobicContact CD1-CZ 3.8Å
344	E	93.9	Very high	95.6	Very high	135 Å²	135	50.6 Å²	50.6	63%	0.631	24%	0.242	S	C	*	.	H	α-helix	trans	-68.5	-18.5	177	-69.3	171.1	-173.5	0	0	112.6	H340	H340-E344 WeakPolarHBondContact O-CG 3.25Å; H340-E344 PolarHBondContact O-N 3.48Å
345	N	93	Very high	95.7	Very high	27 Å²	27	52.2 Å²	52.2	14%	0.144	26%	0.256	C	S	.	.			trans	-97.4	115.3	-177	-164.4	-61.3	0	0	0	112.7	P279 T341 L342 L343 K347 F348 K349	P279-N345 WeakPolarHBondContact CB-ND2 3.18Å; T341-N345 PolarHBondContact O-N 3.27Å; L342-N345 PolarHBondContact O-N 2.88Å; L343-N345 PolarHBondContact O-N 3.12Å; N345-K347 PolarHBondContact O-N 3.28Å; N345-K347 WeakPolarHBondContact OD1-CB 3.48Å; N345-K347 PolarHBondContact OD1-N 2.93Å; N345-F348 HydrophobicContact CB-CB 4.35Å; N345-F348 HydrophobicContact CB-CD2 3.88Å; N345-F348 PolarHBondContact O-N 2.92Å; N345-K349 WeakPolarHBondContact O-CB 3.46Å; N345-K349 PolarHBondContact O-N 3.09Å
346	N	90.5	Very high	95.7	Very high	125 Å²	125	52.3 Å²	52.3	67%	0.668	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-27.2	179.2	-74.9	-35.3	0	0	0	114.9	K349	N346-K349 VanDerWaalsContact OD1-CE 3.24Å; N346-K349 WeakPolarHBondContact OD1-CE 3.27Å; N346-K349 PolarHBondContact OD1-NZ 3.29Å
347	K	90.3	Very high	95.6	Very high	118 Å²	118	55 Å²	55	51%	0.513	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-28.4	178	-57.2	-172.8	-177.8	-126.3	0	112.8	N345	N345-K347 PolarHBondContact O-N 3.28Å; N345-K347 WeakPolarHBondContact OD1-CB 3.48Å; N345-K347 PolarHBondContact OD1-N 2.93Å
348	F	94.6	Very high	95.6	Very high	9 Å²	9	54.4 Å²	54.4	4%	0.039	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-22.2	-171.1	-54.2	-45.2	0	0	0	113.8	V275 P279 V283 M286 L342 N345 S350 T351	V275-F348 HydrophobicContact CG1-CD2 3.73Å; V275-F348 HydrophobicContact CG1-CE2 3.76Å; P279-F348 HydrophobicContact CB-CE2 3.84Å; P279-F348 HydrophobicContact CB-CZ 4.32Å; V283-F348 HydrophobicContact CG2-CE1 4.04Å; V283-F348 HydrophobicContact CG2-CZ 4.06Å; M286-F348 HydrophobicContact CE-CD1 4.37Å; M286-F348 HydrophobicContact CE-CG 4.42Å; M286-F348 HydrophobicContact CG-CD1 4.01Å; M286-F348 HydrophobicContact CG-CE1 3.51Å; M286-F348 HydrophobicContact CG-CZ 3.87Å; M286-F348 HydrophobicContact SD-CE1 4.48Å; M286-F348 HydrophobicContact SD-CZ 4.47Å; L342-F348 HydrophobicContact CB-CB 4.26Å; L342-F348 HydrophobicContact CD2-CB 3.74Å; L342-F348 HydrophobicContact CD2-CD2 4.17Å; L342-F348 HydrophobicContact CD2-CG 4.12Å; L342-F348 CarbonylContact O-C 3.57Å; N345-F348 HydrophobicContact CB-CB 4.35Å; N345-F348 HydrophobicContact CB-CD2 3.88Å; N345-F348 PolarHBondContact O-N 2.92Å; F348-S350 PolarHBondContact O-N 2.98Å; F348-T351 PolarHBondContact O-N 3.45Å; F348-T351 PolarHBondContact O-OG1 3.1Å
349	K	95.1	Very high	95.6	Very high	52 Å²	52	54.4 Å²	54.4	23%	0.226	27%	0.272	C	S	.	.	H	α-helix	trans	-56.2	-28.1	-178	74.1	-178.7	-174.6	175.8	0	114.1	L342 L343 N345 N346 T351 V352 R353 E411 F412	L342-K349 VanDerWaalsContact O-CA 3.24Å; L342-K349 WeakPolarHBondContact O-CA 3.35Å; L342-K349 WeakPolarHBondContact O-CB 3.41Å; L342-K349 PolarHBondContact O-N 2.9Å; L343-K349 VanDerWaalsContact O-CB 3.32Å; L343-K349 WeakPolarHBondContact O-CB 3.29Å; N345-K349 WeakPolarHBondContact O-CB 3.46Å; N345-K349 PolarHBondContact O-N 3.09Å; N346-K349 VanDerWaalsContact OD1-CE 3.24Å; N346-K349 WeakPolarHBondContact OD1-CE 3.27Å; N346-K349 PolarHBondContact OD1-NZ 3.29Å; K349-T351 PolarHBondContact O-N 3.47Å; K349-V352 PolarHBondContact O-N 2.88Å; K349-R353 PolarHBondContact O-N 3.47Å; K349-E411 WeakPolarHBondContact CD-OE1 3.41Å; K349-E411 WeakPolarHBondContact CE-OE1 3.44Å; K349-E411 IonicContact NZ-OE1 3.64Å; K349-E411 PolarHBondContact NZ-OE1 3.35Å; K349-F412 HydrophobicContact CB-CZ 4.02Å; K349-F412 HydrophobicContact CG-CZ 4.29Å; K349-F412 WeakPolarHBondContact O-CZ 3.42Å
350	S	95.1	Very high	95.7	Very high	55 Å²	55	53.9 Å²	53.9	39%	0.385	27%	0.268	S	S	.	.	H	α-helix	trans	-61.6	-27.2	174	72.7	0	0	0	0	114.1	F348 K354	F348-S350 PolarHBondContact O-N 2.98Å; S350-K354 WeakPolarHBondContact O-CG 3.03Å; S350-K354 PolarHBondContact O-N 2.9Å
351	T	95.1	Very high	95.7	Very high	44 Å²	44	52.6 Å²	52.6	27%	0.27	26%	0.262	S	S	.	.	H	α-helix	trans	-74.4	-37.2	176.1	65.7	0	0	0	0	111.1	L290 F348 K349 K354 A355	L290-T351 HydrophobicContact CD1-CG2 3.83Å; F348-T351 PolarHBondContact O-N 3.45Å; F348-T351 PolarHBondContact O-OG1 3.1Å; K349-T351 PolarHBondContact O-N 3.47Å; T351-K354 PolarHBondContact O-N 2.89Å; T351-A355 WeakPolarHBondContact O-CB 3.39Å; T351-A355 PolarHBondContact O-N 3.19Å
352	V	96.9	Very high	95.8	Very high	6 Å²	6	54.5 Å²	54.5	4%	0.036	27%	0.268	C	S	.	.	H	α-helix	trans	-63.9	-48	172.8	-179.5	0	0	0	0	109.8	V339 L342 L343 K349 K354 A355 L356 L359 V408 F412	V339-V352 HydrophobicContact CG1-CG1 4.24Å; V339-V352 HydrophobicContact CG1-CG2 4.24Å; L342-V352 HydrophobicContact CB-CG2 3.75Å; L342-V352 HydrophobicContact CD1-CG2 4.26Å; L343-V352 HydrophobicContact CD1-CG1 4.33Å; K349-V352 PolarHBondContact O-N 2.88Å; V352-K354 VanDerWaalsContact C-N 3.25Å; V352-K354 PolarHBondContact O-N 2.98Å; V352-A355 CarbonylContact O-C 3.57Å; V352-A355 PolarHBondContact O-N 2.95Å; V352-L356 HydrophobicContact CG1-CD2 4.41Å; V352-L356 WeakPolarHBondContact O-CG 3.36Å; V352-L356 PolarHBondContact O-N 3.4Å; V352-L356 VanDerWaalsContact O-N 3.1Å; V352-L359 HydrophobicContact CG1-CD2 3.88Å; V352-V408 HydrophobicContact CG1-CG1 4.04Å; V352-F412 HydrophobicContact CB-CE2 4.39Å; V352-F412 HydrophobicContact CG1-CE2 4.32Å
353	R	97	Very high	95.9	Very high	120 Å²	120	54.3 Å²	54.3	45%	0.453	27%	0.267	S	S	.	.	H	α-helix	trans	-51.6	-42.3	175.8	-168	-178.9	-171.4	167	5.3	112.8	K349 A355 L356 F412 E415	K349-R353 PolarHBondContact O-N 3.47Å; R353-A355 VanDerWaalsContact C-N 3.34Å; R353-L356 HydrophobicContact CG-CD1 4.44Å; R353-L356 WeakPolarHBondContact O-CD1 3.25Å; R353-L356 WeakPolarHBondContact O-CG 3.29Å; R353-F412 HydrophobicContact CB-CD1 4.15Å; R353-F412 HydrophobicContact CB-CD2 4.17Å; R353-F412 HydrophobicContact CB-CE1 3.93Å; R353-F412 HydrophobicContact CB-CE2 3.92Å; R353-F412 HydrophobicContact CB-CG 4.27Å; R353-F412 HydrophobicContact CB-CZ 3.81Å; R353-F412 HydrophobicContact CG-CD1 3.86Å; R353-F412 HydrophobicContact CG-CD2 4.4Å; R353-F412 HydrophobicContact CG-CE1 4.09Å; R353-F412 HydrophobicContact CG-CG 4.04Å; R353-F412 HydrophobicContact CG-CZ 4.44Å; R353-E415 HydrophobicContact CG-CG 4.23Å; R353-E415 IonicContact CZ-OE1 3.77Å; R353-E415 IonicContact NE-OE1 2.77Å; R353-E415 PolarHBondContact NE-OE1 3.33Å; R353-E415 IonicContact NH2-OE1 2.68Å; R353-E415 PolarHBondContact NH2-OE1 3.38Å; R353-E415 IonicContact NH2-OE2 3.69Å
354	K	95.9	Very high	96	Very high	174 Å²	174	53.5 Å²	53.5	76%	0.757	26%	0.263	S	S	*	.	H	α-helix	trans	-71.5	-27.2	178.5	-72.5	174.8	-174.9	176.8	0	113.4	S350 T351 V352	S350-K354 WeakPolarHBondContact O-CG 3.03Å; S350-K354 PolarHBondContact O-N 2.9Å; T351-K354 PolarHBondContact O-N 2.89Å; V352-K354 VanDerWaalsContact C-N 3.25Å; V352-K354 PolarHBondContact O-N 2.98Å
355	A	96.3	Very high	96.2	Very high	36 Å²	36	48.3 Å²	48.3	30%	0.298	24%	0.239	S	C	.	.	H	α-helix	trans	-92.1	-6.2	-177.1	0	0	0	0	0	113.8	T351 V352 R353 P357 E358 L359	T351-A355 WeakPolarHBondContact O-CB 3.39Å; T351-A355 PolarHBondContact O-N 3.19Å; V352-A355 CarbonylContact O-C 3.57Å; V352-A355 PolarHBondContact O-N 2.95Å; R353-A355 VanDerWaalsContact C-N 3.34Å; A355-P357 VanDerWaalsContact C-CD 3.42Å; A355-P357 VanDerWaalsContact O-N 3.14Å; A355-E358 PolarHBondContact O-N 3.37Å; A355-E358 VanDerWaalsContact O-N 3.12Å; A355-L359 WeakPolarHBondContact O-CB 3.4Å; A355-L359 PolarHBondContact O-N 3.24Å
356	L	97.4	Very high	96.5	Very high	1 Å²	1	47 Å²	47	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-46	-45.7	-173.5	-69.3	171.8	0	0	0	115.1	V352 R353 E358 L359 I360 V408 F412 E415 A419	V352-L356 HydrophobicContact CG1-CD2 4.41Å; V352-L356 WeakPolarHBondContact O-CG 3.36Å; V352-L356 PolarHBondContact O-N 3.4Å; V352-L356 VanDerWaalsContact O-N 3.1Å; R353-L356 HydrophobicContact CG-CD1 4.44Å; R353-L356 WeakPolarHBondContact O-CD1 3.25Å; R353-L356 WeakPolarHBondContact O-CG 3.29Å; L356-E358 PolarHBondContact O-N 2.69Å; L356-L359 PolarHBondContact O-N 3.31Å; L356-I360 HydrophobicContact CB-CD1 4.47Å; L356-I360 HydrophobicContact CD2-CD1 4.49Å; L356-I360 WeakPolarHBondContact O-CB 3.44Å; L356-I360 VanDerWaalsContact O-CG1 3.31Å; L356-I360 WeakPolarHBondContact O-CG1 3.31Å; L356-I360 PolarHBondContact O-N 2.86Å; L356-V408 HydrophobicContact CD2-CB 3.76Å; L356-V408 HydrophobicContact CD2-CG1 4.16Å; L356-V408 HydrophobicContact CD2-CG2 3.96Å; L356-F412 HydrophobicContact CD1-CB 3.89Å; L356-F412 HydrophobicContact CD1-CD2 4.03Å; L356-F412 HydrophobicContact CD1-CG 4.26Å; L356-F412 HydrophobicContact CD2-CD2 4.32Å; L356-E415 HydrophobicContact CD1-CB 3.6Å; L356-A419 HydrophobicContact CB-CB 3.66Å
357	P	96.1	Very high	96.9	Very high	62 Å²	62	41 Å²	41	40%	0.403	20%	0.201	S	C	.	.	H	α-helix	trans	-59.6	-43.2	-177.8	-25.3	35.7	0	0	0	113.6	A355 Y361 A419	A355-P357 VanDerWaalsContact C-CD 3.42Å; A355-P357 VanDerWaalsContact O-N 3.14Å; P357-Y361 WeakPolarHBondContact O-CB 3.38Å; P357-Y361 PolarHBondContact O-N 2.8Å; P357-A419 HydrophobicContact CB-CB 4.35Å; P357-A419 HydrophobicContact CG-CB 4.03Å
358	E	97.6	Very high	97.3	Very high	84 Å²	84	35.7 Å²	35.7	39%	0.393	18%	0.178	S	C	.	.	H	α-helix	trans	-79.9	-39.9	177.6	-67.3	-66.7	136.9	0	0	110.8	W294 A355 L356 I360 Y361 Y362 R426	W294-E358 HydrophobicContact CH2-CB 3.52Å; W294-E358 HydrophobicContact CZ2-CB 3.58Å; W294-E358 HydrophobicContact CZ2-CG 4.48Å; A355-E358 PolarHBondContact O-N 3.37Å; A355-E358 VanDerWaalsContact O-N 3.12Å; L356-E358 PolarHBondContact O-N 2.69Å; E358-I360 PolarHBondContact O-N 3Å; E358-Y361 WeakPolarHBondContact O-CB 3.29Å; E358-Y361 PolarHBondContact O-N 2.96Å; E358-Y362 VanDerWaalsContact O-CD2 3.27Å; E358-Y362 WeakPolarHBondContact O-CD2 3.18Å; E358-Y362 PolarHBondContact O-N 3.43Å; E358-R426 IonicContact OE1-NH1 3.36Å; E358-R426 PolarHBondContact OE1-NH1 3.42Å; E358-R426 IonicContact OE2-NH1 2.95Å
359	L	98.1	Very high	97.4	Very high	5 Å²	5	35.3 Å²	35.3	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-58.6	-49.5	-180	175.8	62.1	0	0	0	110.9	W294 L297 V339 V352 A355 L356 Y361 Y362 I363	W294-L359 HydrophobicContact CZ3-CB 4.23Å; W294-L359 HydrophobicContact CZ3-CD1 4.36Å; L297-L359 HydrophobicContact CD1-CD1 3.93Å; V339-L359 HydrophobicContact CG1-CD2 4.03Å; V352-L359 HydrophobicContact CG1-CD2 3.88Å; A355-L359 WeakPolarHBondContact O-CB 3.4Å; A355-L359 PolarHBondContact O-N 3.24Å; L356-L359 PolarHBondContact O-N 3.31Å; L359-Y361 VanDerWaalsContact C-N 3.29Å; L359-Y361 PolarHBondContact O-N 3.19Å; L359-Y362 PolarHBondContact O-N 3.17Å; L359-Y362 VanDerWaalsContact O-N 3.16Å; L359-I363 HydrophobicContact CD1-CD1 4.16Å; L359-I363 HydrophobicContact CD1-CG1 4.33Å; L359-I363 HydrophobicContact CD2-CD1 4.47Å; L359-I363 HydrophobicContact CG-CD1 3.84Å; L359-I363 HydrophobicContact CG-CG1 4.43Å; L359-I363 WeakPolarHBondContact O-CG1 3.33Å; L359-I363 PolarHBondContact O-N 3.17Å
360	I	98.6	Very high	97.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.7	-35.5	178.8	-66.3	177.3	0	0	0	111.1	L356 E358 Y362 I363 I364 L405 V408 A419 L420 A423	L356-I360 HydrophobicContact CB-CD1 4.47Å; L356-I360 HydrophobicContact CD2-CD1 4.49Å; L356-I360 WeakPolarHBondContact O-CB 3.44Å; L356-I360 VanDerWaalsContact O-CG1 3.31Å; L356-I360 WeakPolarHBondContact O-CG1 3.31Å; L356-I360 PolarHBondContact O-N 2.86Å; E358-I360 PolarHBondContact O-N 3Å; I360-Y362 VanDerWaalsContact C-N 3.34Å; I360-Y362 PolarHBondContact O-N 3.35Å; I360-I363 PolarHBondContact O-N 3.33Å; I360-I364 HydrophobicContact CG2-CD1 4.22Å; I360-I364 WeakPolarHBondContact O-CG1 3.15Å; I360-I364 PolarHBondContact O-N 3.17Å; I360-L405 HydrophobicContact CD1-CD1 4.07Å; I360-L405 HydrophobicContact CG1-CD1 4.1Å; I360-L405 HydrophobicContact CG2-CD1 4.11Å; I360-V408 HydrophobicContact CD1-CG2 4.48Å; I360-A419 HydrophobicContact CD1-CB 3.83Å; I360-L420 HydrophobicContact CD1-CB 4.29Å; I360-L420 HydrophobicContact CG2-CB 4.09Å; I360-L420 HydrophobicContact CG2-CD1 3.49Å; I360-L420 VanDerWaalsContact CG2-CD1 3.49Å; I360-L420 HydrophobicContact CG2-CG 4.38Å; I360-A423 HydrophobicContact CB-CB 4.47Å; I360-A423 HydrophobicContact CG2-CB 4.07Å
361	Y	98.7	Very high	97.5	Very high	21 Å²	21	33.7 Å²	33.7	8%	0.082	16%	0.164	C	C	.	.	H	α-helix	trans	-57.7	-45.9	173	174.5	-87.4	0	0	0	111.6	P357 E358 L359 L365 R426 H427 E430	P357-Y361 WeakPolarHBondContact O-CB 3.38Å; P357-Y361 PolarHBondContact O-N 2.8Å; E358-Y361 WeakPolarHBondContact O-CB 3.29Å; E358-Y361 PolarHBondContact O-N 2.96Å; L359-Y361 VanDerWaalsContact C-N 3.29Å; L359-Y361 PolarHBondContact O-N 3.19Å; Y361-L365 HydrophobicContact CE1-CD1 4.27Å; Y361-R426 HydrophobicContact CD2-CB 4.49Å; Y361-R426 HydrophobicContact CD2-CG 4.24Å; Y361-R426 HydrophobicContact CE2-CB 4.46Å; Y361-R426 HydrophobicContact CE2-CG 3.83Å; Y361-H427 AromaticContact CD2-CD2 3.56Å; Y361-H427 AromaticContact CD2-CE1 3.4Å; Y361-H427 VanDerWaalsContact CD2-CE1 3.4Å; Y361-H427 WeakPolarHBondContact CD2-CE1 3.29Å; Y361-H427 AromaticContact CD2-CG 4Å; Y361-H427 AromaticContact CD2-ND1 3.92Å; Y361-H427 AromaticContact CD2-NE2 3.15Å; Y361-H427 WeakPolarHBondContact CD2-NE2 3.43Å; Y361-H427 AromaticContact CE1-CE1 3.99Å; Y361-H427 AromaticContact CE2-CD2 3.88Å; Y361-H427 AromaticContact CE2-CE1 3.13Å; Y361-H427 WeakPolarHBondContact CE2-CE1 3.48Å; Y361-H427 AromaticContact CE2-CG 3.86Å; Y361-H427 AromaticContact CE2-ND1 3.41Å; Y361-H427 WeakPolarHBondContact CE2-ND1 3.47Å; Y361-H427 AromaticContact CE2-NE2 3.44Å; Y361-H427 WeakPolarHBondContact CE2-NE2 3.11Å; Y361-H427 AromaticContact CG-CE1 3.94Å; Y361-H427 AromaticContact CG-NE2 3.56Å; Y361-H427 AromaticContact CZ-CE1 3.45Å; Y361-H427 VanDerWaalsContact CZ-CE1 3.45Å; Y361-H427 AromaticContact CZ-ND1 3.95Å; Y361-H427 PolarHBondContact O-CE1 3.2Å; Y361-H427 PolarHBondContact O-NE2 2.96Å; Y361-E430 PolarHBondContact OH-OE1 2.91Å; Y361-E430 PolarHBondContact OH-OE2 3.31Å
362	Y	98.6	Very high	97.4	Very high	48 Å²	48	34.8 Å²	34.8	19%	0.188	17%	0.168	C	C	.	.	H	α-helix	trans	-74.4	-33	177	-76.1	-81.4	0	0	0	113.4	W294 L297 T298 A301 E358 L359 I360 I364 L365 Y366	W294-Y362 AromaticContact CH2-CD2 3.99Å; W294-Y362 HydrophobicContact CH2-CD2 3.99Å; W294-Y362 HydrophobicContact CH2-CE2 4.41Å; W294-Y362 HydrophobicContact CZ2-CD2 4.01Å; W294-Y362 AromaticContact CZ2-CE2 3.97Å; W294-Y362 HydrophobicContact CZ2-CE2 3.97Å; L297-Y362 HydrophobicContact CD2-CD1 4.47Å; L297-Y362 HydrophobicContact CD2-CD2 4.43Å; L297-Y362 HydrophobicContact CD2-CG 3.93Å; T298-Y362 HydrophobicContact CG2-CD1 3.99Å; T298-Y362 HydrophobicContact CG2-CD2 3.71Å; T298-Y362 HydrophobicContact CG2-CE1 3.63Å; T298-Y362 HydrophobicContact CG2-CE2 3.36Å; T298-Y362 HydrophobicContact CG2-CG 4.03Å; A301-Y362 HydrophobicContact CB-CD1 3.7Å; A301-Y362 HydrophobicContact CB-CE1 4.35Å; E358-Y362 VanDerWaalsContact O-CD2 3.27Å; E358-Y362 WeakPolarHBondContact O-CD2 3.18Å; E358-Y362 PolarHBondContact O-N 3.43Å; L359-Y362 PolarHBondContact O-N 3.17Å; L359-Y362 VanDerWaalsContact O-N 3.16Å; I360-Y362 VanDerWaalsContact C-N 3.34Å; I360-Y362 PolarHBondContact O-N 3.35Å; Y362-I364 VanDerWaalsContact C-N 3.28Å; Y362-I364 PolarHBondContact O-N 3.09Å; Y362-L365 HydrophobicContact CD1-CD1 3.83Å; Y362-L365 HydrophobicContact CE1-CD1 4.2Å; Y362-L365 WeakPolarHBondContact O-CB 3.1Å; Y362-L365 PolarHBondContact O-N 2.96Å; Y362-Y366 VanDerWaalsContact O-CD2 3.27Å; Y362-Y366 WeakPolarHBondContact O-CD2 3.38Å; Y362-Y366 PolarHBondContact O-N 3.04Å
363	I	98.7	Very high	97.4	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.01	17%	0.172	C	C	.	.	H	α-helix	trans	-55.4	-45.6	172.2	-75.2	170.4	0	0	0	110.5	L359 I360 L365 Y366 M367 A401 L404 L405	L359-I363 HydrophobicContact CD1-CD1 4.16Å; L359-I363 HydrophobicContact CD1-CG1 4.33Å; L359-I363 HydrophobicContact CD2-CD1 4.47Å; L359-I363 HydrophobicContact CG-CD1 3.84Å; L359-I363 HydrophobicContact CG-CG1 4.43Å; L359-I363 WeakPolarHBondContact O-CG1 3.33Å; L359-I363 PolarHBondContact O-N 3.17Å; I360-I363 PolarHBondContact O-N 3.33Å; I363-L365 PolarHBondContact O-N 3.44Å; I363-Y366 PolarHBondContact O-N 2.94Å; I363-M367 HydrophobicContact CG2-CG 4.18Å; I363-M367 HydrophobicContact CG2-SD 3.75Å; I363-M367 WeakPolarHBondContact O-CG 3.41Å; I363-M367 PolarHBondContact O-N 2.95Å; I363-A401 HydrophobicContact CG2-CB 4.2Å; I363-A401 VanDerWaalsContact CG2-O 3.24Å; I363-A401 WeakPolarHBondContact CG2-O 3.49Å; I363-L404 HydrophobicContact CD1-CB 4.43Å; I363-L404 HydrophobicContact CD1-CD2 3.83Å; I363-L404 HydrophobicContact CD1-CG 3.86Å; I363-L404 HydrophobicContact CG1-CD2 4.18Å; I363-L405 HydrophobicContact CG2-CB 4.16Å
364	I	98.8	Very high	97.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-58.8	-33	177.4	-70.2	165.9	0	0	0	112	I360 Y362 M367 L420 A423 A448 A452	I360-I364 HydrophobicContact CG2-CD1 4.22Å; I360-I364 WeakPolarHBondContact O-CG1 3.15Å; I360-I364 PolarHBondContact O-N 3.17Å; Y362-I364 VanDerWaalsContact C-N 3.28Å; Y362-I364 PolarHBondContact O-N 3.09Å; I364-M367 PolarHBondContact O-N 3.45Å; I364-L420 HydrophobicContact CD1-CD1 3.91Å; I364-A423 HydrophobicContact CD1-CB 4.22Å; I364-A448 HydrophobicContact CG2-CB 3.93Å; I364-A448 WeakPolarHBondContact O-CB 3.39Å; I364-A452 HydrophobicContact CD1-CB 4.44Å; I364-A452 HydrophobicContact CG1-CB 4.02Å
365	L	98.5	Very high	97.4	Very high	25 Å²	25	30 Å²	30	13%	0.131	15%	0.153	C	C	.	.	H	α-helix	trans	-66.6	-40	176	-64.4	177.7	0	0	0	112	A301 V305 Y361 Y362 I363 M367 Q368 I445	A301-L365 HydrophobicContact CB-CD1 4.42Å; V305-L365 HydrophobicContact CG2-CB 4.32Å; Y361-L365 HydrophobicContact CE1-CD1 4.27Å; Y362-L365 HydrophobicContact CD1-CD1 3.83Å; Y362-L365 HydrophobicContact CE1-CD1 4.2Å; Y362-L365 WeakPolarHBondContact O-CB 3.1Å; Y362-L365 PolarHBondContact O-N 2.96Å; I363-L365 PolarHBondContact O-N 3.44Å; L365-M367 VanDerWaalsContact C-N 3.32Å; L365-Q368 PolarHBondContact O-N 2.94Å; L365-Q368 PolarHBondContact O-NE2 3.27Å; L365-I445 HydrophobicContact CD2-CD1 3.72Å
366	Y	98.5	Very high	97.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-72.3	-25.9	175.9	-72.6	-68	0	0	0	113.2	L297 S300 A301 Y304 V332 F336 Y362 I363 Q368 V397	L297-Y366 HydrophobicContact CD2-CE2 4.46Å; L297-Y366 PolarHBondContact O-OH 2.98Å; S300-Y366 VanDerWaalsContact C-OH 3.24Å; S300-Y366 WeakPolarHBondContact CB-OH 3.37Å; A301-Y366 VanDerWaalsContact CA-CZ 3.46Å; A301-Y366 WeakPolarHBondContact CA-OH 3.45Å; A301-Y366 HydrophobicContact CB-CD2 4.36Å; A301-Y366 HydrophobicContact CB-CE1 4.23Å; A301-Y366 HydrophobicContact CB-CE2 3.64Å; A301-Y366 PolarHBondContact N-OH 3.14Å; Y304-Y366 AromaticContact CD1-CD1 3.58Å; Y304-Y366 HydrophobicContact CD1-CD1 3.58Å; Y304-Y366 HydrophobicContact CD1-CE1 4.11Å; Y304-Y366 HydrophobicContact CE1-CD1 4.09Å; Y304-Y366 AromaticContact CG-CD1 3.98Å; Y304-Y366 HydrophobicContact CG-CD1 3.98Å; Y304-Y366 HydrophobicContact CG-CE1 4.06Å; V332-Y366 HydrophobicContact CB-CE1 4.38Å; V332-Y366 HydrophobicContact CG1-CD1 3.81Å; V332-Y366 HydrophobicContact CG1-CE1 3.53Å; V332-Y366 HydrophobicContact CG1-CG 4.49Å; V332-Y366 HydrophobicContact CG2-CE1 3.86Å; F336-Y366 AromaticContact CE1-CD2 3.91Å; F336-Y366 HydrophobicContact CE1-CD2 3.91Å; F336-Y366 HydrophobicContact CE1-CE2 4.1Å; F336-Y366 HydrophobicContact CE1-CG 4.36Å; F336-Y366 HydrophobicContact CZ-CD1 4.23Å; F336-Y366 AromaticContact CZ-CD2 3.74Å; F336-Y366 HydrophobicContact CZ-CD2 3.74Å; F336-Y366 HydrophobicContact CZ-CE2 4.23Å; F336-Y366 AromaticContact CZ-CG 3.73Å; F336-Y366 HydrophobicContact CZ-CG 3.73Å; Y362-Y366 VanDerWaalsContact O-CD2 3.27Å; Y362-Y366 WeakPolarHBondContact O-CD2 3.38Å; Y362-Y366 PolarHBondContact O-N 3.04Å; I363-Y366 PolarHBondContact O-N 2.94Å; Y366-Q368 PolarHBondContact O-N 2.75Å; Y366-V397 HydrophobicContact CD1-CG1 3.63Å; Y366-V397 HydrophobicContact CG-CG1 4.19Å
367	M	98.6	Very high	97.4	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-8	174.9	-68.8	176	70.7	0	0	113.1	I363 I364 L365 R398 A401 Q402 L405 A448 L451 A452	I363-M367 HydrophobicContact CG2-CG 4.18Å; I363-M367 HydrophobicContact CG2-SD 3.75Å; I363-M367 WeakPolarHBondContact O-CG 3.41Å; I363-M367 PolarHBondContact O-N 2.95Å; I364-M367 PolarHBondContact O-N 3.45Å; L365-M367 VanDerWaalsContact C-N 3.32Å; M367-R398 WeakPolarHBondContact O-CG 3.28Å; M367-R398 PolarHBondContact O-NH1 3.39Å; M367-A401 HydrophobicContact CG-CB 3.69Å; M367-Q402 HydrophobicContact CE-CB 3.95Å; M367-Q402 HydrophobicContact CE-CG 4.21Å; M367-L405 HydrophobicContact SD-CD2 4.26Å; M367-A448 HydrophobicContact CB-CB 4.24Å; M367-L451 HydrophobicContact CE-CB 4.19Å; M367-L451 HydrophobicContact CE-CD2 3.48Å; M367-L451 VanDerWaalsContact CE-CD2 3.48Å; M367-L451 HydrophobicContact CE-CG 3.51Å; M367-A452 HydrophobicContact CE-CB 3.99Å; M367-A452 HydrophobicContact SD-CB 4.07Å
368	Q	98.6	Very high	97.4	Very high	6 Å²	6	33.4 Å²	33.4	3%	0.028	17%	0.168	C	C	.	.	S	Bend	trans	-64.1	138.9	-179.6	-71.3	173.8	93	0	0	112.4	V309 L365 Y366 T370 K444 I445 A448	V309-Q368 HydrophobicContact CG1-CB 3.66Å; V309-Q368 HydrophobicContact CG2-CB 4.27Å; L365-Q368 PolarHBondContact O-N 2.94Å; L365-Q368 PolarHBondContact O-NE2 3.27Å; Y366-Q368 PolarHBondContact O-N 2.75Å; Q368-T370 PolarHBondContact O-N 3.4Å; Q368-K444 HydrophobicContact CB-CB 4.34Å; Q368-K444 HydrophobicContact CG-CB 4.19Å; Q368-I445 HydrophobicContact CG-CD1 4.24Å; Q368-A448 HydrophobicContact CG-CB 3.97Å
369	I	97.9	Very high	97.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-60.2	129.7	172.2	-171.5	-177.8	0	0	0	111.6	Q373 V374 W377 W443 K444 F493	I369-Q373 HydrophobicContact CG1-CB 3.93Å; I369-V374 HydrophobicContact CD1-CG2 3.48Å; I369-V374 VanDerWaalsContact CD1-CG2 3.48Å; I369-V374 HydrophobicContact CG1-CG2 3.91Å; I369-W377 HydrophobicContact CD1-CE3 3.54Å; I369-W377 HydrophobicContact CD1-CH2 4.44Å; I369-W377 HydrophobicContact CD1-CZ3 3.32Å; I369-W377 HydrophobicContact CG1-CE3 4.1Å; I369-W377 HydrophobicContact CG1-CH2 4.25Å; I369-W377 HydrophobicContact CG1-CZ3 3.54Å; I369-W443 HydrophobicContact CG2-CH2 3.7Å; I369-W443 HydrophobicContact CG2-CZ3 3.72Å; I369-K444 HydrophobicContact CG2-CD 4.23Å; I369-K444 HydrophobicContact CG2-CG 3.94Å; I369-K444 WeakPolarHBondContact O-CD 3.4Å; I369-K444 VanDerWaalsContact O-CE 3.31Å; I369-K444 WeakPolarHBondContact O-CE 3.46Å; I369-K444 PolarHBondContact O-NZ 2.71Å; I369-F493 HydrophobicContact CD1-CB 4.01Å; I369-F493 HydrophobicContact CD1-CD1 3.96Å; I369-F493 HydrophobicContact CD1-CD2 4.05Å; I369-F493 HydrophobicContact CD1-CE1 4.48Å; I369-F493 HydrophobicContact CD1-CG 3.72Å
370	T	96.9	Very high	97.3	Very high	11 Å²	11	36.4 Å²	36.4	7%	0.067	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-84.4	160.7	178.3	72.8	0	0	0	0	112.5	Y304 V309 Q368 D372 Q373 V374	Y304-T370 WeakPolarHBondContact OH-CG2 3.48Å; V309-T370 HydrophobicContact CG2-CG2 4.45Å; Q368-T370 PolarHBondContact O-N 3.4Å; T370-D372 PolarHBondContact O-N 3.03Å; T370-Q373 PolarHBondContact O-N 2.96Å; T370-Q373 WeakPolarHBondContact OG1-CB 3.28Å; T370-Q373 WeakPolarHBondContact OG1-CG 3.29Å; T370-Q373 PolarHBondContact OG1-N 3.15Å; T370-Q373 VanDerWaalsContact OG1-N 3.07Å; T370-V374 WeakPolarHBondContact O-CG2 3.32Å; T370-V374 PolarHBondContact O-N 3.46Å
371	E	94.8	Very high	97.2	Very high	63 Å²	63	37.4 Å²	37.4	29%	0.294	21%	0.205	S	C	.	.	H	α-helix	trans	-63.1	-33.2	174.4	-69.3	-58.7	130.3	0	0	112.1	V309 Y311 V374 K375 K444	V309-E371 PolarHBondContact O-N 3.44Å; Y311-E371 HydrophobicContact CD2-CB 3.89Å; Y311-E371 HydrophobicContact CD2-CG 4.33Å; Y311-E371 HydrophobicContact CE2-CB 4.45Å; E371-V374 WeakPolarHBondContact O-CB 3.35Å; E371-V374 PolarHBondContact O-N 2.9Å; E371-K375 WeakPolarHBondContact O-CB 3.39Å; E371-K375 PolarHBondContact O-N 3.49Å; E371-K444 WeakPolarHBondContact OE1-CE 3.3Å; E371-K444 IonicContact OE1-NZ 3.34Å; E371-K444 PolarHBondContact OE1-NZ 2.98Å
372	D	93.3	Very high	97	Very high	67 Å²	67	38 Å²	38	36%	0.358	21%	0.209	S	C	.	.	H	α-helix	trans	-67.9	-42.6	174.5	-77.6	-33.3	0	0	0	112.1	Y311 T370 V374 K375 V376	Y311-D372 WeakPolarHBondContact CE2-OD2 3.25Å; Y311-D372 PolarHBondContact OH-OD2 2.73Å; T370-D372 PolarHBondContact O-N 3.03Å; D372-V374 PolarHBondContact O-N 3.4Å; D372-K375 WeakPolarHBondContact O-CB 3.5Å; D372-K375 PolarHBondContact O-N 2.89Å; D372-V376 WeakPolarHBondContact O-CB 3.45Å; D372-V376 VanDerWaalsContact O-CG2 3.3Å; D372-V376 WeakPolarHBondContact O-CG2 3.2Å; D372-V376 PolarHBondContact O-N 3.46Å
373	Q	96.4	Very high	96.9	Very high	24 Å²	24	38.1 Å²	38.1	11%	0.112	21%	0.211	C	C	.	.	H	α-helix	trans	-59.8	-45.7	172.6	-76.2	173.1	-32.5	0	0	111.2	I369 T370 K375 V376 W377	I369-Q373 HydrophobicContact CG1-CB 3.93Å; T370-Q373 PolarHBondContact O-N 2.96Å; T370-Q373 WeakPolarHBondContact OG1-CB 3.28Å; T370-Q373 WeakPolarHBondContact OG1-CG 3.29Å; T370-Q373 PolarHBondContact OG1-N 3.15Å; T370-Q373 VanDerWaalsContact OG1-N 3.07Å; Q373-K375 VanDerWaalsContact C-N 3.27Å; Q373-K375 PolarHBondContact O-N 3.36Å; Q373-V376 PolarHBondContact O-N 3.48Å; Q373-W377 HydrophobicContact CB-CD2 4.21Å; Q373-W377 HydrophobicContact CB-CE3 4.25Å; Q373-W377 HydrophobicContact CB-CH2 4.15Å; Q373-W377 HydrophobicContact CB-CZ2 4.09Å; Q373-W377 HydrophobicContact CB-CZ3 4.24Å; Q373-W377 HydrophobicContact CG-CH2 4.37Å; Q373-W377 HydrophobicContact CG-CZ2 4.07Å; Q373-W377 VanDerWaalsContact O-CB 3.26Å; Q373-W377 WeakPolarHBondContact O-CB 3.43Å; Q373-W377 PolarHBondContact O-N 2.8Å
374	V	96.8	Very high	96.8	Very high	29 Å²	29	38.6 Å²	38.6	18%	0.176	21%	0.213	C	C	.	.	H	α-helix	trans	-53.4	-46.6	174	165.4	0	0	0	0	110.9	I369 T370 E371 D372 T378 W443 F493	I369-V374 HydrophobicContact CD1-CG2 3.48Å; I369-V374 VanDerWaalsContact CD1-CG2 3.48Å; I369-V374 HydrophobicContact CG1-CG2 3.91Å; T370-V374 WeakPolarHBondContact O-CG2 3.32Å; T370-V374 PolarHBondContact O-N 3.46Å; E371-V374 WeakPolarHBondContact O-CB 3.35Å; E371-V374 PolarHBondContact O-N 2.9Å; D372-V374 PolarHBondContact O-N 3.4Å; V374-T378 WeakPolarHBondContact O-CB 3.18Å; V374-T378 PolarHBondContact O-N 3.47Å; V374-T378 PolarHBondContact O-OG1 2.8Å; V374-W443 HydrophobicContact CG2-CH2 4.44Å; V374-F493 HydrophobicContact CB-CE2 4.25Å; V374-F493 HydrophobicContact CG1-CE2 3.93Å; V374-F493 HydrophobicContact CG2-CD2 4.14Å; V374-F493 HydrophobicContact CG2-CE2 4.15Å
375	K	96.3	Very high	96.7	Very high	147 Å²	147	38.9 Å²	38.9	64%	0.639	21%	0.214	S	C	*	.	H	α-helix	trans	-67.4	-46.1	-179.2	-176.6	-177.2	175.4	-170.9	0	112.2	E371 D372 Q373 A379	E371-K375 WeakPolarHBondContact O-CB 3.39Å; E371-K375 PolarHBondContact O-N 3.49Å; D372-K375 WeakPolarHBondContact O-CB 3.5Å; D372-K375 PolarHBondContact O-N 2.89Å; Q373-K375 VanDerWaalsContact C-N 3.27Å; Q373-K375 PolarHBondContact O-N 3.36Å; K375-A379 WeakPolarHBondContact O-CB 3.36Å; K375-A379 PolarHBondContact O-N 2.94Å
376	V	96.6	Very high	96.6	Very high	71 Å²	71	41.5 Å²	41.5	43%	0.43	23%	0.226	S	C	.	.	H	α-helix	trans	-63	-51.5	179.4	170.4	0	0	0	0	110.4	D372 Q373 T378 A379 N380 Q383	D372-V376 WeakPolarHBondContact O-CB 3.45Å; D372-V376 VanDerWaalsContact O-CG2 3.3Å; D372-V376 WeakPolarHBondContact O-CG2 3.2Å; D372-V376 PolarHBondContact O-N 3.46Å; Q373-V376 PolarHBondContact O-N 3.48Å; V376-T378 VanDerWaalsContact C-N 3.33Å; V376-T378 PolarHBondContact O-N 2.96Å; V376-A379 PolarHBondContact O-N 2.97Å; V376-A379 VanDerWaalsContact O-N 3.1Å; V376-N380 PolarHBondContact O-N 3.15Å; V376-Q383 HydrophobicContact CG1-CB 4.38Å; V376-Q383 HydrophobicContact CG1-CG 3.92Å
377	W	97.8	Very high	96.4	Very high	8 Å²	8	42.7 Å²	42.7	3%	0.03	23%	0.233	C	C	.	.	H	α-helix	trans	-67.5	-31.4	-178.3	-63.6	-18.4	0	0	0	113.2	I369 Q373 N380 F384 D387 E388 F493	I369-W377 HydrophobicContact CD1-CE3 3.54Å; I369-W377 HydrophobicContact CD1-CH2 4.44Å; I369-W377 HydrophobicContact CD1-CZ3 3.32Å; I369-W377 HydrophobicContact CG1-CE3 4.1Å; I369-W377 HydrophobicContact CG1-CH2 4.25Å; I369-W377 HydrophobicContact CG1-CZ3 3.54Å; Q373-W377 HydrophobicContact CB-CD2 4.21Å; Q373-W377 HydrophobicContact CB-CE3 4.25Å; Q373-W377 HydrophobicContact CB-CH2 4.15Å; Q373-W377 HydrophobicContact CB-CZ2 4.09Å; Q373-W377 HydrophobicContact CB-CZ3 4.24Å; Q373-W377 HydrophobicContact CG-CH2 4.37Å; Q373-W377 HydrophobicContact CG-CZ2 4.07Å; Q373-W377 VanDerWaalsContact O-CB 3.26Å; Q373-W377 WeakPolarHBondContact O-CB 3.43Å; Q373-W377 PolarHBondContact O-N 2.8Å; W377-N380 CarbonylContact O-C 3.57Å; W377-F384 HydrophobicContact CB-CB 3.95Å; W377-F384 HydrophobicContact CB-CD2 4.03Å; W377-F384 HydrophobicContact CB-CG 4.37Å; W377-F384 AromaticContact CD2-CD2 3.78Å; W377-F384 HydrophobicContact CD2-CD2 3.78Å; W377-F384 AromaticContact CE3-CD2 3.82Å; W377-F384 HydrophobicContact CE3-CD2 3.82Å; W377-F384 HydrophobicContact CE3-CE2 4.14Å; W377-F384 HydrophobicContact CG-CB 4.04Å; W377-F384 AromaticContact CG-CD2 3.87Å; W377-F384 HydrophobicContact CG-CD2 3.87Å; W377-F384 HydrophobicContact CG-CG 4.44Å; W377-F384 HydrophobicContact CZ3-CD2 4.47Å; W377-F384 HydrophobicContact CZ3-CE2 4.47Å; W377-D387 HydrophobicContact CZ2-CB 4.05Å; W377-D387 PolarHBondContact NE1-OD2 3.19Å; W377-E388 HydrophobicContact CH2-CG 4.15Å; W377-E388 VanDerWaalsContact CH2-OE1 3.24Å; W377-E388 WeakPolarHBondContact CH2-OE1 3.48Å; W377-E388 HydrophobicContact CZ2-CG 4.32Å; W377-F493 HydrophobicContact CB-CE1 3.74Å; W377-F493 HydrophobicContact CB-CZ 3.84Å; W377-F493 HydrophobicContact CD2-CE1 4.44Å; W377-F493 AromaticContact CE3-CD1 4Å; W377-F493 HydrophobicContact CE3-CD1 4Å; W377-F493 AromaticContact CE3-CE1 3.74Å; W377-F493 HydrophobicContact CE3-CE1 3.74Å; W377-F493 HydrophobicContact CE3-CZ 4.46Å; W377-F493 HydrophobicContact CG-CE1 4.5Å
378	T	96.3	Very high	96.3	Very high	91 Å²	91	44 Å²	44	56%	0.558	24%	0.238	S	C	*	.	H	α-helix	trans	-69.4	-36.5	172.5	-59.6	0	0	0	0	111.6	V374 V376	V374-T378 WeakPolarHBondContact O-CB 3.18Å; V374-T378 PolarHBondContact O-N 3.47Å; V374-T378 PolarHBondContact O-OG1 2.8Å; V376-T378 VanDerWaalsContact C-N 3.33Å; V376-T378 PolarHBondContact O-N 2.96Å
379	A	96.8	Very high	96.1	Very high	86 Å²	86	46.4 Å²	46.4	71%	0.711	25%	0.252	S	S	*	.	H	α-helix	trans	-78.6	-34.3	-179.6	0	0	0	0	0	113	K375 V376	K375-A379 WeakPolarHBondContact O-CB 3.36Å; K375-A379 PolarHBondContact O-N 2.94Å; V376-A379 PolarHBondContact O-N 2.97Å; V376-A379 VanDerWaalsContact O-N 3.1Å
380	N	96.5	Very high	95.5	Very high	65 Å²	65	51.6 Å²	51.6	35%	0.348	28%	0.28	S	S	.	.			trans	-131.4	94.7	-178.8	-173.4	7.7	0	0	0	111.5	V376 W377 Q382 Q383 F384	V376-N380 PolarHBondContact O-N 3.15Å; W377-N380 CarbonylContact O-C 3.57Å; N380-Q382 PolarHBondContact O-N 3.43Å; N380-Q382 WeakPolarHBondContact OD1-CB 3.31Å; N380-Q382 PolarHBondContact OD1-N 2.84Å; N380-Q382 VanDerWaalsContact OD1-N 3.14Å; N380-Q383 HydrophobicContact CB-CB 4.06Å; N380-Q383 WeakPolarHBondContact O-CB 3.47Å; N380-Q383 PolarHBondContact O-N 3.03Å; N380-F384 PolarHBondContact O-N 3.44Å
381	P	96.1	Very high	95.1	Very high	22 Å²	22	57.8 Å²	57.8	14%	0.143	31%	0.312	C	S	.	.	H	α-helix	trans	-61.6	-22.2	176	-26.2	36.7	0	0	0	114.8	F384 V385 P531 I535 F575	P381-F384 PolarHBondContact O-N 3.16Å; P381-V385 WeakPolarHBondContact O-CG2 3.47Å; P381-V385 PolarHBondContact O-N 3.44Å; P381-P531 HydrophobicContact CB-CB 3.67Å; P381-P531 HydrophobicContact CB-CG 4.45Å; P381-P531 HydrophobicContact CG-CB 3.53Å; P381-P531 HydrophobicContact CG-CG 3.78Å; P381-I535 HydrophobicContact CB-CD1 3.94Å; P381-F575 HydrophobicContact CB-CE1 4.15Å; P381-F575 HydrophobicContact CG-CE1 4.2Å
382	Q	94.4	Very high	94.9	Very high	33 Å²	33	56.3 Å²	56.3	15%	0.154	31%	0.307	C	S	.	.	H	α-helix	trans	-69.4	-44.1	175.2	-56.1	-64.2	8.4	0	0	110.6	N380 F384 V385 E386 S576 E578 V579	N380-Q382 PolarHBondContact O-N 3.43Å; N380-Q382 WeakPolarHBondContact OD1-CB 3.31Å; N380-Q382 PolarHBondContact OD1-N 2.84Å; N380-Q382 VanDerWaalsContact OD1-N 3.14Å; Q382-F384 PolarHBondContact O-N 3.45Å; Q382-V385 WeakPolarHBondContact O-CB 3.37Å; Q382-V385 PolarHBondContact O-N 3Å; Q382-E386 PolarHBondContact O-N 3.35Å; Q382-S576 PolarHBondContact NE2-O 3.03Å; Q382-S576 PolarHBondContact OE1-O 2.91Å; Q382-E578 WeakPolarHBondContact CB-OE2 3.37Å; Q382-E578 PolarHBondContact OE1-OE2 3.47Å; Q382-V579 VanDerWaalsContact OE1-CG2 3.24Å
383	Q	96.1	Very high	94.8	Very high	51 Å²	51	61.7 Å²	61.7	24%	0.238	33%	0.328	C	S	.	.	H	α-helix	trans	-59.4	-35.5	174.8	-164.1	67.7	48.9	0	0	111.5	V376 N380 E386 D387	V376-Q383 HydrophobicContact CG1-CB 4.38Å; V376-Q383 HydrophobicContact CG1-CG 3.92Å; N380-Q383 HydrophobicContact CB-CB 4.06Å; N380-Q383 WeakPolarHBondContact O-CB 3.47Å; N380-Q383 PolarHBondContact O-N 3.03Å; Q383-E386 PolarHBondContact O-N 2.73Å; Q383-D387 WeakPolarHBondContact CG-OD2 3.47Å; Q383-D387 PolarHBondContact NE2-OD1 3.28Å; Q383-D387 VanDerWaalsContact O-CB 3.24Å; Q383-D387 WeakPolarHBondContact O-CB 3.46Å; Q383-D387 VanDerWaalsContact O-CG 3.22Å; Q383-D387 PolarHBondContact O-N 2.84Å
384	F	97.8	Very high	94.5	Very high	12 Å²	12	61.9 Å²	61.9	5%	0.053	33%	0.332	C	S	.	.	H	α-helix	trans	-64.2	-38.2	174	176.4	-107.1	0	0	0	112.6	W377 N380 P381 Q382 E388 F493 S532 I535	W377-F384 HydrophobicContact CB-CB 3.95Å; W377-F384 HydrophobicContact CB-CD2 4.03Å; W377-F384 HydrophobicContact CB-CG 4.37Å; W377-F384 AromaticContact CD2-CD2 3.78Å; W377-F384 HydrophobicContact CD2-CD2 3.78Å; W377-F384 AromaticContact CE3-CD2 3.82Å; W377-F384 HydrophobicContact CE3-CD2 3.82Å; W377-F384 HydrophobicContact CE3-CE2 4.14Å; W377-F384 HydrophobicContact CG-CB 4.04Å; W377-F384 AromaticContact CG-CD2 3.87Å; W377-F384 HydrophobicContact CG-CD2 3.87Å; W377-F384 HydrophobicContact CG-CG 4.44Å; W377-F384 HydrophobicContact CZ3-CD2 4.47Å; W377-F384 HydrophobicContact CZ3-CE2 4.47Å; N380-F384 PolarHBondContact O-N 3.44Å; P381-F384 PolarHBondContact O-N 3.16Å; Q382-F384 PolarHBondContact O-N 3.45Å; F384-E388 HydrophobicContact CD2-CG 4.05Å; F384-E388 HydrophobicContact CE2-CB 4.38Å; F384-E388 HydrophobicContact CE2-CG 3.76Å; F384-E388 HydrophobicContact CZ-CG 4.43Å; F384-E388 VanDerWaalsContact O-CB 3.31Å; F384-E388 WeakPolarHBondContact O-CB 3.3Å; F384-E388 PolarHBondContact O-N 3.2Å; F384-F493 HydrophobicContact CD2-CE1 4.13Å; F384-F493 HydrophobicContact CE2-CD1 4.08Å; F384-F493 HydrophobicContact CE2-CE1 4.13Å; F384-S532 WeakPolarHBondContact CE1-O 3Å; F384-I535 HydrophobicContact CD1-CB 4.23Å; F384-I535 HydrophobicContact CD1-CD1 4.05Å; F384-I535 HydrophobicContact CD1-CG2 3.94Å; F384-I535 HydrophobicContact CE1-CB 4.09Å; F384-I535 HydrophobicContact CE1-CG2 3.82Å
385	V	96.8	Very high	94.2	Very high	5 Å²	5	67.6 Å²	67.6	3%	0.03	35%	0.351	C	S	.	.	H	α-helix	trans	-65.7	-48.1	175.6	178.6	0	0	0	0	109.7	P381 Q382 D389 I535 R539 E578 V579 L582	P381-V385 WeakPolarHBondContact O-CG2 3.47Å; P381-V385 PolarHBondContact O-N 3.44Å; Q382-V385 WeakPolarHBondContact O-CB 3.37Å; Q382-V385 PolarHBondContact O-N 3Å; V385-D389 WeakPolarHBondContact O-CB 3.08Å; V385-D389 PolarHBondContact O-N 3.22Å; V385-I535 HydrophobicContact CG2-CD1 3.87Å; V385-I535 HydrophobicContact CG2-CG1 4.21Å; V385-I535 HydrophobicContact CG2-CG2 3.69Å; V385-R539 PolarHBondContact O-NH2 3.15Å; V385-E578 HydrophobicContact CB-CB 4.15Å; V385-E578 HydrophobicContact CG1-CB 3.92Å; V385-V579 HydrophobicContact CG2-CB 4.41Å; V385-V579 HydrophobicContact CG2-CG2 3.52Å; V385-L582 HydrophobicContact CG1-CD2 4.49Å
386	E	95.3	Very high	94.2	Very high	80 Å²	80	61.8 Å²	61.8	37%	0.374	33%	0.329	S	S	.	.	H	α-helix	trans	-63.6	-47.9	-178.3	-174.4	-178.4	174	0	0	112.5	Q382 Q383 E388 D389 T392	Q382-E386 PolarHBondContact O-N 3.35Å; Q383-E386 PolarHBondContact O-N 2.73Å; E386-E388 PolarHBondContact O-N 3.23Å; E386-D389 PolarHBondContact O-N 3.06Å; E386-T392 WeakPolarHBondContact O-CB 3.3Å; E386-T392 PolarHBondContact O-OG1 2.78Å
387	D	95.6	Very high	94.2	Very high	26 Å²	26	58.4 Å²	58.4	14%	0.139	31%	0.309	C	S	.	.	H	α-helix	trans	-72	-27.3	-177.3	-71.6	-8.4	0	0	0	113.4	W377 Q383 S394	W377-D387 HydrophobicContact CZ2-CB 4.05Å; W377-D387 PolarHBondContact NE1-OD2 3.19Å; Q383-D387 WeakPolarHBondContact CG-OD2 3.47Å; Q383-D387 PolarHBondContact NE2-OD1 3.28Å; Q383-D387 VanDerWaalsContact O-CB 3.24Å; Q383-D387 WeakPolarHBondContact O-CB 3.46Å; Q383-D387 VanDerWaalsContact O-CG 3.22Å; Q383-D387 PolarHBondContact O-N 2.84Å; D387-S394 WeakPolarHBondContact OD1-CB 3.28Å; D387-S394 PolarHBondContact OD1-OG 3.45Å
388	E	96	Very high	94.2	Very high	26 Å²	26	58.2 Å²	58.2	12%	0.121	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107	19.5	179.6	-68.6	-82.7	163	0	0	111.9	W377 F384 E386 R398 R497	W377-E388 HydrophobicContact CH2-CG 4.15Å; W377-E388 VanDerWaalsContact CH2-OE1 3.24Å; W377-E388 WeakPolarHBondContact CH2-OE1 3.48Å; W377-E388 HydrophobicContact CZ2-CG 4.32Å; F384-E388 HydrophobicContact CD2-CG 4.05Å; F384-E388 HydrophobicContact CE2-CB 4.38Å; F384-E388 HydrophobicContact CE2-CG 3.76Å; F384-E388 HydrophobicContact CZ-CG 4.43Å; F384-E388 VanDerWaalsContact O-CB 3.31Å; F384-E388 WeakPolarHBondContact O-CB 3.3Å; F384-E388 PolarHBondContact O-N 3.2Å; E386-E388 PolarHBondContact O-N 3.23Å; E388-R398 IonicContact OE1-CZ 2.66Å; E388-R398 IonicContact OE1-NE 3.39Å; E388-R398 PolarHBondContact OE1-NE 2.89Å; E388-R398 VanDerWaalsContact OE1-NE 3.11Å; E388-R398 IonicContact OE1-NH2 3.79Å; E388-R398 PolarHBondContact OE1-NH2 3.01Å; E388-R398 IonicContact OE2-NH2 2.68Å; E388-R497 IonicContact OE1-NH2 3.96Å; E388-R497 IonicContact OE2-CZ 3.45Å; E388-R497 IonicContact OE2-NH1 3.58Å; E388-R497 IonicContact OE2-NH2 2.74Å; E388-R497 PolarHBondContact OE2-NH2 2.84Å
389	D	93.2	Very high	94.3	Very high	57 Å²	57	55 Å²	55	31%	0.305	29%	0.287	S	S	.	.	S	Bend	trans	-78.6	146.3	163.3	-146.2	-73.5	0	0	0	110.5	V385 E386 D391 T392 R539	V385-D389 WeakPolarHBondContact O-CB 3.08Å; V385-D389 PolarHBondContact O-N 3.22Å; E386-D389 PolarHBondContact O-N 3.06Å; D389-D391 PolarHBondContact O-N 3.02Å; D389-D391 PolarHBondContact OD1-N 2.78Å; D389-T392 WeakPolarHBondContact O-CB 3.33Å; D389-T392 WeakPolarHBondContact O-CG2 3.35Å; D389-T392 PolarHBondContact O-N 3.15Å; D389-R539 IonicContact OD2-CZ 3.29Å; D389-R539 VanDerWaalsContact OD2-CZ 3.3Å; D389-R539 IonicContact OD2-NH1 2.87Å; D389-R539 PolarHBondContact OD2-NH1 3.22Å; D389-R539 IonicContact OD2-NH2 3.82Å; D389-R539 PolarHBondContact OD2-NH2 3.42Å
390	D	85.9	Confident	94.3	Very high	110 Å²	110	51.1 Å²	51.1	59%	0.588	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-26.5	-179.4	-72.4	-20.2	0	0	0	110.4
391	D	88.1	Confident	94.4	Very high	140 Å²	140	48 Å²	48	75%	0.749	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.5	29	178.8	-64.2	-43.8	0	0	0	113.3	D389	D389-D391 PolarHBondContact O-N 3.02Å; D389-D391 PolarHBondContact OD1-N 2.78Å
392	T	91.7	Very high	94.5	Very high	32 Å²	32	48.3 Å²	48.3	20%	0.196	24%	0.238	C	C	.	.			trans	-64.7	144.7	-177.4	-169.5	0	0	0	0	113.9	E386 D389 S394 I399	E386-T392 WeakPolarHBondContact O-CB 3.3Å; E386-T392 PolarHBondContact O-OG1 2.78Å; D389-T392 WeakPolarHBondContact O-CB 3.33Å; D389-T392 WeakPolarHBondContact O-CG2 3.35Å; D389-T392 PolarHBondContact O-N 3.15Å; T392-S394 WeakPolarHBondContact OG1-CB 3.46Å; T392-S394 PolarHBondContact OG1-N 3.3Å; T392-S394 VanDerWaalsContact OG1-N 3.15Å; T392-I399 HydrophobicContact CG2-CD1 3.9Å
393	F	90.4	Very high	94.7	Very high	181 Å²	181	50.1 Å²	50.1	79%	0.794	25%	0.248	S	C	*	.			trans	-89	-5.7	168.9	-62	-64.7	0	0	0	113.1
394	S	90.6	Very high	94.8	Very high	28 Å²	28	47.7 Å²	47.7	20%	0.196	24%	0.237	C	C	.	.			trans	-65.1	138	179	-75.1	0	0	0	0	110.8	D387 T392 I399	D387-S394 WeakPolarHBondContact OD1-CB 3.28Å; D387-S394 PolarHBondContact OD1-OG 3.45Å; T392-S394 WeakPolarHBondContact OG1-CB 3.46Å; T392-S394 PolarHBondContact OG1-N 3.3Å; T392-S394 VanDerWaalsContact OG1-N 3.15Å; S394-I399 WeakPolarHBondContact O-CD1 3.34Å
395	Y	91.1	Very high	94.8	Very high	149 Å²	149	47.1 Å²	47.1	58%	0.584	24%	0.235	S	C	*	.			trans	-120.7	115.6	178.5	-168.3	-104	0	0	0	110.1	F333 S400	F333-Y395 AromaticContact CD1-CE1 3.5Å; F333-Y395 HydrophobicContact CD1-CE1 3.5Å; F333-Y395 AromaticContact CD1-CZ 3.67Å; F333-Y395 WeakPolarHBondContact CD1-OH 3.36Å; F333-Y395 AromaticContact CD2-CE1 3.84Å; F333-Y395 HydrophobicContact CD2-CE1 3.84Å; F333-Y395 AromaticContact CE1-CD1 3.98Å; F333-Y395 HydrophobicContact CE1-CD1 3.98Å; F333-Y395 AromaticContact CE1-CE1 3.38Å; F333-Y395 HydrophobicContact CE1-CE1 3.38Å; F333-Y395 AromaticContact CE1-CZ 3.81Å; F333-Y395 HydrophobicContact CE2-CD1 4.18Å; F333-Y395 AromaticContact CE2-CE1 3.75Å; F333-Y395 HydrophobicContact CE2-CE1 3.75Å; F333-Y395 AromaticContact CG-CE1 3.76Å; F333-Y395 HydrophobicContact CG-CE1 3.76Å; F333-Y395 AromaticContact CZ-CD1 3.82Å; F333-Y395 HydrophobicContact CZ-CD1 3.82Å; F333-Y395 AromaticContact CZ-CE1 3.53Å; F333-Y395 HydrophobicContact CZ-CE1 3.53Å; Y395-S400 WeakPolarHBondContact CE2-OG 3.28Å; Y395-S400 PolarHBondContact OH-OG 3.09Å
396	S	95.4	Very high	94.9	Very high	25 Å²	25	50.1 Å²	50.1	18%	0.175	25%	0.25	C	S	.	.			trans	-146.6	162.4	179.3	69.4	0	0	0	0	110.2	R398 I399 S400	S396-R398 PolarHBondContact O-N 3.29Å; S396-R398 VanDerWaalsContact O-N 3.16Å; S396-I399 PolarHBondContact O-N 3.12Å; S396-I399 PolarHBondContact OG-N 3.05Å; S396-S400 PolarHBondContact O-N 3.41Å; S396-S400 PolarHBondContact O-OG 3.32Å; S396-S400 VanDerWaalsContact O-OG 3.12Å
397	V	96.9	Very high	95	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-54.7	-36.5	177.2	171.7	0	0	0	0	111.8	Y304 E329 V332 F333 F336 Y366 A401	Y304-V397 HydrophobicContact CD1-CG1 4.44Å; Y304-V397 HydrophobicContact CE1-CB 4.49Å; Y304-V397 HydrophobicContact CE1-CG1 3.83Å; Y304-V397 HydrophobicContact CE2-CB 4.05Å; Y304-V397 HydrophobicContact CE2-CG1 3.98Å; Y304-V397 HydrophobicContact CE2-CG2 4.02Å; E329-V397 HydrophobicContact CB-CG2 4Å; E329-V397 HydrophobicContact CG-CG2 4.11Å; V332-V397 HydrophobicContact CB-CG2 4.29Å; V332-V397 HydrophobicContact CG1-CG1 3.77Å; V332-V397 HydrophobicContact CG1-CG2 4.22Å; F333-V397 HydrophobicContact CE1-CB 4.46Å; F333-V397 HydrophobicContact CE1-CG2 3.89Å; F333-V397 HydrophobicContact CZ-CG2 3.94Å; F336-V397 HydrophobicContact CE2-CG1 4.27Å; F336-V397 HydrophobicContact CZ-CG1 4.48Å; Y366-V397 HydrophobicContact CD1-CG1 3.63Å; Y366-V397 HydrophobicContact CG-CG1 4.19Å; V397-A401 WeakPolarHBondContact O-CB 3.49Å; V397-A401 PolarHBondContact O-N 3.44Å
398	R	98	Very high	95.1	Very high	3 Å²	3	46.4 Å²	46.4	1%	0.011	24%	0.237	C	C	.	.	H	α-helix	trans	-62.1	-48.6	176.3	171.6	174.8	171.4	103.8	-13.4	112.1	M367 E388 S396 A401 Q402 E447	M367-R398 WeakPolarHBondContact O-CG 3.28Å; M367-R398 PolarHBondContact O-NH1 3.39Å; E388-R398 IonicContact OE1-CZ 2.66Å; E388-R398 IonicContact OE1-NE 3.39Å; E388-R398 PolarHBondContact OE1-NE 2.89Å; E388-R398 VanDerWaalsContact OE1-NE 3.11Å; E388-R398 IonicContact OE1-NH2 3.79Å; E388-R398 PolarHBondContact OE1-NH2 3.01Å; E388-R398 IonicContact OE2-NH2 2.68Å; S396-R398 PolarHBondContact O-N 3.29Å; S396-R398 VanDerWaalsContact O-N 3.16Å; R398-A401 PolarHBondContact O-N 3.48Å; R398-Q402 PolarHBondContact O-N 3.4Å; R398-Q402 VanDerWaalsContact O-N 3.11Å; R398-E447 IonicContact CZ-OE1 2.99Å; R398-E447 IonicContact CZ-OE2 2.64Å; R398-E447 IonicContact NH1-OE1 2.89Å; R398-E447 IonicContact NH1-OE2 3.78Å; R398-E447 PolarHBondContact NH1-OE2 2.72Å; R398-E447 IonicContact NH2-OE1 2.8Å; R398-E447 PolarHBondContact NH2-OE1 3.4Å; R398-E447 IonicContact NH2-OE2 2.71Å; R398-E447 PolarHBondContact NH2-OE2 3.22Å
399	I	97.2	Very high	95.1	Very high	23 Å²	23	45.4 Å²	45.4	12%	0.118	23%	0.233	C	C	.	.	H	α-helix	trans	-68.9	-47.4	-178.8	-64.7	167.8	0	0	0	109.8	T392 S394 S396 A401 Q402 D403	T392-I399 HydrophobicContact CG2-CD1 3.9Å; S394-I399 WeakPolarHBondContact O-CD1 3.34Å; S396-I399 PolarHBondContact O-N 3.12Å; S396-I399 PolarHBondContact OG-N 3.05Å; I399-A401 VanDerWaalsContact C-N 3.26Å; I399-A401 PolarHBondContact O-N 2.95Å; I399-Q402 CarbonylContact O-C 3.47Å; I399-Q402 WeakPolarHBondContact O-CA 3.33Å; I399-Q402 WeakPolarHBondContact O-CB 3.43Å; I399-Q402 PolarHBondContact O-N 2.69Å; I399-D403 PolarHBondContact O-N 3.19Å
400	S	97.7	Very high	95.2	Very high	5 Å²	5	46.1 Å²	46.1	4%	0.035	25%	0.247	C	C	.	.	H	α-helix	trans	-62	-32.6	177.9	-50.9	0	0	0	0	113.3	F333 Y395 S396 L404	F333-S400 WeakPolarHBondContact CE1-OG 3.3Å; Y395-S400 WeakPolarHBondContact CE2-OG 3.28Å; Y395-S400 PolarHBondContact OH-OG 3.09Å; S396-S400 PolarHBondContact O-N 3.41Å; S396-S400 PolarHBondContact O-OG 3.32Å; S396-S400 VanDerWaalsContact O-OG 3.12Å; S400-L404 WeakPolarHBondContact O-CB 3.46Å; S400-L404 PolarHBondContact O-N 3.39Å
401	A	98.5	Very high	95.7	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-68.5	-38.4	172.7	0	0	0	0	0	111.7	F336 I363 M367 V397 R398 I399 L404 L405	F336-A401 HydrophobicContact CE2-CB 3.98Å; F336-A401 HydrophobicContact CZ-CB 3.95Å; I363-A401 HydrophobicContact CG2-CB 4.2Å; I363-A401 VanDerWaalsContact CG2-O 3.24Å; I363-A401 WeakPolarHBondContact CG2-O 3.49Å; M367-A401 HydrophobicContact CG-CB 3.69Å; V397-A401 WeakPolarHBondContact O-CB 3.49Å; V397-A401 PolarHBondContact O-N 3.44Å; R398-A401 PolarHBondContact O-N 3.48Å; I399-A401 VanDerWaalsContact C-N 3.26Å; I399-A401 PolarHBondContact O-N 2.95Å; A401-L404 PolarHBondContact O-N 3.01Å; A401-L405 PolarHBondContact O-N 3.15Å
402	Q	98.3	Very high	96.1	Very high	29 Å²	29	38.8 Å²	38.8	14%	0.136	20%	0.204	C	C	.	.	H	α-helix	trans	-64.9	-42.8	172.2	-178.4	172.7	-14.9	0	0	111.7	M367 R398 I399 L404 L405 L406 S455	M367-Q402 HydrophobicContact CE-CB 3.95Å; M367-Q402 HydrophobicContact CE-CG 4.21Å; R398-Q402 PolarHBondContact O-N 3.4Å; R398-Q402 VanDerWaalsContact O-N 3.11Å; I399-Q402 CarbonylContact O-C 3.47Å; I399-Q402 WeakPolarHBondContact O-CA 3.33Å; I399-Q402 WeakPolarHBondContact O-CB 3.43Å; I399-Q402 PolarHBondContact O-N 2.69Å; Q402-L404 VanDerWaalsContact C-N 3.31Å; Q402-L404 PolarHBondContact O-N 3.42Å; Q402-L405 WeakPolarHBondContact O-CA 3.5Å; Q402-L405 VanDerWaalsContact O-CB 3.31Å; Q402-L405 WeakPolarHBondContact O-CB 3.45Å; Q402-L405 PolarHBondContact O-N 3.01Å; Q402-L405 VanDerWaalsContact O-N 3.09Å; Q402-L406 HydrophobicContact CG-CD1 4.3Å; Q402-L406 HydrophobicContact CG-CG 4.5Å; Q402-L406 WeakPolarHBondContact O-CG 3.44Å; Q402-L406 PolarHBondContact O-N 3.3Å; Q402-S455 PolarHBondContact NE2-OG 3.06Å
403	D	97.9	Very high	96.2	Very high	70 Å²	70	42.3 Å²	42.3	37%	0.374	22%	0.219	S	C	.	.	H	α-helix	trans	-61	-41.9	176.7	-64	-23	0	0	0	111.4	I399 L405 L406 A407	I399-D403 PolarHBondContact O-N 3.19Å; D403-L405 VanDerWaalsContact C-N 3.33Å; D403-L405 PolarHBondContact O-N 3.02Å; D403-L406 PolarHBondContact O-N 3.48Å; D403-A407 WeakPolarHBondContact O-CB 3.22Å; D403-A407 PolarHBondContact O-N 3.33Å
404	L	98.1	Very high	96.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.5	-38.8	174.6	-178.4	59.6	0	0	0	111.8	F336 V339 I363 S400 A401 Q402 A407 V408	F336-L404 HydrophobicContact CB-CD2 4.29Å; F336-L404 HydrophobicContact CD1-CD2 3.78Å; F336-L404 HydrophobicContact CE1-CD2 4.45Å; F336-L404 HydrophobicContact CG-CD2 4.21Å; V339-L404 HydrophobicContact CB-CD1 4.14Å; V339-L404 HydrophobicContact CB-CD2 4.24Å; V339-L404 HydrophobicContact CG1-CD1 3.79Å; V339-L404 HydrophobicContact CG1-CD2 4.24Å; I363-L404 HydrophobicContact CD1-CB 4.43Å; I363-L404 HydrophobicContact CD1-CD2 3.83Å; I363-L404 HydrophobicContact CD1-CG 3.86Å; I363-L404 HydrophobicContact CG1-CD2 4.18Å; S400-L404 WeakPolarHBondContact O-CB 3.46Å; S400-L404 PolarHBondContact O-N 3.39Å; A401-L404 PolarHBondContact O-N 3.01Å; Q402-L404 VanDerWaalsContact C-N 3.31Å; Q402-L404 PolarHBondContact O-N 3.42Å; L404-A407 PolarHBondContact O-N 2.81Å; L404-V408 HydrophobicContact CD1-CG1 4.39Å; L404-V408 WeakPolarHBondContact O-CG2 3.37Å; L404-V408 PolarHBondContact O-N 2.87Å; L404-V408 VanDerWaalsContact O-N 3.08Å
405	L	98.5	Very high	96.7	Very high	1 Å²	1	39 Å²	39	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-61.7	-46.1	172.9	177.3	64	0	0	0	111.4	I360 I363 M367 A401 Q402 D403 A407 V408 A409 A452 V456	I360-L405 HydrophobicContact CD1-CD1 4.07Å; I360-L405 HydrophobicContact CG1-CD1 4.1Å; I360-L405 HydrophobicContact CG2-CD1 4.11Å; I363-L405 HydrophobicContact CG2-CB 4.16Å; M367-L405 HydrophobicContact SD-CD2 4.26Å; A401-L405 PolarHBondContact O-N 3.15Å; Q402-L405 WeakPolarHBondContact O-CA 3.5Å; Q402-L405 VanDerWaalsContact O-CB 3.31Å; Q402-L405 WeakPolarHBondContact O-CB 3.45Å; Q402-L405 PolarHBondContact O-N 3.01Å; Q402-L405 VanDerWaalsContact O-N 3.09Å; D403-L405 VanDerWaalsContact C-N 3.33Å; D403-L405 PolarHBondContact O-N 3.02Å; L405-A407 VanDerWaalsContact C-N 3.34Å; L405-V408 VanDerWaalsContact O-CG2 3.31Å; L405-V408 WeakPolarHBondContact O-CG2 3.49Å; L405-V408 PolarHBondContact O-N 3.09Å; L405-A409 WeakPolarHBondContact O-CB 3.45Å; L405-A409 PolarHBondContact O-N 3.39Å; L405-A452 HydrophobicContact CD2-CB 3.64Å; L405-V456 HydrophobicContact CG-CG1 4.45Å
406	L	97.9	Very high	97	Very high	68 Å²	68	32 Å²	32	36%	0.356	18%	0.177	S	C	.	.	H	α-helix	trans	-62	-42.7	178.3	-69.4	173.3	0	0	0	111	Q402 D403 A409 A410 V456	Q402-L406 HydrophobicContact CG-CD1 4.3Å; Q402-L406 HydrophobicContact CG-CG 4.5Å; Q402-L406 WeakPolarHBondContact O-CG 3.44Å; Q402-L406 PolarHBondContact O-N 3.3Å; D403-L406 PolarHBondContact O-N 3.48Å; L406-A409 PolarHBondContact O-N 2.9Å; L406-A410 WeakPolarHBondContact O-CB 3.43Å; L406-A410 PolarHBondContact O-N 3Å; L406-V456 HydrophobicContact CD2-CG1 3.89Å
407	A	97.8	Very high	97.1	Very high	27 Å²	27	30.8 Å²	30.8	22%	0.223	17%	0.169	C	C	.	.	H	α-helix	trans	-62.1	-48.4	178.1	0	0	0	0	0	112.4	L343 D403 L404 L405 A409 A410 E411	L343-A407 HydrophobicContact CD2-CB 3.81Å; D403-A407 WeakPolarHBondContact O-CB 3.22Å; D403-A407 PolarHBondContact O-N 3.33Å; L404-A407 PolarHBondContact O-N 2.81Å; L405-A407 VanDerWaalsContact C-N 3.34Å; A407-A409 VanDerWaalsContact C-N 3.3Å; A407-A409 PolarHBondContact O-N 3.38Å; A407-A410 PolarHBondContact O-N 3.45Å; A407-E411 PolarHBondContact O-N 3.16Å; A407-E411 VanDerWaalsContact O-N 3.07Å
408	V	97.6	Very high	97.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-70.5	-28	177.6	-59.4	0	0	0	0	112.6	L343 V352 L356 I360 L404 L405 F412 S416	L343-V408 HydrophobicContact CD1-CG1 4.35Å; L343-V408 HydrophobicContact CD2-CG1 4.1Å; V352-V408 HydrophobicContact CG1-CG1 4.04Å; L356-V408 HydrophobicContact CD2-CB 3.76Å; L356-V408 HydrophobicContact CD2-CG1 4.16Å; L356-V408 HydrophobicContact CD2-CG2 3.96Å; I360-V408 HydrophobicContact CD1-CG2 4.48Å; L404-V408 HydrophobicContact CD1-CG1 4.39Å; L404-V408 WeakPolarHBondContact O-CG2 3.37Å; L404-V408 PolarHBondContact O-N 2.87Å; L404-V408 VanDerWaalsContact O-N 3.08Å; L405-V408 VanDerWaalsContact O-CG2 3.31Å; L405-V408 WeakPolarHBondContact O-CG2 3.49Å; L405-V408 PolarHBondContact O-N 3.09Å; V408-F412 WeakPolarHBondContact O-CB 3.44Å; V408-F412 PolarHBondContact O-N 3.06Å; V408-S416 PolarHBondContact O-OG 2.83Å
409	A	96.7	Very high	97.2	Very high	6 Å²	6	32.9 Å²	32.9	5%	0.05	19%	0.187	C	C	.	.	H	α-helix	trans	-71.5	-36.3	174.6	0	0	0	0	0	112.2	L405 L406 A407 Q413 V456 I459	L405-A409 WeakPolarHBondContact O-CB 3.45Å; L405-A409 PolarHBondContact O-N 3.39Å; L406-A409 PolarHBondContact O-N 2.9Å; A407-A409 VanDerWaalsContact C-N 3.3Å; A407-A409 PolarHBondContact O-N 3.38Å; A409-Q413 VanDerWaalsContact O-CA 3.25Å; A409-Q413 WeakPolarHBondContact O-CA 3.47Å; A409-Q413 VanDerWaalsContact O-CG 3.28Å; A409-Q413 WeakPolarHBondContact O-CG 3.29Å; A409-Q413 PolarHBondContact O-N 3.16Å; A409-V456 HydrophobicContact CB-CB 4.32Å; A409-V456 HydrophobicContact CB-CG1 3.55Å; A409-I459 HydrophobicContact CB-CD1 3.87Å
410	A	95.8	Very high	97.2	Very high	71 Å²	71	31.8 Å²	31.8	59%	0.587	18%	0.181	S	C	*	.	H	α-helix	trans	-67.3	-47.1	174.2	0	0	0	0	0	111.6	L406 A407	L406-A410 WeakPolarHBondContact O-CB 3.43Å; L406-A410 PolarHBondContact O-N 3Å; A407-A410 PolarHBondContact O-N 3.45Å
411	E	95.9	Very high	97.2	Very high	88 Å²	88	31.6 Å²	31.6	41%	0.411	18%	0.181	S	C	.	.	H	α-helix	trans	-74.2	-37	-177.7	-176.4	66.4	-166.7	0	0	113	L343 K349 A407	L343-E411 HydrophobicContact CD1-CB 4.01Å; L343-E411 HydrophobicContact CD1-CG 3.82Å; L343-E411 HydrophobicContact CG-CB 4.44Å; L343-E411 HydrophobicContact CG-CG 4.4Å; K349-E411 WeakPolarHBondContact CD-OE1 3.41Å; K349-E411 WeakPolarHBondContact CE-OE1 3.44Å; K349-E411 IonicContact NZ-OE1 3.64Å; K349-E411 PolarHBondContact NZ-OE1 3.35Å; A407-E411 PolarHBondContact O-N 3.16Å; A407-E411 VanDerWaalsContact O-N 3.07Å
412	F	96.4	Very high	97.2	Very high	8 Å²	8	34.2 Å²	34.2	4%	0.035	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.1	56.7	-174.2	-51.2	-56.2	0	0	0	112.9	L343 K349 V352 R353 L356 V408 N414 E415 S416	L343-F412 HydrophobicContact CD1-CD2 4.11Å; L343-F412 HydrophobicContact CD1-CE2 3.29Å; L343-F412 HydrophobicContact CD1-CZ 3.8Å; K349-F412 HydrophobicContact CB-CZ 4.02Å; K349-F412 HydrophobicContact CG-CZ 4.29Å; K349-F412 WeakPolarHBondContact O-CZ 3.42Å; V352-F412 HydrophobicContact CB-CE2 4.39Å; V352-F412 HydrophobicContact CG1-CE2 4.32Å; R353-F412 HydrophobicContact CB-CD1 4.15Å; R353-F412 HydrophobicContact CB-CD2 4.17Å; R353-F412 HydrophobicContact CB-CE1 3.93Å; R353-F412 HydrophobicContact CB-CE2 3.92Å; R353-F412 HydrophobicContact CB-CG 4.27Å; R353-F412 HydrophobicContact CB-CZ 3.81Å; R353-F412 HydrophobicContact CG-CD1 3.86Å; R353-F412 HydrophobicContact CG-CD2 4.4Å; R353-F412 HydrophobicContact CG-CE1 4.09Å; R353-F412 HydrophobicContact CG-CG 4.04Å; R353-F412 HydrophobicContact CG-CZ 4.44Å; L356-F412 HydrophobicContact CD1-CB 3.89Å; L356-F412 HydrophobicContact CD1-CD2 4.03Å; L356-F412 HydrophobicContact CD1-CG 4.26Å; L356-F412 HydrophobicContact CD2-CD2 4.32Å; V408-F412 WeakPolarHBondContact O-CB 3.44Å; V408-F412 PolarHBondContact O-N 3.06Å; F412-N414 PolarHBondContact O-N 3.37Å; F412-E415 HydrophobicContact CB-CB 4.31Å; F412-E415 PolarHBondContact O-N 3.14Å; F412-S416 WeakPolarHBondContact O-CB 3.4Å; F412-S416 PolarHBondContact O-N 2.9Å; F412-S416 PolarHBondContact O-OG 3.23Å; F412-S416 VanDerWaalsContact O-OG 3.08Å
413	Q	94.4	Very high	97.2	Very high	107 Å²	107	33 Å²	33	50%	0.5	20%	0.197	S	C	.	.	H	α-helix	trans	-46.6	-55.4	-169.6	-63.1	-179.1	15.1	0	0	115.4	A409 A417 I459	A409-Q413 VanDerWaalsContact O-CA 3.25Å; A409-Q413 WeakPolarHBondContact O-CA 3.47Å; A409-Q413 VanDerWaalsContact O-CG 3.28Å; A409-Q413 WeakPolarHBondContact O-CG 3.29Å; A409-Q413 PolarHBondContact O-N 3.16Å; Q413-A417 WeakPolarHBondContact O-CB 3.48Å; Q413-A417 PolarHBondContact O-N 3.32Å; Q413-I459 HydrophobicContact CB-CG2 4.21Å; Q413-I459 HydrophobicContact CG-CG2 4.34Å
414	N	94.3	Very high	97.2	Very high	74 Å²	74	29.7 Å²	29.7	40%	0.396	18%	0.179	S	C	.	.	H	α-helix	trans	-70.8	-42.5	-174.5	-67.6	-41.6	0	0	0	112	F412 A417 A418 N463 R468	F412-N414 PolarHBondContact O-N 3.37Å; N414-A417 PolarHBondContact O-N 3.25Å; N414-A418 PolarHBondContact O-N 2.98Å; N414-A418 VanDerWaalsContact O-N 3.14Å; N414-N463 PolarHBondContact OD1-OD1 3.32Å; N414-R468 PolarHBondContact OD1-NH1 3.49Å
415	E	96.9	Very high	97.1	Very high	64 Å²	64	32.2 Å²	32.2	30%	0.299	20%	0.195	S	C	.	.	H	α-helix	trans	-67	-41.9	179.1	-66.7	79.6	174.6	0	0	111.5	R353 L356 F412 A417 A418 A419	R353-E415 HydrophobicContact CG-CG 4.23Å; R353-E415 IonicContact CZ-OE1 3.77Å; R353-E415 IonicContact NE-OE1 2.77Å; R353-E415 PolarHBondContact NE-OE1 3.33Å; R353-E415 IonicContact NH2-OE1 2.68Å; R353-E415 PolarHBondContact NH2-OE1 3.38Å; R353-E415 IonicContact NH2-OE2 3.69Å; L356-E415 HydrophobicContact CD1-CB 3.6Å; F412-E415 HydrophobicContact CB-CB 4.31Å; F412-E415 PolarHBondContact O-N 3.14Å; E415-A417 VanDerWaalsContact C-N 3.34Å; E415-A418 PolarHBondContact O-N 3.24Å; E415-A419 WeakPolarHBondContact O-CB 3.46Å; E415-A419 PolarHBondContact O-N 3Å
416	S	97.8	Very high	97.1	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.014	21%	0.211	C	C	.	.	H	α-helix	trans	-64.4	-38.9	176.5	-69.9	0	0	0	0	111.2	V408 F412 A418 A419 L420	V408-S416 PolarHBondContact O-OG 2.83Å; F412-S416 WeakPolarHBondContact O-CB 3.4Å; F412-S416 PolarHBondContact O-N 2.9Å; F412-S416 PolarHBondContact O-OG 3.23Å; F412-S416 VanDerWaalsContact O-OG 3.08Å; S416-A418 PolarHBondContact O-N 2.92Å; S416-A419 PolarHBondContact O-N 3.02Å; S416-L420 WeakPolarHBondContact O-CB 3.48Å; S416-L420 PolarHBondContact O-N 3.23Å
417	A	97.3	Very high	97.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61	-45.4	173.3	0	0	0	0	0	112.2	Q413 N414 E415 A421 I459 I460 N463 V469	Q413-A417 WeakPolarHBondContact O-CB 3.48Å; Q413-A417 PolarHBondContact O-N 3.32Å; N414-A417 PolarHBondContact O-N 3.25Å; E415-A417 VanDerWaalsContact C-N 3.34Å; A417-A421 VanDerWaalsContact O-CB 3.29Å; A417-A421 WeakPolarHBondContact O-CB 3.46Å; A417-A421 PolarHBondContact O-N 3Å; A417-I459 HydrophobicContact CB-CB 4.48Å; A417-I459 HydrophobicContact CB-CD1 4.26Å; A417-I459 HydrophobicContact CB-CG1 4.42Å; A417-I460 HydrophobicContact CB-CD1 4.11Å; A417-N463 HydrophobicContact CB-CB 4.1Å; A417-V469 HydrophobicContact CB-CG2 4.18Å
418	A	97.3	Very high	97.1	Very high	44 Å²	44	33.2 Å²	33.2	36%	0.364	19%	0.189	S	C	.	.	H	α-helix	trans	-66.1	-44	177.6	0	0	0	0	0	112.3	N414 E415 S416 A422 V469	N414-A418 PolarHBondContact O-N 2.98Å; N414-A418 VanDerWaalsContact O-N 3.14Å; E415-A418 PolarHBondContact O-N 3.24Å; S416-A418 PolarHBondContact O-N 2.92Å; A418-A422 PolarHBondContact O-N 3.44Å; A418-A422 VanDerWaalsContact O-N 3.07Å; A418-V469 HydrophobicContact CB-CG2 3.87Å
419	A	98.1	Very high	97	Very high	3 Å²	3	38.9 Å²	38.9	3%	0.025	22%	0.216	C	C	.	.	H	α-helix	trans	-64.4	-47.1	179.6	0	0	0	0	0	111.8	L356 P357 I360 E415 S416 A422 A423	L356-A419 HydrophobicContact CB-CB 3.66Å; P357-A419 HydrophobicContact CB-CB 4.35Å; P357-A419 HydrophobicContact CG-CB 4.03Å; I360-A419 HydrophobicContact CD1-CB 3.83Å; E415-A419 WeakPolarHBondContact O-CB 3.46Å; E415-A419 PolarHBondContact O-N 3Å; S416-A419 PolarHBondContact O-N 3.02Å; A419-A422 PolarHBondContact O-N 3.37Å; A419-A423 WeakPolarHBondContact O-CB 3.28Å; A419-A423 PolarHBondContact O-N 3.4Å
420	L	98.4	Very high	97	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.5	-41.4	177.5	179.1	59.2	0	0	0	111.7	I360 I364 S416 A422 A423 A424 A452 L453 V456 I460	I360-L420 HydrophobicContact CD1-CB 4.29Å; I360-L420 HydrophobicContact CG2-CB 4.09Å; I360-L420 HydrophobicContact CG2-CD1 3.49Å; I360-L420 VanDerWaalsContact CG2-CD1 3.49Å; I360-L420 HydrophobicContact CG2-CG 4.38Å; I364-L420 HydrophobicContact CD1-CD1 3.91Å; S416-L420 WeakPolarHBondContact O-CB 3.48Å; S416-L420 PolarHBondContact O-N 3.23Å; L420-A422 VanDerWaalsContact C-N 3.32Å; L420-A422 PolarHBondContact O-N 3.13Å; L420-A423 PolarHBondContact O-N 3.02Å; L420-A424 VanDerWaalsContact O-CB 3.24Å; L420-A424 WeakPolarHBondContact O-CB 3.49Å; L420-A424 PolarHBondContact O-N 3.38Å; L420-A452 HydrophobicContact CD1-CB 3.99Å; L420-L453 HydrophobicContact CD2-CD2 3.98Å; L420-L453 HydrophobicContact CG-CD2 3.86Å; L420-L453 HydrophobicContact CG-CG 4.48Å; L420-V456 HydrophobicContact CD2-CG2 3.22Å; L420-I460 HydrophobicContact CB-CD1 4.39Å; L420-I460 HydrophobicContact CD2-CD1 4.15Å; L420-I460 HydrophobicContact CD2-CG1 4.39Å; L420-I460 HydrophobicContact CG-CD1 4.42Å
421	A	97.4	Very high	97.1	Very high	2 Å²	2	38.6 Å²	38.6	2%	0.017	20%	0.202	C	C	.	.	H	α-helix	trans	-58.4	-44.2	174.5	0	0	0	0	0	112.1	A417 T425 V469 F471	A417-A421 VanDerWaalsContact O-CB 3.29Å; A417-A421 WeakPolarHBondContact O-CB 3.46Å; A417-A421 PolarHBondContact O-N 3Å; A421-T425 VanDerWaalsContact O-CB 3.3Å; A421-T425 WeakPolarHBondContact O-CB 3.48Å; A421-T425 PolarHBondContact O-N 2.99Å; A421-T425 PolarHBondContact O-OG1 2.97Å; A421-V469 HydrophobicContact CB-CG1 3.58Å; A421-F471 HydrophobicContact CB-CB 3.97Å; A421-F471 HydrophobicContact CB-CD2 3.68Å; A421-F471 HydrophobicContact CB-CE2 4.5Å; A421-F471 HydrophobicContact CB-CG 4.07Å
422	A	97.6	Very high	97	Very high	55 Å²	55	38.1 Å²	38.1	46%	0.455	20%	0.2	S	C	.	.	H	α-helix	trans	-66.9	-46.2	177.3	0	0	0	0	0	112.2	A418 A419 L420 T425 R426	A418-A422 PolarHBondContact O-N 3.44Å; A418-A422 VanDerWaalsContact O-N 3.07Å; A419-A422 PolarHBondContact O-N 3.37Å; L420-A422 VanDerWaalsContact C-N 3.32Å; L420-A422 PolarHBondContact O-N 3.13Å; A422-T425 PolarHBondContact O-N 3.28Å; A422-R426 WeakPolarHBondContact O-CB 3.29Å; A422-R426 PolarHBondContact O-N 3.18Å
423	A	98.3	Very high	96.9	Very high	3 Å²	3	44.4 Å²	44.4	3%	0.025	23%	0.229	C	C	.	.	H	α-helix	trans	-61.6	-48.7	179.1	0	0	0	0	0	111.8	I360 I364 A419 L420 T425 R426 H427	I360-A423 HydrophobicContact CB-CB 4.47Å; I360-A423 HydrophobicContact CG2-CB 4.07Å; I364-A423 HydrophobicContact CD1-CB 4.22Å; A419-A423 WeakPolarHBondContact O-CB 3.28Å; A419-A423 PolarHBondContact O-N 3.4Å; L420-A423 PolarHBondContact O-N 3.02Å; A423-T425 PolarHBondContact O-N 3.04Å; A423-R426 PolarHBondContact O-N 2.96Å; A423-H427 WeakPolarHBondContact O-CB 3.39Å; A423-H427 PolarHBondContact O-CD2 3.08Å; A423-H427 VanDerWaalsContact O-CD2 3.29Å; A423-H427 PolarHBondContact O-N 3.14Å
424	A	98.1	Very high	96.9	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.7	-42.2	177.2	0	0	0	0	0	111.7	L420 R426 H427 L428 L453	L420-A424 VanDerWaalsContact O-CB 3.24Å; L420-A424 WeakPolarHBondContact O-CB 3.49Å; L420-A424 PolarHBondContact O-N 3.38Å; A424-R426 VanDerWaalsContact C-N 3.31Å; A424-R426 PolarHBondContact O-N 2.89Å; A424-H427 PolarHBondContact O-N 2.77Å; A424-L428 WeakPolarHBondContact O-CB 3.35Å; A424-L428 WeakPolarHBondContact O-CD1 3.4Å; A424-L428 WeakPolarHBondContact O-CG 3.2Å; A424-L428 PolarHBondContact O-N 3.05Å; A424-L453 HydrophobicContact CB-CD1 3.91Å; A424-L453 HydrophobicContact CB-CD2 4.43Å; A424-L453 HydrophobicContact CB-CG 4.27Å
425	T	97.4	Very high	96.9	Very high	53 Å²	53	40.6 Å²	40.6	33%	0.325	22%	0.215	S	C	.	.	H	α-helix	trans	-59.4	-43.5	176.2	-60.8	0	0	0	0	111.5	A421 A422 A423 Q429	A421-T425 VanDerWaalsContact O-CB 3.3Å; A421-T425 WeakPolarHBondContact O-CB 3.48Å; A421-T425 PolarHBondContact O-N 2.99Å; A421-T425 PolarHBondContact O-OG1 2.97Å; A422-T425 PolarHBondContact O-N 3.28Å; A423-T425 PolarHBondContact O-N 3.04Å; T425-Q429 VanDerWaalsContact O-CG 3.31Å; T425-Q429 WeakPolarHBondContact O-CG 3.38Å; T425-Q429 PolarHBondContact O-N 3.07Å
426	R	97.9	Very high	96.7	Very high	92 Å²	92	43.2 Å²	43.2	35%	0.347	23%	0.231	S	C	.	.	H	α-helix	trans	-63.9	-49.3	176.9	178.9	179	170.3	-170.9	-8.7	111.5	E358 Y361 A422 A423 A424 L428 Q429 E430	E358-R426 IonicContact OE1-NH1 3.36Å; E358-R426 PolarHBondContact OE1-NH1 3.42Å; E358-R426 IonicContact OE2-NH1 2.95Å; Y361-R426 HydrophobicContact CD2-CB 4.49Å; Y361-R426 HydrophobicContact CD2-CG 4.24Å; Y361-R426 HydrophobicContact CE2-CB 4.46Å; Y361-R426 HydrophobicContact CE2-CG 3.83Å; A422-R426 WeakPolarHBondContact O-CB 3.29Å; A422-R426 PolarHBondContact O-N 3.18Å; A423-R426 PolarHBondContact O-N 2.96Å; A424-R426 VanDerWaalsContact C-N 3.31Å; A424-R426 PolarHBondContact O-N 2.89Å; R426-L428 VanDerWaalsContact C-N 3.35Å; R426-L428 PolarHBondContact O-N 2.88Å; R426-Q429 WeakPolarHBondContact O-CB 3.29Å; R426-Q429 PolarHBondContact O-N 2.95Å; R426-E430 WeakPolarHBondContact CG-OE1 3.48Å; R426-E430 IonicContact CZ-OE1 3.67Å; R426-E430 IonicContact NE-OE1 2.85Å; R426-E430 PolarHBondContact NE-OE1 3.39Å; R426-E430 IonicContact NH2-OE1 3.58Å; R426-E430 WeakPolarHBondContact O-CG 3.25Å; R426-E430 PolarHBondContact O-N 3.04Å
427	H	98.4	Very high	96.5	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-57.5	-44.4	178.2	-86.8	-51.3	0	0	0	113	Y361 A423 A424 Q429 E430 A431 I445 C449	Y361-H427 AromaticContact CD2-CD2 3.56Å; Y361-H427 AromaticContact CD2-CE1 3.4Å; Y361-H427 VanDerWaalsContact CD2-CE1 3.4Å; Y361-H427 WeakPolarHBondContact CD2-CE1 3.29Å; Y361-H427 AromaticContact CD2-CG 4Å; Y361-H427 AromaticContact CD2-ND1 3.92Å; Y361-H427 AromaticContact CD2-NE2 3.15Å; Y361-H427 WeakPolarHBondContact CD2-NE2 3.43Å; Y361-H427 AromaticContact CE1-CE1 3.99Å; Y361-H427 AromaticContact CE2-CD2 3.88Å; Y361-H427 AromaticContact CE2-CE1 3.13Å; Y361-H427 WeakPolarHBondContact CE2-CE1 3.48Å; Y361-H427 AromaticContact CE2-CG 3.86Å; Y361-H427 AromaticContact CE2-ND1 3.41Å; Y361-H427 WeakPolarHBondContact CE2-ND1 3.47Å; Y361-H427 AromaticContact CE2-NE2 3.44Å; Y361-H427 WeakPolarHBondContact CE2-NE2 3.11Å; Y361-H427 AromaticContact CG-CE1 3.94Å; Y361-H427 AromaticContact CG-NE2 3.56Å; Y361-H427 AromaticContact CZ-CE1 3.45Å; Y361-H427 VanDerWaalsContact CZ-CE1 3.45Å; Y361-H427 AromaticContact CZ-ND1 3.95Å; Y361-H427 PolarHBondContact O-CE1 3.2Å; Y361-H427 PolarHBondContact O-NE2 2.96Å; A423-H427 WeakPolarHBondContact O-CB 3.39Å; A423-H427 PolarHBondContact O-CD2 3.08Å; A423-H427 VanDerWaalsContact O-CD2 3.29Å; A423-H427 PolarHBondContact O-N 3.14Å; A424-H427 PolarHBondContact O-N 2.77Å; H427-Q429 VanDerWaalsContact C-N 3.32Å; H427-Q429 PolarHBondContact O-N 3.37Å; H427-E430 PolarHBondContact O-N 3.22Å; H427-A431 VanDerWaalsContact O-CB 3.27Å; H427-A431 WeakPolarHBondContact O-CB 3.37Å; H427-A431 PolarHBondContact O-N 3.31Å; H427-I445 HydrophobicContact CB-CG2 3.68Å; H427-C449 WeakPolarHBondContact CB-SG 3.46Å
428	L	96.9	Very high	96.2	Very high	24 Å²	24	49.3 Å²	49.3	13%	0.126	29%	0.294	C	S	.	.	H	α-helix	trans	-64.4	-36.5	178.5	-68.9	166.6	0	0	0	112	A424 R426 E432 F476 V480	A424-L428 WeakPolarHBondContact O-CB 3.35Å; A424-L428 WeakPolarHBondContact O-CD1 3.4Å; A424-L428 WeakPolarHBondContact O-CG 3.2Å; A424-L428 PolarHBondContact O-N 3.05Å; R426-L428 VanDerWaalsContact C-N 3.35Å; R426-L428 PolarHBondContact O-N 2.88Å; L428-E432 PolarHBondContact O-N 2.99Å; L428-E432 VanDerWaalsContact O-N 3.07Å; L428-F476 HydrophobicContact CD1-CD2 4.11Å; L428-F476 HydrophobicContact CD1-CE2 4.46Å; L428-V480 HydrophobicContact CD1-CG2 4.07Å; L428-V480 HydrophobicContact CD2-CG1 3.74Å; L428-V480 HydrophobicContact CD2-CG2 4.11Å
429	Q	96.3	Very high	95.9	Very high	120 Å²	120	49.8 Å²	49.8	56%	0.561	30%	0.295	S	S	*	.	H	α-helix	trans	-67.3	-42.7	174.3	-70.8	172.5	11.3	0	0	112.2	T425 R426 H427 Q433	T425-Q429 VanDerWaalsContact O-CG 3.31Å; T425-Q429 WeakPolarHBondContact O-CG 3.38Å; T425-Q429 PolarHBondContact O-N 3.07Å; R426-Q429 WeakPolarHBondContact O-CB 3.29Å; R426-Q429 PolarHBondContact O-N 2.95Å; H427-Q429 VanDerWaalsContact C-N 3.32Å; H427-Q429 PolarHBondContact O-N 3.37Å; Q429-Q433 WeakPolarHBondContact O-CG 3.35Å; Q429-Q433 PolarHBondContact O-N 3.31Å
430	E	96.9	Very high	95.6	Very high	67 Å²	67	57 Å²	57	31%	0.313	33%	0.328	S	S	.	.	H	α-helix	trans	-67.1	-39.6	177.4	-69.9	171.7	-178.3	0	0	111.3	Y361 R426 H427 Q433 A434	Y361-E430 PolarHBondContact OH-OE1 2.91Å; Y361-E430 PolarHBondContact OH-OE2 3.31Å; R426-E430 WeakPolarHBondContact CG-OE1 3.48Å; R426-E430 IonicContact CZ-OE1 3.67Å; R426-E430 IonicContact NE-OE1 2.85Å; R426-E430 PolarHBondContact NE-OE1 3.39Å; R426-E430 IonicContact NH2-OE1 3.58Å; R426-E430 WeakPolarHBondContact O-CG 3.25Å; R426-E430 PolarHBondContact O-N 3.04Å; H427-E430 PolarHBondContact O-N 3.22Å; E430-Q433 WeakPolarHBondContact O-CB 3.29Å; E430-Q433 PolarHBondContact O-N 3.48Å; E430-A434 PolarHBondContact O-N 3.23Å
431	A	96.1	Very high	95.4	Very high	3 Å²	3	59.6 Å²	59.6	3%	0.025	34%	0.34	C	S	.	.	H	α-helix	trans	-64.1	-40.6	176.2	0	0	0	0	0	112.3	H427 Q433 A434 K435 I445	H427-A431 VanDerWaalsContact O-CB 3.27Å; H427-A431 WeakPolarHBondContact O-CB 3.37Å; H427-A431 PolarHBondContact O-N 3.31Å; A431-Q433 VanDerWaalsContact C-N 3.3Å; A431-Q433 PolarHBondContact O-N 2.99Å; A431-A434 PolarHBondContact O-N 3.29Å; A431-K435 WeakPolarHBondContact O-CB 3.48Å; A431-K435 PolarHBondContact O-N 3.21Å; A431-I445 HydrophobicContact CB-CB 4.03Å; A431-I445 HydrophobicContact CB-CG2 3.88Å
432	E	94	Very high	95.3	Very high	78 Å²	78	60.8 Å²	60.8	36%	0.364	34%	0.344	S	S	.	.	H	α-helix	trans	-64.3	-36.1	175.3	-175.3	56.5	-150.3	0	0	111.4	L428 N436	L428-E432 PolarHBondContact O-N 2.99Å; L428-E432 VanDerWaalsContact O-N 3.07Å; E432-N436 WeakPolarHBondContact O-CB 3.28Å; E432-N436 PolarHBondContact O-N 3.33Å; E432-N436 PolarHBondContact O-ND2 2.65Å; E432-N436 PolarHBondContact OE1-ND2 2.95Å
433	Q	95.4	Very high	95.3	Very high	140 Å²	140	59.1 Å²	59.1	65%	0.654	33%	0.326	S	S	*	.	H	α-helix	trans	-65.6	-43.8	171.9	-67.6	176.3	25.1	0	0	111.7	Q429 E430 A431 K435 N436 G437	Q429-Q433 WeakPolarHBondContact O-CG 3.35Å; Q429-Q433 PolarHBondContact O-N 3.31Å; E430-Q433 WeakPolarHBondContact O-CB 3.29Å; E430-Q433 PolarHBondContact O-N 3.48Å; A431-Q433 VanDerWaalsContact C-N 3.3Å; A431-Q433 PolarHBondContact O-N 2.99Å; Q433-K435 VanDerWaalsContact C-N 3.35Å; Q433-K435 PolarHBondContact O-N 2.82Å; Q433-N436 PolarHBondContact O-N 2.96Å; Q433-G437 PolarHBondContact O-N 3.47Å
434	A	94.1	Very high	95.3	Very high	38 Å²	38	59 Å²	59	31%	0.314	33%	0.325	S	S	.	.	H	α-helix	trans	-63.1	-40.9	178	0	0	0	0	0	112.2	E430 A431 G437 G438 S439 W442	E430-A434 PolarHBondContact O-N 3.23Å; A431-A434 PolarHBondContact O-N 3.29Å; A434-G437 CarbonylContact O-C 3.49Å; A434-G437 WeakPolarHBondContact O-CA 3.14Å; A434-G437 PolarHBondContact O-N 2.87Å; A434-G438 PolarHBondContact O-N 3.33Å; A434-S439 WeakPolarHBondContact O-CB 3.3Å; A434-S439 PolarHBondContact O-N 3.08Å; A434-W442 HydrophobicContact CB-CB 4.27Å
435	K	93.7	Very high	95.3	Very high	63 Å²	63	60 Å²	60	27%	0.274	33%	0.33	S	S	.	.	H	α-helix	trans	-60.6	-49.4	174.5	-177	-178.2	-174.4	172.6	0	111.6	A431 Q433 G437 G438 W442	A431-K435 WeakPolarHBondContact O-CB 3.48Å; A431-K435 PolarHBondContact O-N 3.21Å; Q433-K435 VanDerWaalsContact C-N 3.35Å; Q433-K435 PolarHBondContact O-N 2.82Å; K435-G437 PolarHBondContact O-N 3.41Å; K435-G438 PolarHBondContact O-N 3.28Å; K435-W442 HydrophobicContact CB-CB 4.04Å; K435-W442 HydrophobicContact CB-CD2 3.75Å; K435-W442 HydrophobicContact CB-CE3 4.19Å; K435-W442 HydrophobicContact CB-CG 3.66Å; K435-W442 HydrophobicContact CD-CD2 3.77Å; K435-W442 HydrophobicContact CD-CE3 3.84Å; K435-W442 HydrophobicContact CD-CH2 3.96Å; K435-W442 HydrophobicContact CD-CZ2 3.86Å; K435-W442 HydrophobicContact CD-CZ3 3.94Å; K435-W442 HydrophobicContact CG-CD2 3.74Å; K435-W442 HydrophobicContact CG-CE3 4.28Å; K435-W442 HydrophobicContact CG-CG 3.98Å; K435-W442 HydrophobicContact CG-CZ2 4.29Å
436	N	93.6	Very high	95.4	Very high	119 Å²	119	58 Å²	58	64%	0.636	32%	0.317	S	S	*	.	H	α-helix	trans	-66.2	-26	176.3	-72.8	-50.5	0	0	0	112.7	E432 Q433 G438	E432-N436 WeakPolarHBondContact O-CB 3.28Å; E432-N436 PolarHBondContact O-N 3.33Å; E432-N436 PolarHBondContact O-ND2 2.65Å; E432-N436 PolarHBondContact OE1-ND2 2.95Å; Q433-N436 PolarHBondContact O-N 2.96Å; N436-G438 VanDerWaalsContact C-N 3.26Å; N436-G438 PolarHBondContact O-N 3.3Å
437	G	92.8	Very high	95.4	Very high	69 Å²	69	53.8 Å²	53.8	71%	0.711	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-5.6	171	0	0	0	0	0	114.8	Q433 A434 K435	Q433-G437 PolarHBondContact O-N 3.47Å; A434-G437 CarbonylContact O-C 3.49Å; A434-G437 WeakPolarHBondContact O-CA 3.14Å; A434-G437 PolarHBondContact O-N 2.87Å; K435-G437 PolarHBondContact O-N 3.41Å
438	G	91.8	Very high	95.4	Very high	62 Å²	62	53.8 Å²	53.8	64%	0.639	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	18.3	178.7	0	0	0	0	0	115.2	A434 K435 N436	A434-G438 PolarHBondContact O-N 3.33Å; K435-G438 PolarHBondContact O-N 3.28Å; N436-G438 VanDerWaalsContact C-N 3.26Å; N436-G438 PolarHBondContact O-N 3.3Å
439	S	91.6	Very high	95.5	Very high	54 Å²	54	52.6 Å²	52.6	38%	0.378	30%	0.295	S	S	.	.			trans	-63.8	135.4	171	179.3	0	0	0	0	110.2	A434	A434-S439 WeakPolarHBondContact O-CB 3.3Å; A434-S439 PolarHBondContact O-N 3.08Å
440	E	91.4	Very high	95.6	Very high	155 Å²	155	46.9 Å²	46.9	72%	0.724	27%	0.269	S	S	*	.	S	Bend	trans	-77.4	-26.6	178	-65.2	-173.9	172.5	0	0	112.5	W443	E440-W443 PolarHBondContact O-NE1 3.45Å
441	H	93.7	Very high	95.7	Very high	54 Å²	54	43.8 Å²	43.8	25%	0.25	25%	0.254	C	S	.	.			trans	-99.1	9.2	-171.1	-46.2	-64.6	0	0	0	114.2	N310 W443 K444	N310-H441 WeakPolarHBondContact OD1-CB 3.32Å; H441-W443 PolarHBondContact O-N 2.92Å; H441-K444 HydrophobicContact CB-CD 4.35Å; H441-K444 PolarHBondContact O-N 3.4Å; H441-K444 VanDerWaalsContact O-N 3.08Å
442	W	96.1	Very high	95.8	Very high	27 Å²	27	43.7 Å²	43.7	10%	0.102	25%	0.253	C	S	.	.	H	α-helix	trans	-52.6	-32.2	-179.9	70.5	-85.5	0	0	0	113.1	A434 K435 K444 I445 H446 L487 A490 L494	A434-W442 HydrophobicContact CB-CB 4.27Å; K435-W442 HydrophobicContact CB-CB 4.04Å; K435-W442 HydrophobicContact CB-CD2 3.75Å; K435-W442 HydrophobicContact CB-CE3 4.19Å; K435-W442 HydrophobicContact CB-CG 3.66Å; K435-W442 HydrophobicContact CD-CD2 3.77Å; K435-W442 HydrophobicContact CD-CE3 3.84Å; K435-W442 HydrophobicContact CD-CH2 3.96Å; K435-W442 HydrophobicContact CD-CZ2 3.86Å; K435-W442 HydrophobicContact CD-CZ3 3.94Å; K435-W442 HydrophobicContact CG-CD2 3.74Å; K435-W442 HydrophobicContact CG-CE3 4.28Å; K435-W442 HydrophobicContact CG-CG 3.98Å; K435-W442 HydrophobicContact CG-CZ2 4.29Å; W442-K444 VanDerWaalsContact C-N 3.27Å; W442-K444 PolarHBondContact O-N 2.95Å; W442-I445 PolarHBondContact O-N 3.15Å; W442-H446 AromaticContact CE3-CD2 3.97Å; W442-H446 AromaticContact CE3-NE2 3.94Å; W442-H446 AromaticContact CZ3-CD2 3.92Å; W442-H446 AromaticContact CZ3-CE1 3.58Å; W442-H446 AromaticContact CZ3-CG 3.84Å; W442-H446 AromaticContact CZ3-ND1 3.61Å; W442-H446 AromaticContact CZ3-NE2 3.76Å; W442-L487 HydrophobicContact CH2-CD1 3.83Å; W442-L487 HydrophobicContact CZ2-CD1 4.18Å; W442-A490 HydrophobicContact CZ2-CB 4.33Å; W442-L494 HydrophobicContact CH2-CD2 4.33Å
443	W	96.8	Very high	96	Very high	19 Å²	19	40 Å²	40	7%	0.072	24%	0.236	C	C	.	.	H	α-helix	trans	-67.2	-23.2	-177.2	64.5	-94.8	0	0	0	113.7	I369 V374 E440 H441 I445 H446 E447 S491 F493 L494	I369-W443 HydrophobicContact CG2-CH2 3.7Å; I369-W443 HydrophobicContact CG2-CZ3 3.72Å; V374-W443 HydrophobicContact CG2-CH2 4.44Å; E440-W443 PolarHBondContact O-NE1 3.45Å; H441-W443 PolarHBondContact O-N 2.92Å; W443-I445 VanDerWaalsContact C-N 3.26Å; W443-I445 PolarHBondContact O-N 3.28Å; W443-H446 WeakPolarHBondContact O-CB 3.44Å; W443-H446 PolarHBondContact O-N 3.46Å; W443-E447 HydrophobicContact CE3-CB 4.41Å; W443-E447 PolarHBondContact O-N 3.42Å; W443-S491 WeakPolarHBondContact CH2-OG 3.39Å; W443-S491 WeakPolarHBondContact CZ3-OG 3.4Å; W443-F493 HydrophobicContact CH2-CB 4.47Å; W443-F493 HydrophobicContact CZ3-CB 4.18Å; W443-L494 HydrophobicContact CB-CD2 3.82Å; W443-L494 HydrophobicContact CB-CG 4.5Å; W443-L494 HydrophobicContact CE3-CB 3.94Å
444	K	98.1	Very high	96.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.9	-33.1	178.5	-67.9	-175	175.1	170.4	0	112.1	V309 N310 Q368 I369 E371 H441 W442 E447 A448	V309-K444 HydrophobicContact CG1-CD 3.76Å; V309-K444 PolarHBondContact O-NZ 2.85Å; N310-K444 WeakPolarHBondContact OD1-CD 2.99Å; N310-K444 PolarHBondContact OD1-NZ 3.1Å; Q368-K444 HydrophobicContact CB-CB 4.34Å; Q368-K444 HydrophobicContact CG-CB 4.19Å; I369-K444 HydrophobicContact CG2-CD 4.23Å; I369-K444 HydrophobicContact CG2-CG 3.94Å; I369-K444 WeakPolarHBondContact O-CD 3.4Å; I369-K444 VanDerWaalsContact O-CE 3.31Å; I369-K444 WeakPolarHBondContact O-CE 3.46Å; I369-K444 PolarHBondContact O-NZ 2.71Å; E371-K444 WeakPolarHBondContact OE1-CE 3.3Å; E371-K444 IonicContact OE1-NZ 3.34Å; E371-K444 PolarHBondContact OE1-NZ 2.98Å; H441-K444 HydrophobicContact CB-CD 4.35Å; H441-K444 PolarHBondContact O-N 3.4Å; H441-K444 VanDerWaalsContact O-N 3.08Å; W442-K444 VanDerWaalsContact C-N 3.27Å; W442-K444 PolarHBondContact O-N 2.95Å; K444-E447 PolarHBondContact O-N 3.03Å; K444-A448 WeakPolarHBondContact O-CB 3.38Å; K444-A448 PolarHBondContact O-N 2.78Å
445	I	98.4	Very high	96.3	Very high	23 Å²	23	32.6 Å²	32.6	12%	0.118	20%	0.197	C	C	.	.	H	α-helix	trans	-67.6	-41.3	174	-63.2	-66.3	0	0	0	110.9	L365 Q368 H427 A431 W442 W443 E447 A448 C449	L365-I445 HydrophobicContact CD2-CD1 3.72Å; Q368-I445 HydrophobicContact CG-CD1 4.24Å; H427-I445 HydrophobicContact CB-CG2 3.68Å; A431-I445 HydrophobicContact CB-CB 4.03Å; A431-I445 HydrophobicContact CB-CG2 3.88Å; W442-I445 PolarHBondContact O-N 3.15Å; W443-I445 VanDerWaalsContact C-N 3.26Å; W443-I445 PolarHBondContact O-N 3.28Å; I445-E447 VanDerWaalsContact C-N 3.35Å; I445-A448 PolarHBondContact O-N 3.48Å; I445-C449 VanDerWaalsContact O-CB 3.3Å; I445-C449 WeakPolarHBondContact O-CB 3.49Å; I445-C449 PolarHBondContact O-N 3.34Å; I445-C449 PolarHBondContact O-SG 3.39Å; I445-C449 VanDerWaalsContact O-SG 3.35Å
446	H	98.3	Very high	96.4	Very high	10 Å²	10	30.1 Å²	30.1	5%	0.046	19%	0.188	C	C	.	.	H	α-helix	trans	-61.4	-45.8	174	-80.2	-138.7	0	0	0	111.1	W442 W443 C449 M450 D484 L494	W442-H446 AromaticContact CE3-CD2 3.97Å; W442-H446 AromaticContact CE3-NE2 3.94Å; W442-H446 AromaticContact CZ3-CD2 3.92Å; W442-H446 AromaticContact CZ3-CE1 3.58Å; W442-H446 AromaticContact CZ3-CG 3.84Å; W442-H446 AromaticContact CZ3-ND1 3.61Å; W442-H446 AromaticContact CZ3-NE2 3.76Å; W443-H446 WeakPolarHBondContact O-CB 3.44Å; W443-H446 PolarHBondContact O-N 3.46Å; H446-C449 PolarHBondContact O-N 3.07Å; H446-M450 HydrophobicContact CB-CE 4.33Å; H446-M450 WeakPolarHBondContact O-CB 3.49Å; H446-M450 WeakPolarHBondContact O-CE 3.5Å; H446-M450 WeakPolarHBondContact O-CG 3.32Å; H446-M450 PolarHBondContact O-N 2.93Å; H446-D484 IonicContact CE1-OD1 2.7Å; H446-D484 IonicContact CE1-OD2 3.57Å; H446-D484 IonicContact CG-OD2 2.87Å; H446-D484 IonicContact ND1-OD1 3.3Å; H446-D484 PolarHBondContact ND1-OD1 2.91Å; H446-D484 IonicContact ND1-OD2 2.75Å; H446-D484 PolarHBondContact ND1-OD2 2.89Å; H446-L494 HydrophobicContact CB-CD1 3.76Å
447	E	98.4	Very high	96.4	Very high	4 Å²	4	26 Å²	26	2%	0.019	16%	0.164	C	C	.	.	H	α-helix	trans	-58.3	-50.7	177.4	-165.9	-73.1	146.2	0	0	111.6	R398 W443 K444 I445 M450 L451 L494 R497	R398-E447 IonicContact CZ-OE1 2.99Å; R398-E447 IonicContact CZ-OE2 2.64Å; R398-E447 IonicContact NH1-OE1 2.89Å; R398-E447 IonicContact NH1-OE2 3.78Å; R398-E447 PolarHBondContact NH1-OE2 2.72Å; R398-E447 IonicContact NH2-OE1 2.8Å; R398-E447 PolarHBondContact NH2-OE1 3.4Å; R398-E447 IonicContact NH2-OE2 2.71Å; R398-E447 PolarHBondContact NH2-OE2 3.22Å; W443-E447 HydrophobicContact CE3-CB 4.41Å; W443-E447 PolarHBondContact O-N 3.42Å; K444-E447 PolarHBondContact O-N 3.03Å; I445-E447 VanDerWaalsContact C-N 3.35Å; E447-M450 PolarHBondContact O-N 3.5Å; E447-L451 PolarHBondContact O-N 2.88Å; E447-L494 HydrophobicContact CB-CD1 4.29Å; E447-R497 HydrophobicContact CG-CB 3.8Å; E447-R497 HydrophobicContact CG-CG 3.93Å; E447-R497 IonicContact OE1-CZ 3.57Å; E447-R497 IonicContact OE1-NE 3.55Å; E447-R497 PolarHBondContact OE1-NE 3.06Å; E447-R497 IonicContact OE1-NH2 2.69Å; E447-R497 PolarHBondContact OE1-NH2 3.49Å
448	A	98.8	Very high	96.4	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-65.6	-40.3	180	0	0	0	0	0	112.9	I364 M367 Q368 K444 I445 M450 L451 A452	I364-A448 HydrophobicContact CG2-CB 3.93Å; I364-A448 WeakPolarHBondContact O-CB 3.39Å; M367-A448 HydrophobicContact CB-CB 4.24Å; Q368-A448 HydrophobicContact CG-CB 3.97Å; K444-A448 WeakPolarHBondContact O-CB 3.38Å; K444-A448 PolarHBondContact O-N 2.78Å; I445-A448 PolarHBondContact O-N 3.48Å; A448-M450 VanDerWaalsContact C-N 3.35Å; A448-L451 PolarHBondContact O-N 3.41Å; A448-A452 WeakPolarHBondContact O-CB 3.24Å; A448-A452 PolarHBondContact O-N 3.05Å
449	C	98.7	Very high	96.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.9	-42.3	173.8	-79.9	0	0	0	0	111.9	H427 I445 H446 L453	H427-C449 WeakPolarHBondContact CB-SG 3.46Å; I445-C449 VanDerWaalsContact O-CB 3.3Å; I445-C449 WeakPolarHBondContact O-CB 3.49Å; I445-C449 PolarHBondContact O-N 3.34Å; I445-C449 PolarHBondContact O-SG 3.39Å; I445-C449 VanDerWaalsContact O-SG 3.35Å; H446-C449 PolarHBondContact O-N 3.07Å; C449-L453 VanDerWaalsContact O-CB 3.32Å; C449-L453 WeakPolarHBondContact O-CB 3.34Å; C449-L453 WeakPolarHBondContact O-CG 3.35Å; C449-L453 PolarHBondContact O-N 3.01Å
450	M	98.6	Very high	96.8	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-65.7	-41.1	177.2	-78.1	-171.5	-74.5	0	0	111.8	H446 E447 A448 G454 F476 I481 L494 R497 A498 A501	H446-M450 HydrophobicContact CB-CE 4.33Å; H446-M450 WeakPolarHBondContact O-CB 3.49Å; H446-M450 WeakPolarHBondContact O-CE 3.5Å; H446-M450 WeakPolarHBondContact O-CG 3.32Å; H446-M450 PolarHBondContact O-N 2.93Å; E447-M450 PolarHBondContact O-N 3.5Å; A448-M450 VanDerWaalsContact C-N 3.35Å; M450-G454 PolarHBondContact O-N 3.42Å; M450-F476 HydrophobicContact CG-CE2 4.3Å; M450-F476 HydrophobicContact CG-CZ 4.1Å; M450-I481 HydrophobicContact CG-CG1 4.37Å; M450-I481 HydrophobicContact SD-CG1 3.94Å; M450-I481 HydrophobicContact SD-CG2 4.45Å; M450-L494 HydrophobicContact CE-CD1 3.37Å; M450-L494 HydrophobicContact CE-CG 4.47Å; M450-R497 HydrophobicContact CB-CG 3.63Å; M450-R497 HydrophobicContact CE-CB 4.43Å; M450-R497 HydrophobicContact CE-CG 4.05Å; M450-R497 HydrophobicContact SD-CG 4.45Å; M450-A498 HydrophobicContact CE-CB 4.16Å; M450-A498 HydrophobicContact SD-CB 3.9Å; M450-A501 HydrophobicContact CB-CB 3.93Å; M450-A501 HydrophobicContact CG-CB 4.2Å; M450-A501 HydrophobicContact SD-CB 4.21Å
451	L	98.6	Very high	96.8	Very high	2 Å²	2	15.9 Å²	15.9	1%	0.01	8%	0.083	C	C	.	.	H	α-helix	trans	-58	-59.1	172.4	175.5	60.9	0	0	0	110.2	M367 E447 A448 L453 G454 S455 W500	M367-L451 HydrophobicContact CE-CB 4.19Å; M367-L451 HydrophobicContact CE-CD2 3.48Å; M367-L451 VanDerWaalsContact CE-CD2 3.48Å; M367-L451 HydrophobicContact CE-CG 3.51Å; E447-L451 PolarHBondContact O-N 2.88Å; A448-L451 PolarHBondContact O-N 3.41Å; L451-L453 PolarHBondContact O-N 3.47Å; L451-G454 PolarHBondContact O-N 3.33Å; L451-S455 PolarHBondContact O-N 3.3Å; L451-S455 PolarHBondContact O-OG 3.46Å; L451-W500 HydrophobicContact CD1-CH2 3.98Å; L451-W500 HydrophobicContact CD1-CZ3 4.34Å
452	A	98.7	Very high	96.8	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-54.7	-48.2	-177.4	0	0	0	0	0	112.7	I364 M367 L405 L420 A448 G454 S455 V456	I364-A452 HydrophobicContact CD1-CB 4.44Å; I364-A452 HydrophobicContact CG1-CB 4.02Å; M367-A452 HydrophobicContact CE-CB 3.99Å; M367-A452 HydrophobicContact SD-CB 4.07Å; L405-A452 HydrophobicContact CD2-CB 3.64Å; L420-A452 HydrophobicContact CD1-CB 3.99Å; A448-A452 WeakPolarHBondContact O-CB 3.24Å; A448-A452 PolarHBondContact O-N 3.05Å; A452-G454 PolarHBondContact O-N 2.95Å; A452-S455 PolarHBondContact O-N 3.26Å; A452-V456 WeakPolarHBondContact O-CG2 3.37Å; A452-V456 PolarHBondContact O-N 3.22Å
453	L	98.4	Very high	96.7	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-64.3	-39.2	177.3	-74.5	167.1	0	0	0	112.2	L420 A424 C449 L451 V456 K457 I460 F471 F476 F505	L420-L453 HydrophobicContact CD2-CD2 3.98Å; L420-L453 HydrophobicContact CG-CD2 3.86Å; L420-L453 HydrophobicContact CG-CG 4.48Å; A424-L453 HydrophobicContact CB-CD1 3.91Å; A424-L453 HydrophobicContact CB-CD2 4.43Å; A424-L453 HydrophobicContact CB-CG 4.27Å; C449-L453 VanDerWaalsContact O-CB 3.32Å; C449-L453 WeakPolarHBondContact O-CB 3.34Å; C449-L453 WeakPolarHBondContact O-CG 3.35Å; C449-L453 PolarHBondContact O-N 3.01Å; L451-L453 PolarHBondContact O-N 3.47Å; L453-V456 CarbonylContact O-C 3.58Å; L453-K457 WeakPolarHBondContact O-CA 3.38Å; L453-K457 PolarHBondContact O-N 3.39Å; L453-I460 HydrophobicContact CD2-CD1 4.15Å; L453-I460 HydrophobicContact CD2-CG1 4.17Å; L453-F471 HydrophobicContact CD1-CZ 4.01Å; L453-F471 HydrophobicContact CD2-CZ 4.37Å; L453-F476 HydrophobicContact CB-CZ 4.35Å; L453-F476 HydrophobicContact CD1-CD1 4.45Å; L453-F476 HydrophobicContact CD1-CD2 4.19Å; L453-F476 HydrophobicContact CD1-CE1 3.84Å; L453-F476 HydrophobicContact CD1-CE2 3.56Å; L453-F476 HydrophobicContact CD1-CZ 3.36Å; L453-F476 HydrophobicContact CG-CZ 4.5Å; L453-F505 HydrophobicContact CB-CE2 4.19Å; L453-F505 HydrophobicContact CB-CZ 3.95Å; L453-F505 WeakPolarHBondContact O-CZ 3.49Å
454	G	97.5	Very high	96.5	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-71.3	-32.8	180	0	0	0	0	0	114	M450 L451 A452 V456 R504	M450-G454 PolarHBondContact O-N 3.42Å; L451-G454 PolarHBondContact O-N 3.33Å; A452-G454 PolarHBondContact O-N 2.95Å; G454-V456 VanDerWaalsContact C-N 3.34Å; G454-R504 PolarHBondContact O-NE 3.33Å
455	S	97.4	Very high	96.2	Very high	23 Å²	23	26.6 Å²	26.6	16%	0.161	14%	0.135	C	C	.	.	H	α-helix	trans	-65.5	-37.3	177.6	-55.8	0	0	0	0	111.4	Q402 L451 A452	Q402-S455 PolarHBondContact NE2-OG 3.06Å; L451-S455 PolarHBondContact O-N 3.3Å; L451-S455 PolarHBondContact O-OG 3.46Å; A452-S455 PolarHBondContact O-N 3.26Å
456	V	96.4	Very high	96	Very high	12 Å²	12	29.9 Å²	29.9	7%	0.073	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.1	34.4	178.6	-58.8	0	0	0	0	112.8	L405 L406 A409 L420 A452 L453 G454 T458 I459 I460	L405-V456 HydrophobicContact CG-CG1 4.45Å; L406-V456 HydrophobicContact CD2-CG1 3.89Å; A409-V456 HydrophobicContact CB-CB 4.32Å; A409-V456 HydrophobicContact CB-CG1 3.55Å; L420-V456 HydrophobicContact CD2-CG2 3.22Å; A452-V456 WeakPolarHBondContact O-CG2 3.37Å; A452-V456 PolarHBondContact O-N 3.22Å; L453-V456 CarbonylContact O-C 3.58Å; G454-V456 VanDerWaalsContact C-N 3.34Å; V456-T458 VanDerWaalsContact C-N 3.25Å; V456-T458 PolarHBondContact O-N 3.01Å; V456-T458 VanDerWaalsContact O-N 3.11Å; V456-I459 HydrophobicContact CB-CD1 3.88Å; V456-I459 HydrophobicContact CB-CG1 3.83Å; V456-I459 HydrophobicContact CG2-CD1 4.09Å; V456-I459 HydrophobicContact CG2-CG1 4.18Å; V456-I459 WeakPolarHBondContact O-CG1 3.11Å; V456-I459 PolarHBondContact O-N 3.06Å; V456-I460 HydrophobicContact CG2-CG1 4.32Å; V456-I460 PolarHBondContact O-N 3.35Å
457	K	94.8	Very high	95.6	Very high	33 Å²	33	31.8 Å²	31.8	14%	0.143	18%	0.175	C	C	.	.	H	α-helix	trans	-53.6	-37.1	-172.8	61.9	149.2	-169	169	0	114.6	L453 I460 T461 R504 F505 Q547	L453-K457 WeakPolarHBondContact O-CA 3.38Å; L453-K457 PolarHBondContact O-N 3.39Å; K457-I460 PolarHBondContact O-N 3.48Å; K457-T461 WeakPolarHBondContact O-CG2 3.12Å; K457-T461 PolarHBondContact O-N 3.33Å; K457-T461 PolarHBondContact O-OG1 2.81Å; K457-R504 HydrophobicContact CB-CB 4.44Å; K457-R504 HydrophobicContact CD-CB 3.97Å; K457-R504 WeakPolarHBondContact CD-O 3.17Å; K457-R504 PolarHBondContact NZ-O 2.84Å; K457-F505 HydrophobicContact CB-CE1 4.03Å; K457-F505 HydrophobicContact CB-CZ 4.14Å; K457-Q547 VanDerWaalsContact NZ-CD 3.28Å; K457-Q547 VanDerWaalsContact NZ-NE2 3.12Å
458	T	92.9	Very high	95.3	Very high	74 Å²	74	38.1 Å²	38.1	45%	0.454	20%	0.199	S	C	.	.	H	α-helix	trans	-64.7	-51.5	-173.2	-53	0	0	0	0	110	V456 I460 T461 E462	V456-T458 VanDerWaalsContact C-N 3.25Å; V456-T458 PolarHBondContact O-N 3.01Å; V456-T458 VanDerWaalsContact O-N 3.11Å; T458-I460 VanDerWaalsContact C-N 3.27Å; T458-I460 PolarHBondContact O-N 2.81Å; T458-T461 PolarHBondContact O-N 3.28Å; T458-T461 PolarHBondContact O-OG1 3.17Å; T458-T461 VanDerWaalsContact O-OG1 3.09Å; T458-E462 HydrophobicContact CG2-CG 4.49Å; T458-E462 WeakPolarHBondContact O-CB 3.36Å; T458-E462 WeakPolarHBondContact O-CG 3.45Å; T458-E462 PolarHBondContact O-N 3.29Å
459	I	94.7	Very high	95	Very high	20 Å²	20	38.7 Å²	38.7	10%	0.103	20%	0.202	C	C	.	.	H	α-helix	trans	-62.6	-34.4	178.6	63.2	164	0	0	0	112	A409 Q413 A417 V456 N463	A409-I459 HydrophobicContact CB-CD1 3.87Å; Q413-I459 HydrophobicContact CB-CG2 4.21Å; Q413-I459 HydrophobicContact CG-CG2 4.34Å; A417-I459 HydrophobicContact CB-CB 4.48Å; A417-I459 HydrophobicContact CB-CD1 4.26Å; A417-I459 HydrophobicContact CB-CG1 4.42Å; V456-I459 HydrophobicContact CB-CD1 3.88Å; V456-I459 HydrophobicContact CB-CG1 3.83Å; V456-I459 HydrophobicContact CG2-CD1 4.09Å; V456-I459 HydrophobicContact CG2-CG1 4.18Å; V456-I459 WeakPolarHBondContact O-CG1 3.11Å; V456-I459 PolarHBondContact O-N 3.06Å; I459-N463 VanDerWaalsContact O-CB 3.22Å; I459-N463 WeakPolarHBondContact O-CB 3.3Å; I459-N463 PolarHBondContact O-N 2.88Å; I459-N463 VanDerWaalsContact O-N 3.15Å; I459-N463 PolarHBondContact O-ND2 3.07Å
460	I	95.3	Very high	94.6	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.01	24%	0.242	C	C	.	.	H	α-helix	trans	-68.5	-53.6	177.6	-64.8	-66.7	0	0	0	110.6	A417 L420 L453 V456 K457 T458 E462 N463 V464 M473 F505	A417-I460 HydrophobicContact CB-CD1 4.11Å; L420-I460 HydrophobicContact CB-CD1 4.39Å; L420-I460 HydrophobicContact CD2-CD1 4.15Å; L420-I460 HydrophobicContact CD2-CG1 4.39Å; L420-I460 HydrophobicContact CG-CD1 4.42Å; L453-I460 HydrophobicContact CD2-CD1 4.15Å; L453-I460 HydrophobicContact CD2-CG1 4.17Å; V456-I460 HydrophobicContact CG2-CG1 4.32Å; V456-I460 PolarHBondContact O-N 3.35Å; K457-I460 PolarHBondContact O-N 3.48Å; T458-I460 VanDerWaalsContact C-N 3.27Å; T458-I460 PolarHBondContact O-N 2.81Å; I460-E462 PolarHBondContact O-N 2.97Å; I460-N463 PolarHBondContact O-N 2.76Å; I460-V464 HydrophobicContact CG2-CG2 4.42Å; I460-V464 WeakPolarHBondContact O-CB 3.21Å; I460-V464 VanDerWaalsContact O-CG2 3.25Å; I460-V464 WeakPolarHBondContact O-CG2 3.43Å; I460-V464 PolarHBondContact O-N 3.5Å; I460-M473 HydrophobicContact CG2-CE 3.77Å; I460-F505 HydrophobicContact CG2-CE1 4.24Å
461	T	93.4	Very high	94.4	Very high	31 Å²	31	48.1 Å²	48.1	19%	0.19	25%	0.246	C	C	.	.	H	α-helix	trans	-62.4	-42.1	-176.3	54.5	0	0	0	0	112.4	K457 T458 K465 M473 F505 A508	K457-T461 WeakPolarHBondContact O-CG2 3.12Å; K457-T461 PolarHBondContact O-N 3.33Å; K457-T461 PolarHBondContact O-OG1 2.81Å; T458-T461 PolarHBondContact O-N 3.28Å; T458-T461 PolarHBondContact O-OG1 3.17Å; T458-T461 VanDerWaalsContact O-OG1 3.09Å; T461-K465 VanDerWaalsContact O-CB 3.25Å; T461-K465 WeakPolarHBondContact O-CB 3.4Å; T461-K465 PolarHBondContact O-N 3.39Å; T461-M473 HydrophobicContact CG2-CE 4.49Å; T461-F505 HydrophobicContact CG2-CD1 3.62Å; T461-F505 HydrophobicContact CG2-CE1 3.89Å; T461-A508 HydrophobicContact CG2-CB 4.24Å
462	E	93.2	Very high	94.2	Very high	96 Å²	96	53.3 Å²	53.3	45%	0.449	27%	0.274	S	S	.	.	H	α-helix	trans	-66.3	-45.6	177.8	-71.1	-177.4	175.4	0	0	112.4	T458 I460 V464 K465 N466	T458-E462 HydrophobicContact CG2-CG 4.49Å; T458-E462 WeakPolarHBondContact O-CB 3.36Å; T458-E462 WeakPolarHBondContact O-CG 3.45Å; T458-E462 PolarHBondContact O-N 3.29Å; I460-E462 PolarHBondContact O-N 2.97Å; E462-V464 VanDerWaalsContact C-N 3.35Å; E462-V464 PolarHBondContact O-N 3.15Å; E462-K465 PolarHBondContact O-N 2.91Å; E462-N466 VanDerWaalsContact O-CB 3.29Å; E462-N466 WeakPolarHBondContact O-CB 3.2Å; E462-N466 VanDerWaalsContact O-CG 3.23Å; E462-N466 PolarHBondContact O-N 2.9Å; E462-N466 PolarHBondContact O-ND2 3.2Å; E462-N466 VanDerWaalsContact O-ND2 3.11Å
463	N	93.3	Very high	94	Very high	4 Å²	4	54.1 Å²	54.1	2%	0.021	28%	0.278	C	S	.	.	H	α-helix	trans	-67.3	-35.5	-179.9	-83.9	-81	0	0	0	112.6	N414 A417 I459 I460 G467 R468 V469	N414-N463 PolarHBondContact OD1-OD1 3.32Å; A417-N463 HydrophobicContact CB-CB 4.1Å; I459-N463 VanDerWaalsContact O-CB 3.22Å; I459-N463 WeakPolarHBondContact O-CB 3.3Å; I459-N463 PolarHBondContact O-N 2.88Å; I459-N463 VanDerWaalsContact O-N 3.15Å; I459-N463 PolarHBondContact O-ND2 3.07Å; I460-N463 PolarHBondContact O-N 2.76Å; N463-G467 PolarHBondContact O-N 3.39Å; N463-R468 HydrophobicContact CB-CB 4.33Å; N463-R468 PolarHBondContact O-N 3.39Å; N463-R468 WeakPolarHBondContact OD1-CB 3.48Å; N463-R468 VanDerWaalsContact OD1-CD 3.25Å; N463-R468 WeakPolarHBondContact OD1-CD 3.25Å; N463-V469 HydrophobicContact CB-CB 4.21Å; N463-V469 HydrophobicContact CB-CG2 3.79Å; N463-V469 PolarHBondContact O-N 3.41Å
464	V	93.4	Very high	93.7	Very high	38 Å²	38	60 Å²	60	23%	0.23	31%	0.306	C	S	.	.	H	α-helix	trans	-67.4	-46.7	173.4	171.4	0	0	0	0	110.6	I460 E462 N466 G467 F471 M473	I460-V464 HydrophobicContact CG2-CG2 4.42Å; I460-V464 WeakPolarHBondContact O-CB 3.21Å; I460-V464 VanDerWaalsContact O-CG2 3.25Å; I460-V464 WeakPolarHBondContact O-CG2 3.43Å; I460-V464 PolarHBondContact O-N 3.5Å; E462-V464 VanDerWaalsContact C-N 3.35Å; E462-V464 PolarHBondContact O-N 3.15Å; V464-N466 VanDerWaalsContact C-N 3.28Å; V464-N466 PolarHBondContact O-N 3.33Å; V464-G467 PolarHBondContact O-N 3.27Å; V464-F471 HydrophobicContact CG2-CB 3.91Å; V464-F471 HydrophobicContact CG2-CD1 4.44Å; V464-M473 HydrophobicContact CG1-CB 4.31Å
465	K	92	Very high	93.5	Very high	187 Å²	187	61.1 Å²	61.1	81%	0.813	32%	0.317	S	S	*	.	H	α-helix	trans	-60.3	-38.5	178.3	-175.1	179.6	179	-176.8	0	112.2	T461 E462 G467	T461-K465 VanDerWaalsContact O-CB 3.25Å; T461-K465 WeakPolarHBondContact O-CB 3.4Å; T461-K465 PolarHBondContact O-N 3.39Å; E462-K465 PolarHBondContact O-N 2.91Å; K465-G467 VanDerWaalsContact C-N 3.26Å; K465-G467 PolarHBondContact O-N 2.85Å
466	N	92.6	Very high	93.5	Very high	92 Å²	92	60.3 Å²	60.3	49%	0.492	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	0.7	178.2	-67	-31.1	0	0	0	113.5	E462 V464 R468	E462-N466 VanDerWaalsContact O-CB 3.29Å; E462-N466 WeakPolarHBondContact O-CB 3.2Å; E462-N466 VanDerWaalsContact O-CG 3.23Å; E462-N466 PolarHBondContact O-N 2.9Å; E462-N466 PolarHBondContact O-ND2 3.2Å; E462-N466 VanDerWaalsContact O-ND2 3.11Å; V464-N466 VanDerWaalsContact C-N 3.28Å; V464-N466 PolarHBondContact O-N 3.33Å; N466-R468 HydrophobicContact CB-CG 4.04Å; N466-R468 PolarHBondContact O-N 3.45Å
467	G	91	Very high	93.5	Very high	50 Å²	50	59.9 Å²	59.9	52%	0.515	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.2	16.6	179.4	0	0	0	0	0	114.8	N463 V464 K465	N463-G467 PolarHBondContact O-N 3.39Å; V464-G467 PolarHBondContact O-N 3.27Å; K465-G467 VanDerWaalsContact C-N 3.26Å; K465-G467 PolarHBondContact O-N 2.85Å
468	R	91.6	Very high	93.4	Very high	136 Å²	136	59.7 Å²	59.7	51%	0.513	31%	0.312	S	S	.	.	S	Bend	trans	-78.3	-27.5	179.6	-60.6	-179	-164.5	158.5	4.4	112.2	N414 N463 N466	N414-R468 PolarHBondContact OD1-NH1 3.49Å; N463-R468 HydrophobicContact CB-CB 4.33Å; N463-R468 PolarHBondContact O-N 3.39Å; N463-R468 WeakPolarHBondContact OD1-CB 3.48Å; N463-R468 VanDerWaalsContact OD1-CD 3.25Å; N463-R468 WeakPolarHBondContact OD1-CD 3.25Å; N466-R468 HydrophobicContact CB-CG 4.04Å; N466-R468 PolarHBondContact O-N 3.45Å
469	V	92.6	Very high	93.3	Very high	12 Å²	12	58.6 Å²	58.6	7%	0.073	32%	0.316	C	S	.	.	S	Bend	trans	-123.8	134.4	179.3	174.2	0	0	0	0	110	A417 A418 A421 N463 F471	A417-V469 HydrophobicContact CB-CG2 4.18Å; A418-V469 HydrophobicContact CB-CG2 3.87Å; A421-V469 HydrophobicContact CB-CG1 3.58Å; N463-V469 HydrophobicContact CB-CB 4.21Å; N463-V469 HydrophobicContact CB-CG2 3.79Å; N463-V469 PolarHBondContact O-N 3.41Å; V469-F471 HydrophobicContact CG1-CB 4.24Å; V469-F471 PolarHBondContact O-N 2.76Å
470	Q	90.7	Very high	93.3	Very high	178 Å²	178	58.5 Å²	58.5	83%	0.832	32%	0.316	S	S	*	.			trans	-89.1	98.6	173.1	-64.7	-65.2	-37	0	0	109.1
471	F	94.4	Very high	93.4	Very high	21 Å²	21	58.4 Å²	58.4	9%	0.092	32%	0.315	C	S	.	.			trans	-137.6	129.4	176.7	-176.8	-108.5	0	0	0	109.5	A421 L453 V464 V469 M473 F476	A421-F471 HydrophobicContact CB-CB 3.97Å; A421-F471 HydrophobicContact CB-CD2 3.68Å; A421-F471 HydrophobicContact CB-CE2 4.5Å; A421-F471 HydrophobicContact CB-CG 4.07Å; L453-F471 HydrophobicContact CD1-CZ 4.01Å; L453-F471 HydrophobicContact CD2-CZ 4.37Å; V464-F471 HydrophobicContact CG2-CB 3.91Å; V464-F471 HydrophobicContact CG2-CD1 4.44Å; V469-F471 HydrophobicContact CG1-CB 4.24Å; V469-F471 PolarHBondContact O-N 2.76Å; F471-M473 HydrophobicContact CD1-CB 4.33Å; F471-M473 HydrophobicContact CD1-CE 4.02Å; F471-M473 HydrophobicContact CE1-CE 4.03Å; F471-M473 HydrophobicContact CE1-SD 4.32Å; F471-M473 PolarHBondContact O-N 3.4Å; F471-F476 HydrophobicContact CE1-CB 3.88Å; F471-F476 HydrophobicContact CE1-CD1 4.06Å; F471-F476 HydrophobicContact CE1-CG 4.04Å; F471-F476 HydrophobicContact CZ-CB 3.84Å; F471-F476 HydrophobicContact CZ-CD1 4.17Å; F471-F476 HydrophobicContact CZ-CD2 4.24Å; F471-F476 AromaticContact CZ-CG 3.82Å; F471-F476 HydrophobicContact CZ-CG 3.82Å
472	D	93.8	Very high	93.5	Very high	111 Å²	111	58 Å²	58	59%	0.594	31%	0.312	S	S	*	.			trans	-77.1	77.1	178.2	-175.1	9	0	0	0	110.5	H474 G475 F476	D472-H474 VanDerWaalsContact C-N 3.28Å; D472-H474 PolarHBondContact O-N 2.9Å; D472-G475 PolarHBondContact O-N 2.99Å; D472-G475 PolarHBondContact OD1-N 3.49Å; D472-G475 WeakPolarHBondContact OD2-CA 3.46Å; D472-F476 WeakPolarHBondContact O-CB 3.31Å; D472-F476 PolarHBondContact O-N 3.07Å
473	M	94.8	Very high	93.5	Very high	17 Å²	17	55.2 Å²	55.2	8%	0.084	31%	0.305	C	S	.	.	H	α-helix	trans	-59.2	-39.2	-179.3	-178.3	57.4	72.8	0	0	111.8	I460 T461 V464 F471 F476 L477 F505 A508	I460-M473 HydrophobicContact CG2-CE 3.77Å; T461-M473 HydrophobicContact CG2-CE 4.49Å; V464-M473 HydrophobicContact CG1-CB 4.31Å; F471-M473 HydrophobicContact CD1-CB 4.33Å; F471-M473 HydrophobicContact CD1-CE 4.02Å; F471-M473 HydrophobicContact CE1-CE 4.03Å; F471-M473 HydrophobicContact CE1-SD 4.32Å; F471-M473 PolarHBondContact O-N 3.4Å; M473-F476 PolarHBondContact O-N 3.39Å; M473-F476 HydrophobicContact SD-CD1 4.3Å; M473-L477 HydrophobicContact CG-CD1 3.92Å; M473-L477 HydrophobicContact CG-CG 4.45Å; M473-L477 WeakPolarHBondContact O-CB 3.44Å; M473-L477 WeakPolarHBondContact O-CD1 3.43Å; M473-L477 WeakPolarHBondContact O-CG 3.49Å; M473-L477 PolarHBondContact O-N 3.25Å; M473-L477 HydrophobicContact SD-CD1 4.05Å; M473-L477 HydrophobicContact SD-CG 4.07Å; M473-F505 HydrophobicContact CE-CD1 3.95Å; M473-F505 HydrophobicContact CE-CE1 3.9Å; M473-F505 HydrophobicContact SD-CD1 4.14Å; M473-A508 HydrophobicContact CG-CB 4.02Å; M473-A508 HydrophobicContact SD-CB 4.32Å
474	H	92.8	Very high	93.6	Very high	124 Å²	124	55.2 Å²	55.2	57%	0.574	31%	0.305	S	S	*	.	H	α-helix	trans	-67.8	-44.9	178	-177.2	72	0	0	0	111.6	D472 F476 L477 A478	D472-H474 VanDerWaalsContact C-N 3.28Å; D472-H474 PolarHBondContact O-N 2.9Å; H474-F476 VanDerWaalsContact C-N 3.31Å; H474-F476 PolarHBondContact O-N 2.9Å; H474-L477 PolarHBondContact O-N 3.03Å; H474-A478 WeakPolarHBondContact O-CB 3.49Å; H474-A478 PolarHBondContact O-N 3.45Å
475	G	93.8	Very high	93.6	Very high	23 Å²	23	53.9 Å²	53.9	24%	0.237	30%	0.297	C	S	.	.	H	α-helix	trans	-61.4	-37.4	174.5	0	0	0	0	0	112.8	D472 G479 V480	D472-G475 PolarHBondContact O-N 2.99Å; D472-G475 PolarHBondContact OD1-N 3.49Å; D472-G475 WeakPolarHBondContact OD2-CA 3.46Å; G475-G479 CarbonylContact O-C 3.57Å; G475-G479 WeakPolarHBondContact O-CA 3.24Å; G475-G479 PolarHBondContact O-N 3.25Å; G475-V480 PolarHBondContact O-N 2.87Å
476	F	96.5	Very high	93.3	Very high	6 Å²	6	50.8 Å²	50.8	3%	0.026	29%	0.289	C	S	.	.	I	π-helix	trans	-64.5	-51.5	173.7	177	-117	0	0	0	111.8	L428 M450 L453 F471 D472 M473 H474 V480 I481 F505	L428-F476 HydrophobicContact CD1-CD2 4.11Å; L428-F476 HydrophobicContact CD1-CE2 4.46Å; M450-F476 HydrophobicContact CG-CE2 4.3Å; M450-F476 HydrophobicContact CG-CZ 4.1Å; L453-F476 HydrophobicContact CB-CZ 4.35Å; L453-F476 HydrophobicContact CD1-CD1 4.45Å; L453-F476 HydrophobicContact CD1-CD2 4.19Å; L453-F476 HydrophobicContact CD1-CE1 3.84Å; L453-F476 HydrophobicContact CD1-CE2 3.56Å; L453-F476 HydrophobicContact CD1-CZ 3.36Å; L453-F476 HydrophobicContact CG-CZ 4.5Å; F471-F476 HydrophobicContact CE1-CB 3.88Å; F471-F476 HydrophobicContact CE1-CD1 4.06Å; F471-F476 HydrophobicContact CE1-CG 4.04Å; F471-F476 HydrophobicContact CZ-CB 3.84Å; F471-F476 HydrophobicContact CZ-CD1 4.17Å; F471-F476 HydrophobicContact CZ-CD2 4.24Å; F471-F476 AromaticContact CZ-CG 3.82Å; F471-F476 HydrophobicContact CZ-CG 3.82Å; D472-F476 WeakPolarHBondContact O-CB 3.31Å; D472-F476 PolarHBondContact O-N 3.07Å; M473-F476 PolarHBondContact O-N 3.39Å; M473-F476 HydrophobicContact SD-CD1 4.3Å; H474-F476 VanDerWaalsContact C-N 3.31Å; H474-F476 PolarHBondContact O-N 2.9Å; F476-V480 HydrophobicContact CD2-CB 4.07Å; F476-V480 HydrophobicContact CD2-CG1 4.43Å; F476-V480 HydrophobicContact CD2-CG2 4.19Å; F476-V480 HydrophobicContact CE2-CB 4.45Å; F476-V480 HydrophobicContact CE2-CG1 4.36Å; F476-V480 WeakPolarHBondContact O-CA 3.06Å; F476-V480 VanDerWaalsContact O-CB 3.24Å; F476-V480 WeakPolarHBondContact O-CB 3.43Å; F476-V480 PolarHBondContact O-N 3.43Å; F476-V480 VanDerWaalsContact O-N 3.12Å; F476-I481 HydrophobicContact CD1-CD1 4.25Å; F476-I481 HydrophobicContact CE1-CD1 3.66Å; F476-I481 HydrophobicContact CE1-CG1 4.19Å; F476-I481 HydrophobicContact CE2-CG1 4.31Å; F476-I481 HydrophobicContact CZ-CD1 3.85Å; F476-I481 HydrophobicContact CZ-CG1 4.02Å; F476-I481 PolarHBondContact O-N 3.14Å; F476-F505 HydrophobicContact CE1-CD2 4.19Å; F476-F505 AromaticContact CE1-CE2 3.9Å; F476-F505 HydrophobicContact CE1-CE2 3.9Å; F476-F505 HydrophobicContact CE1-CZ 4.44Å
477	L	96.1	Very high	93	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.01	28%	0.282	C	S	.	.	I	π-helix	trans	-63	-50	-179.7	-68.3	166.7	0	0	0	112.4	M473 H474 I481 L482 F505 M509	M473-L477 HydrophobicContact CG-CD1 3.92Å; M473-L477 HydrophobicContact CG-CG 4.45Å; M473-L477 WeakPolarHBondContact O-CB 3.44Å; M473-L477 WeakPolarHBondContact O-CD1 3.43Å; M473-L477 WeakPolarHBondContact O-CG 3.49Å; M473-L477 PolarHBondContact O-N 3.25Å; M473-L477 HydrophobicContact SD-CD1 4.05Å; M473-L477 HydrophobicContact SD-CG 4.07Å; H474-L477 PolarHBondContact O-N 3.03Å; L477-I481 HydrophobicContact CD2-CD1 4.15Å; L477-L482 WeakPolarHBondContact O-CB 3.46Å; L477-L482 PolarHBondContact O-N 2.8Å; L477-F505 HydrophobicContact CD2-CB 3.82Å; L477-F505 HydrophobicContact CD2-CG 4.46Å; L477-M509 HydrophobicContact CD1-CG 3.79Å; L477-M509 HydrophobicContact CD2-CG 4.06Å; L477-M509 HydrophobicContact CD2-SD 4.19Å
478	A	92.9	Very high	92.1	Very high	30 Å²	30	51.9 Å²	51.9	25%	0.248	29%	0.287	C	S	.	.	I	π-helix	trans	-87.1	-39.7	-173.4	0	0	0	0	0	113.3	H474	H474-A478 WeakPolarHBondContact O-CB 3.49Å; H474-A478 PolarHBondContact O-N 3.45Å
479	G	91	Very high	91.4	Very high	51 Å²	51	50.2 Å²	50.2	53%	0.526	30%	0.302	S	S	.	.	I	π-helix	trans	-87.7	-23	-175.1	0	0	0	0	0	114.4	G475 A483	G475-G479 CarbonylContact O-C 3.57Å; G475-G479 WeakPolarHBondContact O-CA 3.24Å; G475-G479 PolarHBondContact O-N 3.25Å; G479-A483 VanDerWaalsContact O-CB 3.26Å; G479-A483 WeakPolarHBondContact O-CB 3.46Å
480	V	94.9	Very high	91	Very high	17 Å²	17	51.3 Å²	51.3	10%	0.103	31%	0.313	C	S	.	.	I	π-helix	trans	-108.9	-72	176.9	-173.9	0	0	0	0	110	L428 G475 F476 L482 A483 D484	L428-V480 HydrophobicContact CD1-CG2 4.07Å; L428-V480 HydrophobicContact CD2-CG1 3.74Å; L428-V480 HydrophobicContact CD2-CG2 4.11Å; G475-V480 PolarHBondContact O-N 2.87Å; F476-V480 HydrophobicContact CD2-CB 4.07Å; F476-V480 HydrophobicContact CD2-CG1 4.43Å; F476-V480 HydrophobicContact CD2-CG2 4.19Å; F476-V480 HydrophobicContact CE2-CB 4.45Å; F476-V480 HydrophobicContact CE2-CG1 4.36Å; F476-V480 WeakPolarHBondContact O-CA 3.06Å; F476-V480 VanDerWaalsContact O-CB 3.24Å; F476-V480 WeakPolarHBondContact O-CB 3.43Å; F476-V480 PolarHBondContact O-N 3.43Å; F476-V480 VanDerWaalsContact O-N 3.12Å; V480-L482 PolarHBondContact O-N 3.36Å; V480-A483 PolarHBondContact O-N 3.16Å; V480-D484 WeakPolarHBondContact O-CB 3.46Å; V480-D484 VanDerWaalsContact O-CG 3.28Å; V480-D484 PolarHBondContact O-N 3.18Å
481	I	96.7	Very high	91.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	28%	0.277	C	S	.	.	I	π-helix	trans	-59.9	-54	-170.7	-54.6	-172.3	0	0	0	111.3	M450 F476 L477 A483 D484 L485 A498 A501 A502 F517	M450-I481 HydrophobicContact CG-CG1 4.37Å; M450-I481 HydrophobicContact SD-CG1 3.94Å; M450-I481 HydrophobicContact SD-CG2 4.45Å; F476-I481 HydrophobicContact CD1-CD1 4.25Å; F476-I481 HydrophobicContact CE1-CD1 3.66Å; F476-I481 HydrophobicContact CE1-CG1 4.19Å; F476-I481 HydrophobicContact CE2-CG1 4.31Å; F476-I481 HydrophobicContact CZ-CD1 3.85Å; F476-I481 HydrophobicContact CZ-CG1 4.02Å; F476-I481 PolarHBondContact O-N 3.14Å; L477-I481 HydrophobicContact CD2-CD1 4.15Å; I481-A483 VanDerWaalsContact C-N 3.3Å; I481-A483 PolarHBondContact O-N 3.26Å; I481-D484 PolarHBondContact O-N 3.03Å; I481-L485 WeakPolarHBondContact O-CG 3.39Å; I481-L485 PolarHBondContact O-N 2.94Å; I481-A498 HydrophobicContact CG2-CB 3.94Å; I481-A498 VanDerWaalsContact CG2-O 3.23Å; I481-A498 WeakPolarHBondContact CG2-O 3.28Å; I481-A501 HydrophobicContact CD1-CB 3.99Å; I481-A502 HydrophobicContact CG2-CB 4.07Å; I481-F517 HydrophobicContact CB-CE1 4.32Å; I481-F517 HydrophobicContact CB-CZ 4.29Å; I481-F517 HydrophobicContact CG2-CE1 3.72Å; I481-F517 HydrophobicContact CG2-CZ 4.09Å
482	L	94.7	Very high	91.4	Very high	24 Å²	24	44.7 Å²	44.7	13%	0.126	29%	0.287	C	S	.	.	H	α-helix	trans	-65.4	-33.5	-179.4	-175.3	65.3	0	0	0	112.3	L477 V480 N486 L513 Q516 F517	L477-L482 WeakPolarHBondContact O-CB 3.46Å; L477-L482 PolarHBondContact O-N 2.8Å; V480-L482 PolarHBondContact O-N 3.36Å; L482-N486 PolarHBondContact O-ND2 3.28Å; L482-L513 HydrophobicContact CD2-CD2 4.07Å; L482-Q516 HydrophobicContact CD1-CB 4.23Å; L482-F517 HydrophobicContact CB-CE1 3.93Å; L482-F517 HydrophobicContact CB-CZ 3.84Å; L482-F517 HydrophobicContact CD1-CD1 4.33Å; L482-F517 HydrophobicContact CD1-CE1 3.95Å; L482-F517 HydrophobicContact CD1-CZ 4.32Å
483	A	94.2	Very high	91.6	Very high	37 Å²	37	39.8 Å²	39.8	31%	0.306	26%	0.261	S	S	.	.	H	α-helix	trans	-66.4	-43.8	175.6	0	0	0	0	0	111.2	G479 V480 I481 L485 N486 L487	G479-A483 VanDerWaalsContact O-CB 3.26Å; G479-A483 WeakPolarHBondContact O-CB 3.46Å; V480-A483 PolarHBondContact O-N 3.16Å; I481-A483 VanDerWaalsContact C-N 3.3Å; I481-A483 PolarHBondContact O-N 3.26Å; A483-L485 VanDerWaalsContact C-N 3.35Å; A483-L485 PolarHBondContact O-N 3.19Å; A483-N486 WeakPolarHBondContact O-CB 3.34Å; A483-N486 PolarHBondContact O-N 3.04Å; A483-L487 PolarHBondContact O-N 3.18Å
484	D	94.9	Very high	91.7	Very high	3 Å²	3	39 Å²	39	2%	0.016	26%	0.257	C	S	.	.	H	α-helix	trans	-67.1	-33.6	-179.8	-72.2	-19.9	0	0	0	112.5	H446 V480 I481 N486 L487 L494	H446-D484 IonicContact CE1-OD1 2.7Å; H446-D484 IonicContact CE1-OD2 3.57Å; H446-D484 IonicContact CG-OD2 2.87Å; H446-D484 IonicContact ND1-OD1 3.3Å; H446-D484 PolarHBondContact ND1-OD1 2.91Å; H446-D484 IonicContact ND1-OD2 2.75Å; H446-D484 PolarHBondContact ND1-OD2 2.89Å; V480-D484 WeakPolarHBondContact O-CB 3.46Å; V480-D484 VanDerWaalsContact O-CG 3.28Å; V480-D484 PolarHBondContact O-N 3.18Å; I481-D484 PolarHBondContact O-N 3.03Å; D484-N486 PolarHBondContact O-N 3.08Å; D484-L487 PolarHBondContact O-N 2.77Å; D484-L494 HydrophobicContact CB-CD1 4.42Å; D484-L494 HydrophobicContact CB-CD2 3.98Å; D484-L494 HydrophobicContact CB-CG 4.19Å
485	L	92.7	Very high	91.9	Very high	10 Å²	10	33.9 Å²	33.9	5%	0.052	23%	0.234	C	C	.	.	H	α-helix	trans	-59.3	-29.3	171	-70.1	179.2	0	0	0	113.2	I481 A483 L487 L495 A498 L499 F517 A520	I481-L485 WeakPolarHBondContact O-CG 3.39Å; I481-L485 PolarHBondContact O-N 2.94Å; A483-L485 VanDerWaalsContact C-N 3.35Å; A483-L485 PolarHBondContact O-N 3.19Å; L485-L487 VanDerWaalsContact C-N 3.35Å; L485-L495 HydrophobicContact CB-CD1 4.44Å; L485-L495 HydrophobicContact CD2-CD1 3.6Å; L485-A498 HydrophobicContact CD2-CB 3.52Å; L485-A498 HydrophobicContact CG-CB 3.91Å; L485-L499 HydrophobicContact CD1-CD2 4.24Å; L485-L499 HydrophobicContact CD2-CD2 3.53Å; L485-L499 HydrophobicContact CD2-CG 3.72Å; L485-F517 HydrophobicContact CD1-CD1 3.35Å; L485-F517 HydrophobicContact CD1-CE1 3.49Å; L485-F517 VanDerWaalsContact CD1-CE1 3.49Å; L485-A520 HydrophobicContact CD1-CB 3.9Å
486	N	87.3	Confident	92.1	Very high	122 Å²	122	32.8 Å²	32.8	65%	0.652	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-6.3	178.3	-68.5	-61.3	0	0	0	112.9	L482 A483 D484 T488	L482-N486 PolarHBondContact O-ND2 3.28Å; A483-N486 WeakPolarHBondContact O-CB 3.34Å; A483-N486 PolarHBondContact O-N 3.04Å; D484-N486 PolarHBondContact O-N 3.08Å; N486-T488 PolarHBondContact O-N 3.17Å
487	L	85.4	Confident	92.2	Very high	64 Å²	64	33.3 Å²	33.3	34%	0.335	22%	0.224	S	C	.	.			trans	-98.5	57.1	179.8	-66.6	174.6	0	0	0	111.7	W442 A483 D484 L485 A489 A490	W442-L487 HydrophobicContact CH2-CD1 3.83Å; W442-L487 HydrophobicContact CZ2-CD1 4.18Å; A483-L487 PolarHBondContact O-N 3.18Å; D484-L487 PolarHBondContact O-N 2.77Å; L485-L487 VanDerWaalsContact C-N 3.35Å; L487-A489 PolarHBondContact O-N 3.3Å; L487-A490 PolarHBondContact O-N 3.16Å
488	T	72	Confident	92.3	Very high	102 Å²	102	33.2 Å²	33.2	63%	0.626	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-16.5	-175.6	56.4	0	0	0	0	114.9	N486	N486-T488 PolarHBondContact O-N 3.17Å
489	A	76.3	Confident	92.6	Very high	101 Å²	101	31.9 Å²	31.9	84%	0.835	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-9.9	178.6	0	0	0	0	0	114.5	L487	L487-A489 PolarHBondContact O-N 3.3Å
490	A	86.1	Confident	92.9	Very high	35 Å²	35	30.6 Å²	30.6	29%	0.289	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-61.7	-175.2	0	0	0	0	0	112.4	W442 L487 L494	W442-A490 HydrophobicContact CZ2-CB 4.33Å; L487-A490 PolarHBondContact O-N 3.16Å; A490-L494 HydrophobicContact CB-CD2 4.15Å
491	S	94.9	Very high	93.1	Very high	12 Å²	12	29.8 Å²	29.8	8%	0.084	19%	0.187	C	C	.	.			trans	-167	141.6	177.1	173.6	0	0	0	0	110.3	W443 F493 L494 L495	W443-S491 WeakPolarHBondContact CH2-OG 3.39Å; W443-S491 WeakPolarHBondContact CZ3-OG 3.4Å; S491-F493 PolarHBondContact O-N 3.01Å; S491-F493 PolarHBondContact OG-N 3.07Å; S491-L494 PolarHBondContact O-N 3.02Å; S491-L495 PolarHBondContact O-N 3.44Å
492	P	96.8	Very high	93.1	Very high	47 Å²	47	29.8 Å²	29.8	31%	0.305	19%	0.187	S	C	.	.	H	α-helix	trans	-64.4	-28.1	173.2	27.7	-34.8	0	0	0	112.8	L495 G496 P530 V533	P492-L495 PolarHBondContact O-N 3.2Å; P492-G496 PolarHBondContact O-N 3.3Å; P492-P530 HydrophobicContact CB-CB 4.41Å; P492-P530 HydrophobicContact CB-CG 3.45Å; P492-P530 VanDerWaalsContact CB-CG 3.45Å; P492-P530 HydrophobicContact CG-CG 4.32Å; P492-V533 HydrophobicContact CB-CG2 3.73Å; P492-V533 WeakPolarHBondContact O-CG2 3.39Å
493	F	97.8	Very high	93.2	Very high	9 Å²	9	28.8 Å²	28.8	4%	0.039	18%	0.181	C	C	.	.	H	α-helix	trans	-72.1	-36.1	178.3	-61.7	-76.9	0	0	0	112.1	I369 V374 W377 F384 W443 S491 R497	I369-F493 HydrophobicContact CD1-CB 4.01Å; I369-F493 HydrophobicContact CD1-CD1 3.96Å; I369-F493 HydrophobicContact CD1-CD2 4.05Å; I369-F493 HydrophobicContact CD1-CE1 4.48Å; I369-F493 HydrophobicContact CD1-CG 3.72Å; V374-F493 HydrophobicContact CB-CE2 4.25Å; V374-F493 HydrophobicContact CG1-CE2 3.93Å; V374-F493 HydrophobicContact CG2-CD2 4.14Å; V374-F493 HydrophobicContact CG2-CE2 4.15Å; W377-F493 HydrophobicContact CB-CE1 3.74Å; W377-F493 HydrophobicContact CB-CZ 3.84Å; W377-F493 HydrophobicContact CD2-CE1 4.44Å; W377-F493 AromaticContact CE3-CD1 4Å; W377-F493 HydrophobicContact CE3-CD1 4Å; W377-F493 AromaticContact CE3-CE1 3.74Å; W377-F493 HydrophobicContact CE3-CE1 3.74Å; W377-F493 HydrophobicContact CE3-CZ 4.46Å; W377-F493 HydrophobicContact CG-CE1 4.5Å; F384-F493 HydrophobicContact CD2-CE1 4.13Å; F384-F493 HydrophobicContact CE2-CD1 4.08Å; F384-F493 HydrophobicContact CE2-CE1 4.13Å; W443-F493 HydrophobicContact CH2-CB 4.47Å; W443-F493 HydrophobicContact CZ3-CB 4.18Å; S491-F493 PolarHBondContact O-N 3.01Å; S491-F493 PolarHBondContact OG-N 3.07Å; F493-R497 VanDerWaalsContact O-CB 3.3Å; F493-R497 WeakPolarHBondContact O-CB 3.25Å; F493-R497 PolarHBondContact O-N 3.26Å
494	L	97.9	Very high	93.3	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-62.7	-46.9	171.1	179.3	68.4	0	0	0	110.9	W442 W443 H446 E447 M450 D484 A490 S491 R497 A498	W442-L494 HydrophobicContact CH2-CD2 4.33Å; W443-L494 HydrophobicContact CB-CD2 3.82Å; W443-L494 HydrophobicContact CB-CG 4.5Å; W443-L494 HydrophobicContact CE3-CB 3.94Å; H446-L494 HydrophobicContact CB-CD1 3.76Å; E447-L494 HydrophobicContact CB-CD1 4.29Å; M450-L494 HydrophobicContact CE-CD1 3.37Å; M450-L494 HydrophobicContact CE-CG 4.47Å; D484-L494 HydrophobicContact CB-CD1 4.42Å; D484-L494 HydrophobicContact CB-CD2 3.98Å; D484-L494 HydrophobicContact CB-CG 4.19Å; A490-L494 HydrophobicContact CB-CD2 4.15Å; S491-L494 PolarHBondContact O-N 3.02Å; L494-R497 PolarHBondContact O-N 3.38Å; L494-A498 WeakPolarHBondContact O-CB 3.47Å; L494-A498 PolarHBondContact O-N 2.98Å
495	L	97.6	Very high	93.4	Very high	16 Å²	16	29.5 Å²	29.5	8%	0.084	18%	0.176	C	C	.	.	H	α-helix	trans	-59.9	-48.1	178.7	176.6	60.7	0	0	0	111.2	L485 S491 P492 A498 L499 V533	L485-L495 HydrophobicContact CB-CD1 4.44Å; L485-L495 HydrophobicContact CD2-CD1 3.6Å; S491-L495 PolarHBondContact O-N 3.44Å; P492-L495 PolarHBondContact O-N 3.2Å; L495-A498 PolarHBondContact O-N 3.03Å; L495-L499 WeakPolarHBondContact O-CG 3.45Å; L495-L499 PolarHBondContact O-N 2.79Å; L495-L499 VanDerWaalsContact O-N 3.14Å; L495-V533 HydrophobicContact CB-CG2 4.24Å; L495-V533 HydrophobicContact CD2-CG1 3.82Å; L495-V533 HydrophobicContact CD2-CG2 3.92Å; L495-V533 HydrophobicContact CG-CG1 4.03Å; L495-V533 HydrophobicContact CG-CG2 4.15Å
496	G	97.6	Very high	93.5	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.8	-48.3	176	0	0	0	0	0	112.4	P492 A498 L499 W500 S536	P492-G496 PolarHBondContact O-N 3.3Å; G496-A498 VanDerWaalsContact C-N 3.33Å; G496-A498 PolarHBondContact O-N 2.69Å; G496-L499 WeakPolarHBondContact O-CB 3.17Å; G496-L499 PolarHBondContact O-N 3.41Å; G496-W500 PolarHBondContact O-N 2.88Å; G496-S536 WeakPolarHBondContact CA-OG 3.3Å; G496-S536 WeakPolarHBondContact O-CB 3.49Å
497	R	98.3	Very high	93.6	Very high	17 Å²	17	27.5 Å²	27.5	6%	0.064	18%	0.177	C	C	.	.	H	α-helix	trans	-61.1	-39.9	177.8	179	59.1	64.2	-153.9	-10.5	112.7	E388 E447 M450 F493 L494 L499 W500 A501	E388-R497 IonicContact OE1-NH2 3.96Å; E388-R497 IonicContact OE2-CZ 3.45Å; E388-R497 IonicContact OE2-NH1 3.58Å; E388-R497 IonicContact OE2-NH2 2.74Å; E388-R497 PolarHBondContact OE2-NH2 2.84Å; E447-R497 HydrophobicContact CG-CB 3.8Å; E447-R497 HydrophobicContact CG-CG 3.93Å; E447-R497 IonicContact OE1-CZ 3.57Å; E447-R497 IonicContact OE1-NE 3.55Å; E447-R497 PolarHBondContact OE1-NE 3.06Å; E447-R497 IonicContact OE1-NH2 2.69Å; E447-R497 PolarHBondContact OE1-NH2 3.49Å; M450-R497 HydrophobicContact CB-CG 3.63Å; M450-R497 HydrophobicContact CE-CB 4.43Å; M450-R497 HydrophobicContact CE-CG 4.05Å; M450-R497 HydrophobicContact SD-CG 4.45Å; F493-R497 VanDerWaalsContact O-CB 3.3Å; F493-R497 WeakPolarHBondContact O-CB 3.25Å; F493-R497 PolarHBondContact O-N 3.26Å; L494-R497 PolarHBondContact O-N 3.38Å; R497-L499 VanDerWaalsContact C-N 3.34Å; R497-L499 PolarHBondContact O-N 2.84Å; R497-W500 VanDerWaalsContact NH1-CE3 3.33Å; R497-W500 PolarHBondContact O-N 3.13Å; R497-A501 VanDerWaalsContact O-CB 3.26Å; R497-A501 WeakPolarHBondContact O-CB 3.44Å; R497-A501 PolarHBondContact O-N 3.09Å
498	A	98.3	Very high	93.9	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.6	-38.3	177.8	0	0	0	0	0	112	M450 I481 L485 L494 L495 G496 A502	M450-A498 HydrophobicContact CE-CB 4.16Å; M450-A498 HydrophobicContact SD-CB 3.9Å; I481-A498 HydrophobicContact CG2-CB 3.94Å; I481-A498 VanDerWaalsContact CG2-O 3.23Å; I481-A498 WeakPolarHBondContact CG2-O 3.28Å; L485-A498 HydrophobicContact CD2-CB 3.52Å; L485-A498 HydrophobicContact CG-CB 3.91Å; L494-A498 WeakPolarHBondContact O-CB 3.47Å; L494-A498 PolarHBondContact O-N 2.98Å; L495-A498 PolarHBondContact O-N 3.03Å; G496-A498 VanDerWaalsContact C-N 3.33Å; G496-A498 PolarHBondContact O-N 2.69Å; A498-A502 VanDerWaalsContact O-CB 3.3Å; A498-A502 WeakPolarHBondContact O-CB 3.39Å; A498-A502 PolarHBondContact O-N 3.23Å
499	L	98.3	Very high	94.9	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-63.1	-48.5	172.8	-66.2	175.3	0	0	0	111.3	L485 L495 G496 R497 A502 S503 A520 V533 A537 A540	L485-L499 HydrophobicContact CD1-CD2 4.24Å; L485-L499 HydrophobicContact CD2-CD2 3.53Å; L485-L499 HydrophobicContact CD2-CG 3.72Å; L495-L499 WeakPolarHBondContact O-CG 3.45Å; L495-L499 PolarHBondContact O-N 2.79Å; L495-L499 VanDerWaalsContact O-N 3.14Å; G496-L499 WeakPolarHBondContact O-CB 3.17Å; G496-L499 PolarHBondContact O-N 3.41Å; R497-L499 VanDerWaalsContact C-N 3.34Å; R497-L499 PolarHBondContact O-N 2.84Å; L499-A502 PolarHBondContact O-N 3.36Å; L499-S503 PolarHBondContact O-N 2.98Å; L499-A520 HydrophobicContact CD2-CB 4.09Å; L499-V533 HydrophobicContact CD1-CG1 4.26Å; L499-A537 HydrophobicContact CD1-CB 3.97Å; L499-A540 HydrophobicContact CB-CB 4.34Å; L499-A540 WeakPolarHBondContact O-CB 3.08Å
500	W	98.3	Very high	95.6	Very high	24 Å²	24	19.9 Å²	19.9	9%	0.091	13%	0.128	C	C	.	.	H	α-helix	trans	-59	-50.5	177.2	173	91.6	0	0	0	111.2	L451 G496 R497 A502 S503 R504	L451-W500 HydrophobicContact CD1-CH2 3.98Å; L451-W500 HydrophobicContact CD1-CZ3 4.34Å; G496-W500 PolarHBondContact O-N 2.88Å; R497-W500 VanDerWaalsContact NH1-CE3 3.33Å; R497-W500 PolarHBondContact O-N 3.13Å; W500-A502 VanDerWaalsContact C-N 3.35Å; W500-A502 PolarHBondContact O-N 3.05Å; W500-S503 WeakPolarHBondContact O-CB 3.48Å; W500-S503 PolarHBondContact O-N 3.21Å; W500-S503 PolarHBondContact O-OG 2.96Å; W500-R504 HydrophobicContact CD2-CG 4.12Å; W500-R504 HydrophobicContact CE3-CG 4.26Å; W500-R504 HydrophobicContact CH2-CG 4.2Å; W500-R504 HydrophobicContact CZ2-CG 4.02Å; W500-R504 HydrophobicContact CZ3-CG 4.3Å; W500-R504 WeakPolarHBondContact O-CG 3.44Å; W500-R504 PolarHBondContact O-N 3.29Å
501	A	98.1	Very high	95.8	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.2	-39.9	-177.9	0	0	0	0	0	111.9	M450 I481 R497 S503 R504 F505	M450-A501 HydrophobicContact CB-CB 3.93Å; M450-A501 HydrophobicContact CG-CB 4.2Å; M450-A501 HydrophobicContact SD-CB 4.21Å; I481-A501 HydrophobicContact CD1-CB 3.99Å; R497-A501 VanDerWaalsContact O-CB 3.26Å; R497-A501 WeakPolarHBondContact O-CB 3.44Å; R497-A501 PolarHBondContact O-N 3.09Å; A501-S503 VanDerWaalsContact C-N 3.29Å; A501-S503 PolarHBondContact O-N 3.4Å; A501-R504 WeakPolarHBondContact O-CB 3.46Å; A501-R504 PolarHBondContact O-N 2.95Å; A501-R504 VanDerWaalsContact O-N 3.12Å; A501-F505 VanDerWaalsContact O-CD2 3.31Å; A501-F505 WeakPolarHBondContact O-CD2 3.46Å; A501-F505 PolarHBondContact O-N 3.03Å
502	A	97.8	Very high	95.6	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-56.4	-44	173.3	0	0	0	0	0	111.5	I481 A498 L499 W500 R504 F505 M509 F517 Y544	I481-A502 HydrophobicContact CG2-CB 4.07Å; A498-A502 VanDerWaalsContact O-CB 3.3Å; A498-A502 WeakPolarHBondContact O-CB 3.39Å; A498-A502 PolarHBondContact O-N 3.23Å; L499-A502 PolarHBondContact O-N 3.36Å; W500-A502 VanDerWaalsContact C-N 3.35Å; W500-A502 PolarHBondContact O-N 3.05Å; A502-R504 VanDerWaalsContact C-N 3.29Å; A502-R504 PolarHBondContact O-N 3.14Å; A502-F505 PolarHBondContact O-N 3.11Å; A502-M509 WeakPolarHBondContact O-CE 3.34Å; A502-F517 HydrophobicContact CB-CB 4.19Å; A502-F517 HydrophobicContact CB-CD1 3.52Å; A502-F517 HydrophobicContact CB-CD2 4.22Å; A502-F517 HydrophobicContact CB-CE1 3.83Å; A502-F517 HydrophobicContact CB-CE2 4.47Å; A502-F517 HydrophobicContact CB-CG 3.74Å; A502-F517 HydrophobicContact CB-CZ 4.28Å; A502-Y544 WeakPolarHBondContact CB-OH 3.42Å
503	S	97.3	Very high	95.4	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.014	14%	0.144	C	C	.	.	H	α-helix	trans	-63.8	-33.4	178.1	80.5	0	0	0	0	113	L499 W500 A501 F505 T506 A540 Y544 Q547	L499-S503 PolarHBondContact O-N 2.98Å; W500-S503 WeakPolarHBondContact O-CB 3.48Å; W500-S503 PolarHBondContact O-N 3.21Å; W500-S503 PolarHBondContact O-OG 2.96Å; A501-S503 VanDerWaalsContact C-N 3.29Å; A501-S503 PolarHBondContact O-N 3.4Å; S503-F505 VanDerWaalsContact C-N 3.34Å; S503-F505 PolarHBondContact O-N 3.47Å; S503-T506 PolarHBondContact O-OG1 3.46Å; S503-A540 WeakPolarHBondContact CB-O 3.25Å; S503-Y544 PolarHBondContact N-OH 3.32Å; S503-Q547 PolarHBondContact O-NE2 2.92Å; S503-Q547 PolarHBondContact O-OE1 3.23Å
504	R	96.5	Very high	95.3	Very high	56 Å²	56	24.5 Å²	24.5	21%	0.211	14%	0.144	C	C	.	.	H	α-helix	trans	-64.6	-38.5	177.7	-62.5	-56	-68.1	169.2	-10.1	111.6	G454 K457 W500 A501 A502 T506 Q547	G454-R504 PolarHBondContact O-NE 3.33Å; K457-R504 HydrophobicContact CB-CB 4.44Å; K457-R504 HydrophobicContact CD-CB 3.97Å; K457-R504 WeakPolarHBondContact CD-O 3.17Å; K457-R504 PolarHBondContact NZ-O 2.84Å; W500-R504 HydrophobicContact CD2-CG 4.12Å; W500-R504 HydrophobicContact CE3-CG 4.26Å; W500-R504 HydrophobicContact CH2-CG 4.2Å; W500-R504 HydrophobicContact CZ2-CG 4.02Å; W500-R504 HydrophobicContact CZ3-CG 4.3Å; W500-R504 WeakPolarHBondContact O-CG 3.44Å; W500-R504 PolarHBondContact O-N 3.29Å; A501-R504 WeakPolarHBondContact O-CB 3.46Å; A501-R504 PolarHBondContact O-N 2.95Å; A501-R504 VanDerWaalsContact O-N 3.12Å; A502-R504 VanDerWaalsContact C-N 3.29Å; A502-R504 PolarHBondContact O-N 3.14Å; R504-T506 PolarHBondContact O-N 3.09Å; R504-Q547 PolarHBondContact O-OE1 3.17Å
505	F	96.6	Very high	95.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	20.1	-175.8	-70.6	-74.2	0	0	0	115	L453 K457 I460 T461 M473 F476 L477 A501 A502 S503 A507 A508 M509	L453-F505 HydrophobicContact CB-CE2 4.19Å; L453-F505 HydrophobicContact CB-CZ 3.95Å; L453-F505 WeakPolarHBondContact O-CZ 3.49Å; K457-F505 HydrophobicContact CB-CE1 4.03Å; K457-F505 HydrophobicContact CB-CZ 4.14Å; I460-F505 HydrophobicContact CG2-CE1 4.24Å; T461-F505 HydrophobicContact CG2-CD1 3.62Å; T461-F505 HydrophobicContact CG2-CE1 3.89Å; M473-F505 HydrophobicContact CE-CD1 3.95Å; M473-F505 HydrophobicContact CE-CE1 3.9Å; M473-F505 HydrophobicContact SD-CD1 4.14Å; F476-F505 HydrophobicContact CE1-CD2 4.19Å; F476-F505 AromaticContact CE1-CE2 3.9Å; F476-F505 HydrophobicContact CE1-CE2 3.9Å; F476-F505 HydrophobicContact CE1-CZ 4.44Å; L477-F505 HydrophobicContact CD2-CB 3.82Å; L477-F505 HydrophobicContact CD2-CG 4.46Å; A501-F505 VanDerWaalsContact O-CD2 3.31Å; A501-F505 WeakPolarHBondContact O-CD2 3.46Å; A501-F505 PolarHBondContact O-N 3.03Å; A502-F505 PolarHBondContact O-N 3.11Å; S503-F505 VanDerWaalsContact C-N 3.34Å; S503-F505 PolarHBondContact O-N 3.47Å; F505-A507 VanDerWaalsContact C-N 3.27Å; F505-A507 PolarHBondContact O-N 3.4Å; F505-A507 VanDerWaalsContact O-N 3.15Å; F505-A508 PolarHBondContact O-N 2.87Å; F505-M509 WeakPolarHBondContact O-CG 3.29Å
506	T	94.5	Very high	95	Very high	6 Å²	6	33.2 Å²	33.2	4%	0.037	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-50.9	-42.4	-176.9	-57.2	0	0	0	0	113.8	S503 R504 A508 M509 I514 Y544 L548	S503-T506 PolarHBondContact O-OG1 3.46Å; R504-T506 PolarHBondContact O-N 3.09Å; T506-A508 PolarHBondContact O-N 3.36Å; T506-M509 VanDerWaalsContact CA-CE 3.45Å; T506-M509 PolarHBondContact O-N 2.77Å; T506-I514 HydrophobicContact CG2-CD1 4.2Å; T506-Y544 HydrophobicContact CG2-CD1 4.14Å; T506-Y544 HydrophobicContact CG2-CE1 4.38Å; T506-Y544 VanDerWaalsContact OG1-CD1 3.27Å; T506-Y544 WeakPolarHBondContact OG1-CD1 3.45Å; T506-Y544 WeakPolarHBondContact OG1-CE1 3.4Å; T506-L548 HydrophobicContact CG2-CD2 3.67Å; T506-L548 HydrophobicContact CG2-CG 4.11Å
507	A	90.2	Very high	95	Very high	83 Å²	83	33.2 Å²	33.2	69%	0.686	18%	0.184	S	C	*	.	G	3₁₀ helix	trans	-64.6	-18.8	179.4	0	0	0	0	0	114.8	F505	F505-A507 VanDerWaalsContact C-N 3.27Å; F505-A507 PolarHBondContact O-N 3.4Å; F505-A507 VanDerWaalsContact O-N 3.15Å
508	A	90.9	Very high	94.9	Very high	41 Å²	41	32.5 Å²	32.5	34%	0.339	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-99	-1.6	-179.3	0	0	0	0	0	113.5	T461 M473 F505 T506	T461-A508 HydrophobicContact CG2-CB 4.24Å; M473-A508 HydrophobicContact CG-CB 4.02Å; M473-A508 HydrophobicContact SD-CB 4.32Å; F505-A508 PolarHBondContact O-N 2.87Å; T506-A508 PolarHBondContact O-N 3.36Å
509	M	93.2	Very high	94.8	Very high	20 Å²	20	37.4 Å²	37.4	10%	0.099	21%	0.205	C	C	.	.	S	Bend	trans	-95.2	150.8	-174.6	-66.7	-164.8	-82.6	0	0	113.1	L477 A502 F505 T506 L513 I514 F517 Y544	L477-M509 HydrophobicContact CD1-CG 3.79Å; L477-M509 HydrophobicContact CD2-CG 4.06Å; L477-M509 HydrophobicContact CD2-SD 4.19Å; A502-M509 WeakPolarHBondContact O-CE 3.34Å; F505-M509 WeakPolarHBondContact O-CG 3.29Å; T506-M509 VanDerWaalsContact CA-CE 3.45Å; T506-M509 PolarHBondContact O-N 2.77Å; M509-L513 HydrophobicContact CB-CB 4.29Å; M509-L513 HydrophobicContact SD-CB 4.46Å; M509-I514 HydrophobicContact CB-CD1 4.23Å; M509-I514 HydrophobicContact CB-CG1 3.65Å; M509-I514 HydrophobicContact CE-CG1 4.21Å; M509-F517 HydrophobicContact CE-CD2 4.13Å; M509-F517 HydrophobicContact SD-CD2 3.23Å; M509-F517 WeakPolarHBondContact SD-CD2 3.42Å; M509-F517 HydrophobicContact SD-CE2 3.31Å; M509-F517 WeakPolarHBondContact SD-CE2 3.23Å; M509-F517 HydrophobicContact SD-CG 4.36Å; M509-F517 HydrophobicContact SD-CZ 4.47Å; M509-Y544 HydrophobicContact CE-CE1 4.05Å
510	S	91.2	Very high	94.7	Very high	46 Å²	46	38.5 Å²	38.5	32%	0.322	21%	0.214	S	C	.	.			trans	-76.4	155.9	165.6	84.5	0	0	0	0	110.5	E512 L513 I514	S510-E512 VanDerWaalsContact CB-OE2 3.24Å; S510-E512 WeakPolarHBondContact CB-OE2 3.47Å; S510-E512 PolarHBondContact O-N 3.24Å; S510-E512 VanDerWaalsContact O-N 3.15Å; S510-E512 PolarHBondContact OG-OE2 2.8Å; S510-L513 PolarHBondContact O-N 3.07Å; S510-L513 PolarHBondContact OG-N 3.14Å; S510-I514 WeakPolarHBondContact O-CG1 3.41Å; S510-I514 PolarHBondContact O-N 3.31Å
511	P	89.3	Confident	94.7	Very high	65 Å²	65	37.4 Å²	37.4	42%	0.422	21%	0.21	S	C	.	.	H	α-helix	trans	-54.2	-34.7	177.5	-27.5	36.2	0	0	0	113.8	I514 Q515 I556	P511-I514 PolarHBondContact O-N 3.36Å; P511-Q515 WeakPolarHBondContact O-CG 3.41Å; P511-Q515 PolarHBondContact O-N 2.94Å; P511-I556 HydrophobicContact CB-CD1 4.16Å
512	E	91.4	Very high	94.6	Very high	115 Å²	115	38.5 Å²	38.5	54%	0.537	22%	0.217	S	C	.	.	H	α-helix	trans	-69.2	-35	178.7	-56.1	73.7	-158.5	0	0	112.5	S510 Q516	S510-E512 VanDerWaalsContact CB-OE2 3.24Å; S510-E512 WeakPolarHBondContact CB-OE2 3.47Å; S510-E512 PolarHBondContact O-N 3.24Å; S510-E512 VanDerWaalsContact O-N 3.15Å; S510-E512 PolarHBondContact OG-OE2 2.8Å; E512-Q516 WeakPolarHBondContact O-CG 3.24Å; E512-Q516 PolarHBondContact O-N 3.17Å; E512-Q516 PolarHBondContact O-NE2 2.68Å
513	L	93.5	Very high	94.5	Very high	12 Å²	12	41.2 Å²	41.2	6%	0.063	24%	0.236	C	C	.	.	H	α-helix	trans	-71.4	-44	173.8	-77.4	176.8	0	0	0	110.6	L482 M509 S510 Q515 Q516 F517	L482-L513 HydrophobicContact CD2-CD2 4.07Å; M509-L513 HydrophobicContact CB-CB 4.29Å; M509-L513 HydrophobicContact SD-CB 4.46Å; S510-L513 PolarHBondContact O-N 3.07Å; S510-L513 PolarHBondContact OG-N 3.14Å; L513-Q515 VanDerWaalsContact C-N 3.27Å; L513-Q515 PolarHBondContact O-N 3.27Å; L513-Q516 PolarHBondContact O-N 3.27Å; L513-Q516 VanDerWaalsContact O-N 3.08Å; L513-F517 HydrophobicContact CB-CD2 4.36Å; L513-F517 HydrophobicContact CB-CE2 4.22Å; L513-F517 HydrophobicContact CD2-CE2 4.47Å; L513-F517 WeakPolarHBondContact O-CD2 3.35Å; L513-F517 PolarHBondContact O-N 2.93Å
514	I	94.6	Very high	94.4	Very high	9 Å²	9	41.3 Å²	41.3	5%	0.046	24%	0.237	C	C	.	.	H	α-helix	trans	-55.4	-45.4	176.5	-63.8	170.7	0	0	0	110.2	T506 M509 S510 P511 Q516 F517 L518 I556	T506-I514 HydrophobicContact CG2-CD1 4.2Å; M509-I514 HydrophobicContact CB-CD1 4.23Å; M509-I514 HydrophobicContact CB-CG1 3.65Å; M509-I514 HydrophobicContact CE-CG1 4.21Å; S510-I514 WeakPolarHBondContact O-CG1 3.41Å; S510-I514 PolarHBondContact O-N 3.31Å; P511-I514 PolarHBondContact O-N 3.36Å; I514-Q516 VanDerWaalsContact C-N 3.35Å; I514-Q516 PolarHBondContact O-N 2.91Å; I514-F517 PolarHBondContact O-N 3.17Å; I514-L518 HydrophobicContact CG2-CD1 3.77Å; I514-L518 HydrophobicContact CG2-CG 4.13Å; I514-L518 WeakPolarHBondContact O-CB 3.3Å; I514-L518 VanDerWaalsContact O-CG 3.31Å; I514-L518 WeakPolarHBondContact O-CG 3.38Å; I514-L518 PolarHBondContact O-N 3.3Å; I514-I556 HydrophobicContact CB-CG2 4.35Å; I514-I556 HydrophobicContact CD1-CD1 4.42Å; I514-I556 HydrophobicContact CG2-CG2 3.76Å
515	Q	94.2	Very high	94.4	Very high	103 Å²	103	38.8 Å²	38.8	48%	0.481	23%	0.228	S	C	.	.	H	α-helix	trans	-60.3	-41	177.3	-75.9	-176	-2	0	0	113.3	P511 L513 Q519 I556	P511-Q515 WeakPolarHBondContact O-CG 3.41Å; P511-Q515 PolarHBondContact O-N 2.94Å; L513-Q515 VanDerWaalsContact C-N 3.27Å; L513-Q515 PolarHBondContact O-N 3.27Å; Q515-Q519 WeakPolarHBondContact O-CB 3.19Å; Q515-Q519 PolarHBondContact O-N 2.9Å; Q515-I556 HydrophobicContact CG-CG2 4.05Å
516	Q	95.4	Very high	94.3	Very high	96 Å²	96	44 Å²	44	45%	0.449	25%	0.252	S	S	.	.	H	α-helix	trans	-65.6	-43.1	177.3	-73.5	174.3	72.2	0	0	111.6	L482 E512 L513 I514 Q519 A520	L482-Q516 HydrophobicContact CD1-CB 4.23Å; E512-Q516 WeakPolarHBondContact O-CG 3.24Å; E512-Q516 PolarHBondContact O-N 3.17Å; E512-Q516 PolarHBondContact O-NE2 2.68Å; L513-Q516 PolarHBondContact O-N 3.27Å; L513-Q516 VanDerWaalsContact O-N 3.08Å; I514-Q516 VanDerWaalsContact C-N 3.35Å; I514-Q516 PolarHBondContact O-N 2.91Å; Q516-Q519 PolarHBondContact O-N 3.39Å; Q516-A520 WeakPolarHBondContact O-CB 3.49Å; Q516-A520 PolarHBondContact O-N 3.17Å
517	F	97.3	Very high	94	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-68.5	-39.3	177.6	-70.7	-60.7	0	0	0	112.8	I481 L482 L485 A502 M509 L513 I514 Q519 A520 T521 Y544	I481-F517 HydrophobicContact CB-CE1 4.32Å; I481-F517 HydrophobicContact CB-CZ 4.29Å; I481-F517 HydrophobicContact CG2-CE1 3.72Å; I481-F517 HydrophobicContact CG2-CZ 4.09Å; L482-F517 HydrophobicContact CB-CE1 3.93Å; L482-F517 HydrophobicContact CB-CZ 3.84Å; L482-F517 HydrophobicContact CD1-CD1 4.33Å; L482-F517 HydrophobicContact CD1-CE1 3.95Å; L482-F517 HydrophobicContact CD1-CZ 4.32Å; L485-F517 HydrophobicContact CD1-CD1 3.35Å; L485-F517 HydrophobicContact CD1-CE1 3.49Å; L485-F517 VanDerWaalsContact CD1-CE1 3.49Å; A502-F517 HydrophobicContact CB-CB 4.19Å; A502-F517 HydrophobicContact CB-CD1 3.52Å; A502-F517 HydrophobicContact CB-CD2 4.22Å; A502-F517 HydrophobicContact CB-CE1 3.83Å; A502-F517 HydrophobicContact CB-CE2 4.47Å; A502-F517 HydrophobicContact CB-CG 3.74Å; A502-F517 HydrophobicContact CB-CZ 4.28Å; M509-F517 HydrophobicContact CE-CD2 4.13Å; M509-F517 HydrophobicContact SD-CD2 3.23Å; M509-F517 WeakPolarHBondContact SD-CD2 3.42Å; M509-F517 HydrophobicContact SD-CE2 3.31Å; M509-F517 WeakPolarHBondContact SD-CE2 3.23Å; M509-F517 HydrophobicContact SD-CG 4.36Å; M509-F517 HydrophobicContact SD-CZ 4.47Å; L513-F517 HydrophobicContact CB-CD2 4.36Å; L513-F517 HydrophobicContact CB-CE2 4.22Å; L513-F517 HydrophobicContact CD2-CE2 4.47Å; L513-F517 WeakPolarHBondContact O-CD2 3.35Å; L513-F517 PolarHBondContact O-N 2.93Å; I514-F517 PolarHBondContact O-N 3.17Å; F517-Q519 VanDerWaalsContact C-N 3.34Å; F517-Q519 PolarHBondContact O-N 3.48Å; F517-A520 PolarHBondContact O-N 3Å; F517-T521 WeakPolarHBondContact O-CB 3.44Å; F517-T521 PolarHBondContact O-N 2.92Å; F517-T521 PolarHBondContact O-OG1 3.36Å; F517-Y544 VanDerWaalsContact CB-OH 3.28Å; F517-Y544 WeakPolarHBondContact CB-OH 3.43Å
518	L	96.8	Very high	94.2	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-61.9	-42.9	173.3	-73.6	174.8	0	0	0	111.5	I514 A520 T521 V522 Y544 I556 L557 F560	I514-L518 HydrophobicContact CG2-CD1 3.77Å; I514-L518 HydrophobicContact CG2-CG 4.13Å; I514-L518 WeakPolarHBondContact O-CB 3.3Å; I514-L518 VanDerWaalsContact O-CG 3.31Å; I514-L518 WeakPolarHBondContact O-CG 3.38Å; I514-L518 PolarHBondContact O-N 3.3Å; L518-A520 VanDerWaalsContact C-N 3.33Å; L518-A520 PolarHBondContact O-N 3.38Å; L518-T521 PolarHBondContact O-N 3.48Å; L518-V522 WeakPolarHBondContact O-CG2 3.23Å; L518-V522 PolarHBondContact O-N 3.44Å; L518-Y544 HydrophobicContact CD2-CD1 4.26Å; L518-Y544 HydrophobicContact CD2-CD2 3.53Å; L518-Y544 HydrophobicContact CD2-CE2 3.93Å; L518-Y544 HydrophobicContact CD2-CG 3.74Å; L518-I556 HydrophobicContact CD1-CG2 4.24Å; L518-L557 HydrophobicContact CD1-CD1 3.99Å; L518-L557 HydrophobicContact CD2-CD1 3.53Å; L518-L557 HydrophobicContact CG-CD1 4.41Å; L518-F560 HydrophobicContact CB-CD1 4.26Å; L518-F560 HydrophobicContact CB-CD2 3.95Å; L518-F560 HydrophobicContact CB-CE1 4.18Å; L518-F560 HydrophobicContact CB-CE2 3.86Å; L518-F560 HydrophobicContact CB-CG 4.15Å; L518-F560 HydrophobicContact CB-CZ 3.97Å; L518-F560 HydrophobicContact CD1-CD2 3.82Å; L518-F560 HydrophobicContact CD1-CE2 3.87Å; L518-F560 HydrophobicContact CG-CD2 4.49Å
519	Q	96.1	Very high	94.4	Very high	103 Å²	103	48 Å²	48	48%	0.481	26%	0.261	S	S	.	.	H	α-helix	trans	-61.8	-41.5	175	-176.5	61.7	54.3	0	0	112	Q515 Q516 F517 S523 F560	Q515-Q519 WeakPolarHBondContact O-CB 3.19Å; Q515-Q519 PolarHBondContact O-N 2.9Å; Q516-Q519 PolarHBondContact O-N 3.39Å; F517-Q519 VanDerWaalsContact C-N 3.34Å; F517-Q519 PolarHBondContact O-N 3.48Å; Q519-S523 PolarHBondContact O-N 3.48Å; Q519-S523 VanDerWaalsContact O-N 3.08Å; Q519-S523 PolarHBondContact O-OG 3.24Å; Q519-F560 HydrophobicContact CB-CE1 4.05Å
520	A	96.3	Very high	94.5	Very high	26 Å²	26	49.4 Å²	49.4	22%	0.215	27%	0.272	C	S	.	.	H	α-helix	trans	-65.6	-40.5	175.3	0	0	0	0	0	111.7	L485 L499 Q516 F517 L518 S523 G524	L485-A520 HydrophobicContact CD1-CB 3.9Å; L499-A520 HydrophobicContact CD2-CB 4.09Å; Q516-A520 WeakPolarHBondContact O-CB 3.49Å; Q516-A520 PolarHBondContact O-N 3.17Å; F517-A520 PolarHBondContact O-N 3Å; L518-A520 VanDerWaalsContact C-N 3.33Å; L518-A520 PolarHBondContact O-N 3.38Å; A520-S523 CarbonylContact O-C 3.6Å; A520-S523 WeakPolarHBondContact O-CA 3.48Å; A520-S523 WeakPolarHBondContact O-CB 3.3Å; A520-S523 PolarHBondContact O-N 2.71Å; A520-S523 VanDerWaalsContact O-N 3.15Å; A520-G524 PolarHBondContact O-N 2.97Å
521	T	97.6	Very high	94.8	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-64.2	-45	178.7	-53.5	0	0	0	0	111.4	F517 L518 S523 G524 L525 A537 A540 I541	F517-T521 WeakPolarHBondContact O-CB 3.44Å; F517-T521 PolarHBondContact O-N 2.92Å; F517-T521 PolarHBondContact O-OG1 3.36Å; L518-T521 PolarHBondContact O-N 3.48Å; T521-S523 VanDerWaalsContact C-N 3.27Å; T521-S523 PolarHBondContact O-N 3.27Å; T521-G524 WeakPolarHBondContact O-CA 3.34Å; T521-G524 PolarHBondContact O-N 3.42Å; T521-L525 PolarHBondContact O-N 3.36Å; T521-A537 HydrophobicContact CG2-CB 3.96Å; T521-A537 WeakPolarHBondContact CG2-O 3.33Å; T521-A540 HydrophobicContact CG2-CB 3.96Å; T521-I541 HydrophobicContact CG2-CD1 4.08Å; T521-I541 HydrophobicContact CG2-CG1 3.66Å
522	V	96.2	Very high	95.1	Very high	23 Å²	23	46.6 Å²	46.6	14%	0.139	25%	0.252	C	S	.	.	H	α-helix	trans	-60.6	-38.8	172.7	170.7	0	0	0	0	111.4	L518 G524 L525 F560 I564	L518-V522 WeakPolarHBondContact O-CG2 3.23Å; L518-V522 PolarHBondContact O-N 3.44Å; V522-G524 VanDerWaalsContact C-N 3.26Å; V522-G524 PolarHBondContact O-N 2.92Å; V522-L525 PolarHBondContact O-N 3.17Å; V522-F560 HydrophobicContact CG2-CB 4.17Å; V522-F560 HydrophobicContact CG2-CD1 4.09Å; V522-I564 HydrophobicContact CG2-CG1 3.87Å
523	S	95.4	Very high	95.4	Very high	57 Å²	57	41.1 Å²	41.1	40%	0.399	23%	0.227	S	C	.	.	H	α-helix	trans	-66.9	-30.2	175.1	-52.9	0	0	0	0	112.2	Q519 A520 T521 L525 H526	Q519-S523 PolarHBondContact O-N 3.48Å; Q519-S523 VanDerWaalsContact O-N 3.08Å; Q519-S523 PolarHBondContact O-OG 3.24Å; A520-S523 CarbonylContact O-C 3.6Å; A520-S523 WeakPolarHBondContact O-CA 3.48Å; A520-S523 WeakPolarHBondContact O-CB 3.3Å; A520-S523 PolarHBondContact O-N 2.71Å; A520-S523 VanDerWaalsContact O-N 3.15Å; T521-S523 VanDerWaalsContact C-N 3.27Å; T521-S523 PolarHBondContact O-N 3.27Å; S523-L525 VanDerWaalsContact C-N 3.3Å; S523-L525 PolarHBondContact O-N 3.48Å; S523-H526 WeakPolarHBondContact O-CB 3.29Å; S523-H526 PolarHBondContact O-N 2.76Å
524	G	96	Very high	95.6	Very high	4 Å²	4	40.8 Å²	40.8	4%	0.041	23%	0.225	C	C	.	.	H	α-helix	trans	-66.9	-25.1	174.3	0	0	0	0	0	114	A520 T521 V522 R534	A520-G524 PolarHBondContact O-N 2.97Å; T521-G524 WeakPolarHBondContact O-CA 3.34Å; T521-G524 PolarHBondContact O-N 3.42Å; V522-G524 VanDerWaalsContact C-N 3.26Å; V522-G524 PolarHBondContact O-N 2.92Å; G524-R534 WeakPolarHBondContact O-CA 3.46Å; G524-R534 VanDerWaalsContact O-CG 3.26Å; G524-R534 WeakPolarHBondContact O-CG 3.16Å
525	L	95.8	Very high	95.8	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.01	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-19.2	177.6	-73.1	177.9	0	0	0	114.4	T521 V522 S523 R534 A537 V538 I541	T521-L525 PolarHBondContact O-N 3.36Å; V522-L525 PolarHBondContact O-N 3.17Å; S523-L525 VanDerWaalsContact C-N 3.3Å; S523-L525 PolarHBondContact O-N 3.48Å; L525-R534 PolarHBondContact O-NE 3.14Å; L525-A537 HydrophobicContact CD2-CB 3.95Å; L525-A537 HydrophobicContact CG-CB 4.13Å; L525-V538 HydrophobicContact CD2-CG2 3.74Å; L525-I541 HydrophobicContact CD1-CD1 3.4Å; L525-I541 VanDerWaalsContact CD1-CD1 3.4Å; L525-I541 HydrophobicContact CD2-CD1 4.11Å; L525-I541 HydrophobicContact CG-CD1 3.93Å
526	H	93.4	Very high	96	Very high	111 Å²	111	36 Å²	36	51%	0.514	20%	0.203	S	C	.	.	S	Bend	trans	-60.9	144.3	-171.8	-170	-95.7	0	0	0	112.3	S523 S528 Q529	S523-H526 WeakPolarHBondContact O-CB 3.29Å; S523-H526 PolarHBondContact O-N 2.76Å; H526-S528 WeakPolarHBondContact ND1-CB 3.43Å; H526-S528 PolarHBondContact ND1-N 3.39Å; H526-S528 PolarHBondContact ND1-OG 2.81Å; H526-S528 PolarHBondContact O-N 3.3Å; H526-Q529 WeakPolarHBondContact O-CB 3.45Å; H526-Q529 PolarHBondContact O-N 3.37Å
527	D	90.2	Very high	96.2	Very high	75 Å²	75	31.4 Å²	31.4	40%	0.401	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-16.7	-177.3	-76.7	-25	0	0	0	114.8	Q529 R534 Q574	D527-Q529 PolarHBondContact O-N 3.38Å; D527-R534 IonicContact OD1-CZ 3.93Å; D527-R534 VanDerWaalsContact OD1-CZ 3.22Å; D527-R534 IonicContact OD1-NH1 3.17Å; D527-R534 PolarHBondContact OD1-NH1 3.44Å; D527-R534 IonicContact OD1-NH2 2.87Å; D527-R534 PolarHBondContact OD1-NH2 3.2Å; D527-Q574 PolarHBondContact OD1-NE2 3.38Å
528	S	92.8	Very high	96.2	Very high	88 Å²	88	31.4 Å²	31.4	62%	0.615	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-13.6	174.4	64.4	0	0	0	0	113.7	H526	H526-S528 WeakPolarHBondContact ND1-CB 3.43Å; H526-S528 PolarHBondContact ND1-N 3.39Å; H526-S528 PolarHBondContact ND1-OG 2.81Å; H526-S528 PolarHBondContact O-N 3.3Å
529	Q	95.2	Very high	96.3	Very high	51 Å²	51	33.2 Å²	33.2	24%	0.238	19%	0.188	C	C	.	.	S	Bend	trans	-85.5	148.1	179.8	-62	-63.3	-14.9	0	0	110.7	H526 D527 V533 R534	H526-Q529 WeakPolarHBondContact O-CB 3.45Å; H526-Q529 PolarHBondContact O-N 3.37Å; D527-Q529 PolarHBondContact O-N 3.38Å; Q529-V533 HydrophobicContact CB-CB 4.26Å; Q529-V533 HydrophobicContact CB-CG1 4.13Å; Q529-V533 HydrophobicContact CG-CG1 4.27Å; Q529-R534 HydrophobicContact CB-CG 3.83Å; Q529-R534 WeakPolarHBondContact O-CD 3.32Å
530	P	95.8	Very high	96.4	Very high	49 Å²	49	28.3 Å²	28.3	32%	0.318	17%	0.166	S	C	.	.			trans	-65.5	155.6	173.7	25.2	-29	0	0	0	111.1	P492 S532 V533 R534	P492-P530 HydrophobicContact CB-CB 4.41Å; P492-P530 HydrophobicContact CB-CG 3.45Å; P492-P530 VanDerWaalsContact CB-CG 3.45Å; P492-P530 HydrophobicContact CG-CG 4.32Å; P530-S532 VanDerWaalsContact C-N 3.31Å; P530-S532 PolarHBondContact O-N 3.25Å; P530-V533 HydrophobicContact CG-CB 4.31Å; P530-V533 HydrophobicContact CG-CG2 3.8Å; P530-V533 PolarHBondContact O-N 3.15Å; P530-V533 VanDerWaalsContact O-N 3.14Å; P530-R534 PolarHBondContact O-N 3.5Å
531	P	96.7	Very high	96.5	Very high	43 Å²	43	27.1 Å²	27.1	28%	0.279	16%	0.156	S	C	.	.	H	α-helix	trans	-53.8	-42.1	-175.1	-28.3	36	0	0	0	114.2	P381 V533 R534 I535 F575	P381-P531 HydrophobicContact CB-CB 3.67Å; P381-P531 HydrophobicContact CB-CG 4.45Å; P381-P531 HydrophobicContact CG-CB 3.53Å; P381-P531 HydrophobicContact CG-CG 3.78Å; P531-V533 VanDerWaalsContact C-N 3.32Å; P531-V533 PolarHBondContact O-N 3.06Å; P531-R534 PolarHBondContact O-N 3.47Å; P531-R534 VanDerWaalsContact O-N 3.11Å; P531-I535 HydrophobicContact CB-CD1 4.34Å; P531-I535 WeakPolarHBondContact O-CB 3.14Å; P531-I535 WeakPolarHBondContact O-CD1 3.34Å; P531-I535 VanDerWaalsContact O-CG1 3.24Å; P531-I535 WeakPolarHBondContact O-CG1 3.36Å; P531-I535 PolarHBondContact O-N 3.06Å; P531-F575 HydrophobicContact CB-CE1 4.24Å; P531-F575 HydrophobicContact CB-CZ 3.93Å; P531-F575 HydrophobicContact CG-CE1 4.41Å; P531-F575 HydrophobicContact CG-CZ 3.96Å
532	S	96.9	Very high	96.5	Very high	8 Å²	8	31.9 Å²	31.9	6%	0.056	17%	0.173	C	C	.	.	H	α-helix	trans	-59.9	-37.8	-179.3	54.8	0	0	0	0	113.5	F384 P530 S536	F384-S532 WeakPolarHBondContact CE1-O 3Å; P530-S532 VanDerWaalsContact C-N 3.31Å; P530-S532 PolarHBondContact O-N 3.25Å; S532-S536 WeakPolarHBondContact O-CB 3.42Å; S532-S536 PolarHBondContact O-N 3.14Å; S532-S536 PolarHBondContact O-OG 3.16Å
533	V	97.8	Very high	96.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-68	-43.2	175.5	173.6	0	0	0	0	110.6	P492 L495 L499 Q529 P530 P531 S536 A537	P492-V533 HydrophobicContact CB-CG2 3.73Å; P492-V533 WeakPolarHBondContact O-CG2 3.39Å; L495-V533 HydrophobicContact CB-CG2 4.24Å; L495-V533 HydrophobicContact CD2-CG1 3.82Å; L495-V533 HydrophobicContact CD2-CG2 3.92Å; L495-V533 HydrophobicContact CG-CG1 4.03Å; L495-V533 HydrophobicContact CG-CG2 4.15Å; L499-V533 HydrophobicContact CD1-CG1 4.26Å; Q529-V533 HydrophobicContact CB-CB 4.26Å; Q529-V533 HydrophobicContact CB-CG1 4.13Å; Q529-V533 HydrophobicContact CG-CG1 4.27Å; P530-V533 HydrophobicContact CG-CB 4.31Å; P530-V533 HydrophobicContact CG-CG2 3.8Å; P530-V533 PolarHBondContact O-N 3.15Å; P530-V533 VanDerWaalsContact O-N 3.14Å; P531-V533 VanDerWaalsContact C-N 3.32Å; P531-V533 PolarHBondContact O-N 3.06Å; V533-S536 PolarHBondContact O-N 3.21Å; V533-A537 WeakPolarHBondContact O-CB 3.16Å; V533-A537 PolarHBondContact O-N 3.4Å
534	R	98	Very high	96.6	Very high	6 Å²	6	28.2 Å²	28.2	2%	0.023	15%	0.149	C	C	.	.	H	α-helix	trans	-64.5	-44.8	179.7	-62.2	174.7	71.4	-167.8	1.7	111	G524 L525 D527 Q529 P530 P531 A537 V538 L571	G524-R534 WeakPolarHBondContact O-CA 3.46Å; G524-R534 VanDerWaalsContact O-CG 3.26Å; G524-R534 WeakPolarHBondContact O-CG 3.16Å; L525-R534 PolarHBondContact O-NE 3.14Å; D527-R534 IonicContact OD1-CZ 3.93Å; D527-R534 VanDerWaalsContact OD1-CZ 3.22Å; D527-R534 IonicContact OD1-NH1 3.17Å; D527-R534 PolarHBondContact OD1-NH1 3.44Å; D527-R534 IonicContact OD1-NH2 2.87Å; D527-R534 PolarHBondContact OD1-NH2 3.2Å; Q529-R534 HydrophobicContact CB-CG 3.83Å; Q529-R534 WeakPolarHBondContact O-CD 3.32Å; P530-R534 PolarHBondContact O-N 3.5Å; P531-R534 PolarHBondContact O-N 3.47Å; P531-R534 VanDerWaalsContact O-N 3.11Å; R534-A537 WeakPolarHBondContact O-CB 3.22Å; R534-A537 PolarHBondContact O-N 2.9Å; R534-V538 VanDerWaalsContact O-CG2 3.28Å; R534-V538 WeakPolarHBondContact O-CG2 3.32Å; R534-V538 PolarHBondContact O-N 3.17Å; R534-L571 HydrophobicContact CB-CD1 4.13Å
535	I	98.1	Very high	96.7	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.5	-46.4	175.5	-69	159.1	0	0	0	110.5	P381 F384 V385 P531 A537 V538 R539 V579 L582	P381-I535 HydrophobicContact CB-CD1 3.94Å; F384-I535 HydrophobicContact CD1-CB 4.23Å; F384-I535 HydrophobicContact CD1-CD1 4.05Å; F384-I535 HydrophobicContact CD1-CG2 3.94Å; F384-I535 HydrophobicContact CE1-CB 4.09Å; F384-I535 HydrophobicContact CE1-CG2 3.82Å; V385-I535 HydrophobicContact CG2-CD1 3.87Å; V385-I535 HydrophobicContact CG2-CG1 4.21Å; V385-I535 HydrophobicContact CG2-CG2 3.69Å; P531-I535 HydrophobicContact CB-CD1 4.34Å; P531-I535 WeakPolarHBondContact O-CB 3.14Å; P531-I535 WeakPolarHBondContact O-CD1 3.34Å; P531-I535 VanDerWaalsContact O-CG1 3.24Å; P531-I535 WeakPolarHBondContact O-CG1 3.36Å; P531-I535 PolarHBondContact O-N 3.06Å; I535-A537 VanDerWaalsContact C-N 3.28Å; I535-A537 PolarHBondContact O-N 2.65Å; I535-V538 WeakPolarHBondContact O-CB 3.16Å; I535-V538 PolarHBondContact O-N 2.79Å; I535-V538 VanDerWaalsContact O-N 3.11Å; I535-R539 PolarHBondContact O-N 3.02Å; I535-V579 HydrophobicContact CD1-CG2 3.73Å; I535-V579 HydrophobicContact CG1-CG1 4.34Å; I535-V579 HydrophobicContact CG1-CG2 4.07Å; I535-L582 HydrophobicContact CG2-CD2 3.89Å
536	S	98.3	Very high	96.6	Very high	10 Å²	10	30.4 Å²	30.4	7%	0.07	16%	0.16	C	C	.	.	H	α-helix	trans	-62.3	-36.4	176.5	-57	0	0	0	0	112.3	G496 S532 V533 R539 A540	G496-S536 WeakPolarHBondContact CA-OG 3.3Å; G496-S536 WeakPolarHBondContact O-CB 3.49Å; S532-S536 WeakPolarHBondContact O-CB 3.42Å; S532-S536 PolarHBondContact O-N 3.14Å; S532-S536 PolarHBondContact O-OG 3.16Å; V533-S536 PolarHBondContact O-N 3.21Å; S536-R539 PolarHBondContact O-N 3.25Å; S536-A540 WeakPolarHBondContact O-CB 3.49Å; S536-A540 PolarHBondContact O-N 2.7Å
537	A	98.5	Very high	96.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-65.9	-36.9	174.6	0	0	0	0	0	112.2	L499 T521 L525 V533 R534 I535 A540 I541	L499-A537 HydrophobicContact CD1-CB 3.97Å; T521-A537 HydrophobicContact CG2-CB 3.96Å; T521-A537 WeakPolarHBondContact CG2-O 3.33Å; L525-A537 HydrophobicContact CD2-CB 3.95Å; L525-A537 HydrophobicContact CG-CB 4.13Å; V533-A537 WeakPolarHBondContact O-CB 3.16Å; V533-A537 PolarHBondContact O-N 3.4Å; R534-A537 WeakPolarHBondContact O-CB 3.22Å; R534-A537 PolarHBondContact O-N 2.9Å; I535-A537 VanDerWaalsContact C-N 3.28Å; I535-A537 PolarHBondContact O-N 2.65Å; A537-A540 PolarHBondContact O-N 3Å; A537-I541 WeakPolarHBondContact O-CD1 3.32Å; A537-I541 VanDerWaalsContact O-CG1 3.24Å; A537-I541 WeakPolarHBondContact O-CG1 3.44Å; A537-I541 PolarHBondContact O-N 2.91Å
538	V	98.6	Very high	96.8	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-62.7	-51	173.7	178	0	0	0	0	110.4	L525 R534 I535 A540 I541 W542 L568 L571 L582 V583 T586	L525-V538 HydrophobicContact CD2-CG2 3.74Å; R534-V538 VanDerWaalsContact O-CG2 3.28Å; R534-V538 WeakPolarHBondContact O-CG2 3.32Å; R534-V538 PolarHBondContact O-N 3.17Å; I535-V538 WeakPolarHBondContact O-CB 3.16Å; I535-V538 PolarHBondContact O-N 2.79Å; I535-V538 VanDerWaalsContact O-N 3.11Å; V538-A540 VanDerWaalsContact C-N 3.27Å; V538-A540 PolarHBondContact O-N 3.1Å; V538-I541 WeakPolarHBondContact O-CB 3.46Å; V538-I541 PolarHBondContact O-N 2.76Å; V538-I541 VanDerWaalsContact O-N 3.11Å; V538-W542 PolarHBondContact O-N 3.01Å; V538-L568 HydrophobicContact CG1-CD2 4.07Å; V538-L568 HydrophobicContact CG2-CD2 3.92Å; V538-L571 HydrophobicContact CG2-CD2 3.48Å; V538-L571 VanDerWaalsContact CG2-CD2 3.48Å; V538-L582 HydrophobicContact CB-CD2 4.36Å; V538-L582 HydrophobicContact CG1-CD1 4.32Å; V538-L582 HydrophobicContact CG1-CD2 4.12Å; V538-L582 HydrophobicContact CG1-CG 3.75Å; V538-V583 HydrophobicContact CG1-CG2 4.3Å; V538-V583 HydrophobicContact CG2-CG2 4.29Å; V538-T586 HydrophobicContact CG1-CG2 3.97Å; V538-T586 WeakPolarHBondContact CG1-OG1 3.44Å
539	R	98.1	Very high	96.8	Very high	40 Å²	40	22.3 Å²	22.3	15%	0.151	11%	0.109	C	C	.	.	H	α-helix	trans	-56.9	-40.9	174.9	-67.6	-169.1	-178.4	-84.6	3.9	111.6	V385 D389 I535 S536 W542 G543 L582	V385-R539 PolarHBondContact O-NH2 3.15Å; D389-R539 IonicContact OD2-CZ 3.29Å; D389-R539 VanDerWaalsContact OD2-CZ 3.3Å; D389-R539 IonicContact OD2-NH1 2.87Å; D389-R539 PolarHBondContact OD2-NH1 3.22Å; D389-R539 IonicContact OD2-NH2 3.82Å; D389-R539 PolarHBondContact OD2-NH2 3.42Å; I535-R539 PolarHBondContact O-N 3.02Å; S536-R539 PolarHBondContact O-N 3.25Å; R539-W542 PolarHBondContact O-N 3.36Å; R539-G543 PolarHBondContact O-N 3.4Å; R539-L582 HydrophobicContact CG-CD1 3.94Å; R539-L582 HydrophobicContact CG-CD2 3.84Å
540	A	98.3	Very high	96.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.5	-41.7	176.6	0	0	0	0	0	112.8	L499 S503 T521 S536 A537 V538 G543 Y544	L499-A540 HydrophobicContact CB-CB 4.34Å; L499-A540 WeakPolarHBondContact O-CB 3.08Å; S503-A540 WeakPolarHBondContact CB-O 3.25Å; T521-A540 HydrophobicContact CG2-CB 3.96Å; S536-A540 WeakPolarHBondContact O-CB 3.49Å; S536-A540 PolarHBondContact O-N 2.7Å; A537-A540 PolarHBondContact O-N 3Å; V538-A540 VanDerWaalsContact C-N 3.27Å; V538-A540 PolarHBondContact O-N 3.1Å; A540-G543 PolarHBondContact O-N 3.1Å; A540-Y544 HydrophobicContact CB-CE2 4.36Å; A540-Y544 WeakPolarHBondContact O-CD2 3.1Å; A540-Y544 PolarHBondContact O-N 3.41Å
541	I	98.6	Very high	96.2	Very high	1 Å²	1	27 Å²	27	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-61.9	-45.2	176	-73.5	158.8	0	0	0	110.8	T521 L525 A537 V538 G543 Y544 C545 I564 T586 V590	T521-I541 HydrophobicContact CG2-CD1 4.08Å; T521-I541 HydrophobicContact CG2-CG1 3.66Å; L525-I541 HydrophobicContact CD1-CD1 3.4Å; L525-I541 VanDerWaalsContact CD1-CD1 3.4Å; L525-I541 HydrophobicContact CD2-CD1 4.11Å; L525-I541 HydrophobicContact CG-CD1 3.93Å; A537-I541 WeakPolarHBondContact O-CD1 3.32Å; A537-I541 VanDerWaalsContact O-CG1 3.24Å; A537-I541 WeakPolarHBondContact O-CG1 3.44Å; A537-I541 PolarHBondContact O-N 2.91Å; V538-I541 WeakPolarHBondContact O-CB 3.46Å; V538-I541 PolarHBondContact O-N 2.76Å; V538-I541 VanDerWaalsContact O-N 3.11Å; I541-G543 VanDerWaalsContact C-N 3.3Å; I541-G543 PolarHBondContact O-N 3.39Å; I541-Y544 PolarHBondContact O-N 3.48Å; I541-C545 PolarHBondContact O-N 3.18Å; I541-C545 PolarHBondContact O-SG 3.02Å; I541-I564 HydrophobicContact CD1-CG1 4.05Å; I541-I564 HydrophobicContact CD1-CG2 4.09Å; I541-I564 HydrophobicContact CG1-CD1 4.33Å; I541-I564 HydrophobicContact CG1-CG1 4.34Å; I541-I564 HydrophobicContact CG2-CD1 4.3Å; I541-I564 HydrophobicContact CG2-CG2 3.79Å; I541-T586 HydrophobicContact CB-CG2 4.11Å; I541-T586 HydrophobicContact CG2-CG2 3.68Å; I541-V590 HydrophobicContact CG2-CG2 3.95Å
542	W	98.1	Very high	96	Very high	101 Å²	101	33.3 Å²	33.3	38%	0.383	16%	0.164	S	C	.	.	H	α-helix	trans	-54.4	-50.7	174.4	-174.3	101.2	0	0	0	110.3	V538 R539 Y544 C545 D546 T586 I589	V538-W542 PolarHBondContact O-N 3.01Å; R539-W542 PolarHBondContact O-N 3.36Å; W542-Y544 VanDerWaalsContact C-N 3.33Å; W542-Y544 PolarHBondContact O-N 3.4Å; W542-C545 PolarHBondContact O-N 3.14Å; W542-C545 VanDerWaalsContact O-N 3.14Å; W542-D546 HydrophobicContact CH2-CB 4.41Å; W542-D546 HydrophobicContact CZ3-CB 4.24Å; W542-D546 PolarHBondContact O-N 2.95Å; W542-T586 HydrophobicContact CB-CG2 4.23Å; W542-I589 HydrophobicContact CG-CG2 4.29Å
543	G	96.1	Very high	95.8	Very high	3 Å²	3	34.7 Å²	34.7	3%	0.031	17%	0.173	C	C	.	.	H	α-helix	trans	-61.6	-35	178.8	0	0	0	0	0	114.4	R539 A540 I541 Q547	R539-G543 PolarHBondContact O-N 3.4Å; A540-G543 PolarHBondContact O-N 3.1Å; I541-G543 VanDerWaalsContact C-N 3.3Å; I541-G543 PolarHBondContact O-N 3.39Å; G543-Q547 WeakPolarHBondContact O-CB 3.24Å; G543-Q547 WeakPolarHBondContact O-CG 3.11Å; G543-Q547 PolarHBondContact O-N 2.87Å; G543-Q547 VanDerWaalsContact O-N 3.15Å
544	Y	98.1	Very high	95.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-69.9	-42.5	173.3	-74.7	-55.8	0	0	0	112.5	A502 S503 T506 M509 F517 L518 A540 I541 W542 L548	A502-Y544 WeakPolarHBondContact CB-OH 3.42Å; S503-Y544 PolarHBondContact N-OH 3.32Å; T506-Y544 HydrophobicContact CG2-CD1 4.14Å; T506-Y544 HydrophobicContact CG2-CE1 4.38Å; T506-Y544 VanDerWaalsContact OG1-CD1 3.27Å; T506-Y544 WeakPolarHBondContact OG1-CD1 3.45Å; T506-Y544 WeakPolarHBondContact OG1-CE1 3.4Å; M509-Y544 HydrophobicContact CE-CE1 4.05Å; F517-Y544 VanDerWaalsContact CB-OH 3.28Å; F517-Y544 WeakPolarHBondContact CB-OH 3.43Å; L518-Y544 HydrophobicContact CD2-CD1 4.26Å; L518-Y544 HydrophobicContact CD2-CD2 3.53Å; L518-Y544 HydrophobicContact CD2-CE2 3.93Å; L518-Y544 HydrophobicContact CD2-CG 3.74Å; A540-Y544 HydrophobicContact CB-CE2 4.36Å; A540-Y544 WeakPolarHBondContact O-CD2 3.1Å; A540-Y544 PolarHBondContact O-N 3.41Å; I541-Y544 PolarHBondContact O-N 3.48Å; W542-Y544 VanDerWaalsContact C-N 3.33Å; W542-Y544 PolarHBondContact O-N 3.4Å; Y544-L548 WeakPolarHBondContact O-CB 3.26Å; Y544-L548 WeakPolarHBondContact O-CG 3.42Å; Y544-L548 PolarHBondContact O-N 2.8Å
545	C	96.9	Very high	95.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.2	-48.4	179	-65.1	0	0	0	0	110.5	I541 W542 K549 I589 V593	I541-C545 PolarHBondContact O-N 3.18Å; I541-C545 PolarHBondContact O-SG 3.02Å; W542-C545 PolarHBondContact O-N 3.14Å; W542-C545 VanDerWaalsContact O-N 3.14Å; C545-K549 WeakPolarHBondContact O-CB 3.35Å; C545-K549 WeakPolarHBondContact O-CD 3.46Å; C545-K549 WeakPolarHBondContact O-CG 3.2Å; C545-K549 PolarHBondContact O-N 3.04Å; C545-K549 VanDerWaalsContact O-N 3.11Å; C545-I589 HydrophobicContact CB-CB 4.5Å; C545-I589 HydrophobicContact CB-CD1 3.95Å; C545-I589 HydrophobicContact CB-CG1 3.87Å; C545-I589 HydrophobicContact CB-CG2 3.96Å; C545-V593 HydrophobicContact CB-CG2 4Å
546	D	94.3	Very high	95.2	Very high	53 Å²	53	42.1 Å²	42.1	28%	0.283	21%	0.21	S	C	.	.	H	α-helix	trans	-60.2	-58.5	178.9	178.3	61.3	0	0	0	112.2	W542 L548 K549 L550 I589	W542-D546 HydrophobicContact CH2-CB 4.41Å; W542-D546 HydrophobicContact CZ3-CB 4.24Å; W542-D546 PolarHBondContact O-N 2.95Å; D546-L548 PolarHBondContact O-N 3.4Å; D546-K549 WeakPolarHBondContact O-CB 3.37Å; D546-K549 PolarHBondContact O-N 3.06Å; D546-L550 WeakPolarHBondContact O-CG 3.36Å; D546-L550 PolarHBondContact O-N 3.32Å; D546-I589 HydrophobicContact CB-CD1 3.81Å
547	Q	93	Very high	95	Very high	14 Å²	14	41.6 Å²	41.6	7%	0.065	21%	0.207	C	C	.	.	H	α-helix	trans	-66.7	-35.8	-173.9	-69	177.9	50.9	0	0	113.4	K457 S503 R504 G543 L550 S551	K457-Q547 VanDerWaalsContact NZ-CD 3.28Å; K457-Q547 VanDerWaalsContact NZ-NE2 3.12Å; S503-Q547 PolarHBondContact O-NE2 2.92Å; S503-Q547 PolarHBondContact O-OE1 3.23Å; R504-Q547 PolarHBondContact O-OE1 3.17Å; G543-Q547 WeakPolarHBondContact O-CB 3.24Å; G543-Q547 WeakPolarHBondContact O-CG 3.11Å; G543-Q547 PolarHBondContact O-N 2.87Å; G543-Q547 VanDerWaalsContact O-N 3.15Å; Q547-L550 PolarHBondContact O-N 3.48Å; Q547-S551 WeakPolarHBondContact O-CB 3.34Å; Q547-S551 PolarHBondContact O-N 3.24Å; Q547-S551 PolarHBondContact O-OG 2.86Å
548	L	94.3	Very high	94.8	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-75.9	-25.9	178.4	-65.4	175.2	0	0	0	112.4	T506 Y544 D546 E552 S553 T554 L557	T506-L548 HydrophobicContact CG2-CD2 3.67Å; T506-L548 HydrophobicContact CG2-CG 4.11Å; Y544-L548 WeakPolarHBondContact O-CB 3.26Å; Y544-L548 WeakPolarHBondContact O-CG 3.42Å; Y544-L548 PolarHBondContact O-N 2.8Å; D546-L548 PolarHBondContact O-N 3.4Å; L548-E552 PolarHBondContact O-N 2.95Å; L548-S553 PolarHBondContact O-N 3.05Å; L548-T554 HydrophobicContact CB-CG2 4.47Å; L548-L557 HydrophobicContact CD1-CB 4.04Å
549	K	92.6	Very high	94.7	Very high	86 Å²	86	49.7 Å²	49.7	37%	0.374	25%	0.253	S	S	.	.	H	α-helix	trans	-66.2	-49.7	168.2	-79	171.8	65.5	-172.8	0	110.5	C545 D546 S551 E552 T554 I589 T592	C545-K549 WeakPolarHBondContact O-CB 3.35Å; C545-K549 WeakPolarHBondContact O-CD 3.46Å; C545-K549 WeakPolarHBondContact O-CG 3.2Å; C545-K549 PolarHBondContact O-N 3.04Å; C545-K549 VanDerWaalsContact O-N 3.11Å; D546-K549 WeakPolarHBondContact O-CB 3.37Å; D546-K549 PolarHBondContact O-N 3.06Å; K549-S551 PolarHBondContact O-N 2.78Å; K549-E552 PolarHBondContact O-N 3.45Å; K549-T554 HydrophobicContact CB-CG2 4.47Å; K549-T554 HydrophobicContact CG-CG2 3.87Å; K549-I589 HydrophobicContact CD-CG1 4.49Å; K549-T592 WeakPolarHBondContact CD-OG1 3.24Å; K549-T592 WeakPolarHBondContact CE-OG1 3.43Å; K549-T592 PolarHBondContact NZ-OG1 2.87Å
550	L	89.8	Confident	94.7	Very high	134 Å²	134	48.9 Å²	48.9	70%	0.702	25%	0.25	S	S	*	.	H	α-helix	trans	-59.8	-32.4	177.5	-68.4	172.1	0	0	0	112.7	D546 Q547	D546-L550 WeakPolarHBondContact O-CG 3.36Å; D546-L550 PolarHBondContact O-N 3.32Å; Q547-L550 PolarHBondContact O-N 3.48Å
551	S	89.8	Confident	94.6	Very high	65 Å²	65	49 Å²	49	46%	0.455	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	7.9	178.9	-50.7	0	0	0	0	114.2	Q547 K549 S553	Q547-S551 WeakPolarHBondContact O-CB 3.34Å; Q547-S551 PolarHBondContact O-N 3.24Å; Q547-S551 PolarHBondContact O-OG 2.86Å; K549-S551 PolarHBondContact O-N 2.78Å; S551-S553 PolarHBondContact O-N 3.42Å; S551-S553 PolarHBondContact O-OG 3.39Å
552	E	92.1	Very high	94.6	Very high	175 Å²	175	52.3 Å²	52.3	82%	0.818	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	31.8	-176.3	-58.5	-172.9	165.2	0	0	114.4	L548 K549	L548-E552 PolarHBondContact O-N 2.95Å; K549-E552 PolarHBondContact O-N 3.45Å
553	S	92.8	Very high	94.5	Very high	37 Å²	37	50.2 Å²	50.2	26%	0.259	27%	0.273	S	S	.	.			trans	-117.1	24.5	-170.8	-66.5	0	0	0	0	113.3	L548 S551 H555 I556	L548-S553 PolarHBondContact O-N 3.05Å; S551-S553 PolarHBondContact O-N 3.42Å; S551-S553 PolarHBondContact O-OG 3.39Å; S553-H555 PolarHBondContact O-N 3.4Å; S553-H555 VanDerWaalsContact O-N 3.1Å; S553-I556 PolarHBondContact O-N 3.05Å
554	T	93.9	Very high	94.6	Very high	30 Å²	30	50.1 Å²	50.1	18%	0.184	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-61.9	-19.1	-176.6	57.7	0	0	0	0	114.4	L548 K549 I556 L557 Q558 V593	L548-T554 HydrophobicContact CB-CG2 4.47Å; K549-T554 HydrophobicContact CB-CG2 4.47Å; K549-T554 HydrophobicContact CG-CG2 3.87Å; T554-I556 PolarHBondContact O-N 3.3Å; T554-I556 VanDerWaalsContact O-N 3.11Å; T554-L557 WeakPolarHBondContact O-CB 3.34Å; T554-L557 PolarHBondContact O-N 3Å; T554-Q558 PolarHBondContact O-N 3.26Å; T554-V593 HydrophobicContact CG2-CG1 4.12Å
555	H	93.3	Very high	94.6	Very high	117 Å²	117	50.4 Å²	50.4	54%	0.542	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-56.7	-26.4	176.4	69.5	-83.9	0	0	0	113.8	S553 L557	S553-H555 PolarHBondContact O-N 3.4Å; S553-H555 VanDerWaalsContact O-N 3.1Å; H555-L557 VanDerWaalsContact C-N 3.34Å
556	I	93.3	Very high	94.5	Very high	14 Å²	14	55.6 Å²	55.6	7%	0.072	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-72.4	-31	176.6	-54.6	176.3	0	0	0	111.1	P511 I514 Q515 L518 S553 T554 P559	P511-I556 HydrophobicContact CB-CD1 4.16Å; I514-I556 HydrophobicContact CB-CG2 4.35Å; I514-I556 HydrophobicContact CD1-CD1 4.42Å; I514-I556 HydrophobicContact CG2-CG2 3.76Å; Q515-I556 HydrophobicContact CG-CG2 4.05Å; L518-I556 HydrophobicContact CD1-CG2 4.24Å; S553-I556 PolarHBondContact O-N 3.05Å; T554-I556 PolarHBondContact O-N 3.3Å; T554-I556 VanDerWaalsContact O-N 3.11Å; I556-P559 WeakPolarHBondContact O-CD 3.41Å
557	L	94.4	Very high	94.6	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-29.2	-177.5	-175.2	61.3	0	0	0	112.8	L518 L548 T554 H555 P559 F560 L561 I564 V593	L518-L557 HydrophobicContact CD1-CD1 3.99Å; L518-L557 HydrophobicContact CD2-CD1 3.53Å; L518-L557 HydrophobicContact CG-CD1 4.41Å; L548-L557 HydrophobicContact CD1-CB 4.04Å; T554-L557 WeakPolarHBondContact O-CB 3.34Å; T554-L557 PolarHBondContact O-N 3Å; H555-L557 VanDerWaalsContact C-N 3.34Å; L557-P559 VanDerWaalsContact O-N 3.16Å; L557-F560 WeakPolarHBondContact O-CB 3.43Å; L557-F560 PolarHBondContact O-N 2.99Å; L557-L561 HydrophobicContact CD2-CD2 4.31Å; L557-L561 HydrophobicContact CG-CD2 4.04Å; L557-L561 PolarHBondContact O-N 2.88Å; L557-I564 HydrophobicContact CD1-CD1 3.83Å; L557-V593 HydrophobicContact CD2-CG1 3.97Å; L557-V593 HydrophobicContact CD2-CG2 4.13Å; L557-V593 HydrophobicContact CG-CG1 4.49Å
558	Q	94.1	Very high	94.7	Very high	79 Å²	79	52.7 Å²	52.7	37%	0.369	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-46.7	-44.4	-176.5	-74.5	175.7	-2	0	0	115.2	T554 F560 L561 D594	T554-Q558 PolarHBondContact O-N 3.26Å; Q558-F560 PolarHBondContact O-N 3.35Å; Q558-F560 VanDerWaalsContact O-N 3.15Å; Q558-L561 HydrophobicContact CG-CD1 4.42Å; Q558-L561 PolarHBondContact O-N 3.45Å; Q558-D594 HydrophobicContact CG-CB 4.26Å
559	P	96.7	Very high	94.7	Very high	91 Å²	91	54.6 Å²	54.6	59%	0.591	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-63	-21.3	179.9	-23.1	35.5	0	0	0	114.4	I556 L557	I556-P559 WeakPolarHBondContact O-CD 3.41Å; L557-P559 VanDerWaalsContact O-N 3.16Å
560	F	97.6	Very high	94.7	Very high	23 Å²	23	53.2 Å²	53.2	10%	0.101	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-96.5	-16.7	-175.2	-59.1	-84.4	0	0	0	113.1	L518 Q519 V522 L557 Q558 P562 S563 I564	L518-F560 HydrophobicContact CB-CD1 4.26Å; L518-F560 HydrophobicContact CB-CD2 3.95Å; L518-F560 HydrophobicContact CB-CE1 4.18Å; L518-F560 HydrophobicContact CB-CE2 3.86Å; L518-F560 HydrophobicContact CB-CG 4.15Å; L518-F560 HydrophobicContact CB-CZ 3.97Å; L518-F560 HydrophobicContact CD1-CD2 3.82Å; L518-F560 HydrophobicContact CD1-CE2 3.87Å; L518-F560 HydrophobicContact CG-CD2 4.49Å; Q519-F560 HydrophobicContact CB-CE1 4.05Å; V522-F560 HydrophobicContact CG2-CB 4.17Å; V522-F560 HydrophobicContact CG2-CD1 4.09Å; L557-F560 WeakPolarHBondContact O-CB 3.43Å; L557-F560 PolarHBondContact O-N 2.99Å; Q558-F560 PolarHBondContact O-N 3.35Å; Q558-F560 VanDerWaalsContact O-N 3.15Å; F560-P562 VanDerWaalsContact C-CD 3.45Å; F560-S563 PolarHBondContact O-N 3.25Å; F560-S563 VanDerWaalsContact O-N 3.1Å; F560-I564 HydrophobicContact CB-CD1 4.01Å; F560-I564 HydrophobicContact CB-CG1 4.47Å; F560-I564 WeakPolarHBondContact O-CG1 3.31Å; F560-I564 PolarHBondContact O-N 3.16Å
561	L	97.4	Very high	94.9	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-52.5	-42.3	-177.3	-64.1	177.4	0	0	0	114.2	L557 Q558 S563 I564 L565 V590 V593 D594 F597	L557-L561 HydrophobicContact CD2-CD2 4.31Å; L557-L561 HydrophobicContact CG-CD2 4.04Å; L557-L561 PolarHBondContact O-N 2.88Å; Q558-L561 HydrophobicContact CG-CD1 4.42Å; Q558-L561 PolarHBondContact O-N 3.45Å; L561-S563 VanDerWaalsContact C-N 3.35Å; L561-S563 PolarHBondContact O-N 2.91Å; L561-I564 PolarHBondContact O-N 2.75Å; L561-L565 WeakPolarHBondContact O-CB 3.44Å; L561-L565 PolarHBondContact O-N 2.92Å; L561-V590 HydrophobicContact CD2-CG1 4.28Å; L561-V593 HydrophobicContact CD1-CB 4.43Å; L561-V593 HydrophobicContact CD1-CG1 4.11Å; L561-V593 HydrophobicContact CD2-CB 4.29Å; L561-V593 HydrophobicContact CD2-CG1 4.17Å; L561-D594 HydrophobicContact CD1-CB 3.96Å; L561-F597 VanDerWaalsContact C-CZ 3.46Å; L561-F597 HydrophobicContact CB-CD1 3.76Å; L561-F597 HydrophobicContact CB-CD2 3.93Å; L561-F597 HydrophobicContact CB-CE1 3.68Å; L561-F597 HydrophobicContact CB-CE2 3.86Å; L561-F597 HydrophobicContact CB-CG 3.88Å; L561-F597 HydrophobicContact CB-CZ 3.73Å; L561-F597 HydrophobicContact CD1-CB 3.98Å; L561-F597 HydrophobicContact CD1-CD1 3.78Å; L561-F597 HydrophobicContact CD1-CE1 4.47Å; L561-F597 HydrophobicContact CD1-CG 3.85Å; L561-F597 HydrophobicContact CG-CD1 4.31Å; L561-F597 WeakPolarHBondContact O-CZ 3.37Å
562	P	97.6	Very high	95.1	Very high	71 Å²	71	44.1 Å²	44.1	46%	0.461	24%	0.238	S	C	.	.	H	α-helix	trans	-60.5	-42.5	177.8	-23.4	34.1	0	0	0	113.3	F560 E566 F597	F560-P562 VanDerWaalsContact C-CD 3.45Å; P562-E566 PolarHBondContact O-N 3.23Å; P562-E566 VanDerWaalsContact O-N 3.14Å; P562-F597 HydrophobicContact CB-CE2 4.19Å; P562-F597 HydrophobicContact CG-CD2 4.31Å; P562-F597 HydrophobicContact CG-CE2 3.83Å
563	S	96.9	Very high	95.1	Very high	57 Å²	57	39.6 Å²	39.6	40%	0.399	23%	0.231	S	C	.	.	H	α-helix	trans	-74	-37.3	-179.5	-53.1	0	0	0	0	111.8	F560 L561 E566 G567	F560-S563 PolarHBondContact O-N 3.25Å; F560-S563 VanDerWaalsContact O-N 3.1Å; L561-S563 VanDerWaalsContact C-N 3.35Å; L561-S563 PolarHBondContact O-N 2.91Å; S563-E566 PolarHBondContact O-N 3.24Å; S563-G567 PolarHBondContact O-N 3.4Å
564	I	98	Very high	95	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-58.2	-52.1	173	-72.9	169.6	0	0	0	109.7	V522 I541 L557 F560 L561 E566 G567 L568 V590	V522-I564 HydrophobicContact CG2-CG1 3.87Å; I541-I564 HydrophobicContact CD1-CG1 4.05Å; I541-I564 HydrophobicContact CD1-CG2 4.09Å; I541-I564 HydrophobicContact CG1-CD1 4.33Å; I541-I564 HydrophobicContact CG1-CG1 4.34Å; I541-I564 HydrophobicContact CG2-CD1 4.3Å; I541-I564 HydrophobicContact CG2-CG2 3.79Å; L557-I564 HydrophobicContact CD1-CD1 3.83Å; F560-I564 HydrophobicContact CB-CD1 4.01Å; F560-I564 HydrophobicContact CB-CG1 4.47Å; F560-I564 WeakPolarHBondContact O-CG1 3.31Å; F560-I564 PolarHBondContact O-N 3.16Å; L561-I564 PolarHBondContact O-N 2.75Å; I564-E566 VanDerWaalsContact C-N 3.32Å; I564-E566 PolarHBondContact O-N 2.92Å; I564-G567 PolarHBondContact O-N 3.47Å; I564-L568 HydrophobicContact CG2-CD1 3.82Å; I564-L568 HydrophobicContact CG2-CG 4.25Å; I564-L568 WeakPolarHBondContact O-CG 3.28Å; I564-L568 PolarHBondContact O-N 3.17Å; I564-V590 HydrophobicContact CG2-CG2 3.96Å
565	L	97.2	Very high	95	Very high	7 Å²	7	43 Å²	43	4%	0.037	24%	0.24	C	C	.	.	H	α-helix	trans	-58.8	-43.8	179.6	176.1	63.5	0	0	0	111.9	L561 G567 L568 V569 L587 F597 A601 I605	L561-L565 WeakPolarHBondContact O-CB 3.44Å; L561-L565 PolarHBondContact O-N 2.92Å; L565-G567 PolarHBondContact O-N 3.17Å; L565-L568 PolarHBondContact O-N 3.37Å; L565-V569 HydrophobicContact CD1-CG2 3.93Å; L565-V569 HydrophobicContact CG-CG2 4.26Å; L565-V569 WeakPolarHBondContact O-CB 3.39Å; L565-V569 WeakPolarHBondContact O-CG2 3.29Å; L565-V569 PolarHBondContact O-N 3.38Å; L565-L587 HydrophobicContact CD1-CD1 3.5Å; L565-L587 VanDerWaalsContact CD1-CD1 3.5Å; L565-F597 HydrophobicContact CB-CZ 3.98Å; L565-F597 HydrophobicContact CD2-CE1 4.44Å; L565-F597 HydrophobicContact CD2-CZ 3.87Å; L565-A601 HydrophobicContact CD2-CB 3.53Å; L565-I605 HydrophobicContact CD1-CD1 4.35Å; L565-I605 HydrophobicContact CD1-CG1 3.79Å; L565-I605 HydrophobicContact CD2-CD1 4.24Å; L565-I605 HydrophobicContact CD2-CG1 4.03Å
566	E	95.7	Very high	94.9	Very high	108 Å²	108	39.5 Å²	39.5	51%	0.505	23%	0.229	S	C	.	.	H	α-helix	trans	-60.8	-44	177.6	-175.8	168.9	-172.4	0	0	112.1	P562 S563 I564 V569 Q570	P562-E566 PolarHBondContact O-N 3.23Å; P562-E566 VanDerWaalsContact O-N 3.14Å; S563-E566 PolarHBondContact O-N 3.24Å; I564-E566 VanDerWaalsContact C-N 3.32Å; I564-E566 PolarHBondContact O-N 2.92Å; E566-V569 PolarHBondContact O-N 3.27Å; E566-Q570 VanDerWaalsContact O-CG 3.3Å; E566-Q570 WeakPolarHBondContact O-CG 3.46Å; E566-Q570 PolarHBondContact O-N 3.47Å
567	G	95.5	Very high	94.7	Very high	5 Å²	5	41.3 Å²	41.3	5%	0.052	24%	0.242	C	C	.	.	H	α-helix	trans	-66.4	-40.4	177.3	0	0	0	0	0	113.5	S563 I564 L565 Q570 L571	S563-G567 PolarHBondContact O-N 3.4Å; I564-G567 PolarHBondContact O-N 3.47Å; L565-G567 PolarHBondContact O-N 3.17Å; G567-Q570 PolarHBondContact O-N 3.34Å; G567-L571 WeakPolarHBondContact O-CB 3.38Å; G567-L571 PolarHBondContact O-N 3.45Å
568	L	96.5	Very high	94.6	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-63.6	-44.7	175.7	-67.7	177	0	0	0	111.6	V538 I564 L565 Q570 L571 A572 V583 T586 L587 V590	V538-L568 HydrophobicContact CG1-CD2 4.07Å; V538-L568 HydrophobicContact CG2-CD2 3.92Å; I564-L568 HydrophobicContact CG2-CD1 3.82Å; I564-L568 HydrophobicContact CG2-CG 4.25Å; I564-L568 WeakPolarHBondContact O-CG 3.28Å; I564-L568 PolarHBondContact O-N 3.17Å; L565-L568 PolarHBondContact O-N 3.37Å; L568-Q570 VanDerWaalsContact C-N 3.32Å; L568-Q570 PolarHBondContact O-N 3.01Å; L568-L571 PolarHBondContact O-N 3.17Å; L568-A572 WeakPolarHBondContact O-CB 3.44Å; L568-A572 PolarHBondContact O-N 3.21Å; L568-V583 HydrophobicContact CB-CG1 4.19Å; L568-V583 HydrophobicContact CD2-CG1 4.27Å; L568-V583 WeakPolarHBondContact O-CG1 3.47Å; L568-T586 HydrophobicContact CD1-CG2 4.08Å; L568-T586 HydrophobicContact CD2-CG2 4.06Å; L568-L587 HydrophobicContact CD1-CB 4.44Å; L568-L587 HydrophobicContact CD1-CD1 4.5Å; L568-V590 HydrophobicContact CD1-CG2 4.2Å
569	V	93.9	Very high	94.6	Very high	44 Å²	44	41.1 Å²	41.1	27%	0.267	24%	0.242	S	C	.	.	H	α-helix	trans	-60.6	-42.5	177	171.4	0	0	0	0	111.1	L565 E566 A573 L608	L565-V569 HydrophobicContact CD1-CG2 3.93Å; L565-V569 HydrophobicContact CG-CG2 4.26Å; L565-V569 WeakPolarHBondContact O-CB 3.39Å; L565-V569 WeakPolarHBondContact O-CG2 3.29Å; L565-V569 PolarHBondContact O-N 3.38Å; E566-V569 PolarHBondContact O-N 3.27Å; V569-A573 PolarHBondContact O-N 2.97Å; V569-L608 HydrophobicContact CB-CD2 4.15Å; V569-L608 HydrophobicContact CG1-CD2 4.18Å; V569-L608 HydrophobicContact CG2-CD2 3.7Å
570	Q	92.9	Very high	94.6	Very high	58 Å²	58	36.8 Å²	36.8	27%	0.271	21%	0.214	S	C	.	.	H	α-helix	trans	-63.8	-41.6	176.9	-74.6	172.7	1.1	0	0	111.8	E566 G567 L568 A573 Q574	E566-Q570 VanDerWaalsContact O-CG 3.3Å; E566-Q570 WeakPolarHBondContact O-CG 3.46Å; E566-Q570 PolarHBondContact O-N 3.47Å; G567-Q570 PolarHBondContact O-N 3.34Å; L568-Q570 VanDerWaalsContact C-N 3.32Å; L568-Q570 PolarHBondContact O-N 3.01Å; Q570-A573 PolarHBondContact O-N 3.17Å; Q570-Q574 WeakPolarHBondContact O-CG 3.5Å; Q570-Q574 PolarHBondContact O-N 2.98Å
571	L	93.8	Very high	94.5	Very high	1 Å²	1	37 Å²	37	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-68.3	-43	-179.6	-161.6	67.8	0	0	0	111.7	R534 V538 G567 L568 A573 Q574 F575 V579 V583	R534-L571 HydrophobicContact CB-CD1 4.13Å; V538-L571 HydrophobicContact CG2-CD2 3.48Å; V538-L571 VanDerWaalsContact CG2-CD2 3.48Å; G567-L571 WeakPolarHBondContact O-CB 3.38Å; G567-L571 PolarHBondContact O-N 3.45Å; L568-L571 PolarHBondContact O-N 3.17Å; L571-A573 PolarHBondContact O-N 3.23Å; L571-Q574 PolarHBondContact O-N 3.01Å; L571-F575 HydrophobicContact CD1-CD2 3.5Å; L571-F575 VanDerWaalsContact CD1-CD2 3.5Å; L571-F575 HydrophobicContact CD1-CE2 3.45Å; L571-F575 VanDerWaalsContact CD1-CE2 3.45Å; L571-F575 HydrophobicContact CG-CD2 4.01Å; L571-F575 HydrophobicContact CG-CE2 4.45Å; L571-F575 PolarHBondContact O-N 2.81Å; L571-F575 VanDerWaalsContact O-N 3.07Å; L571-V579 HydrophobicContact CD2-CG1 4.27Å; L571-V579 HydrophobicContact CG-CG1 4.23Å; L571-V583 HydrophobicContact CB-CG2 4.2Å; L571-V583 HydrophobicContact CD2-CG2 3.59Å; L571-V583 HydrophobicContact CG-CG2 4.04Å
572	A	93.6	Very high	94.5	Very high	7 Å²	7	37.4 Å²	37.4	6%	0.058	22%	0.219	C	C	.	.	H	α-helix	trans	-59.6	-27.4	174.6	0	0	0	0	0	113.4	L568 L580 V583 I612	L568-A572 WeakPolarHBondContact O-CB 3.44Å; L568-A572 PolarHBondContact O-N 3.21Å; A572-L580 HydrophobicContact CB-CD1 3.71Å; A572-V583 HydrophobicContact CB-CG1 3.92Å; A572-I612 HydrophobicContact CB-CD1 4.28Å
573	A	91.6	Very high	94.5	Very high	80 Å²	80	34.1 Å²	34.1	66%	0.661	20%	0.197	S	C	*	.	H	α-helix	trans	-78.2	-22.4	176.9	0	0	0	0	0	113.4	V569 Q570 L571	V569-A573 PolarHBondContact O-N 2.97Å; Q570-A573 PolarHBondContact O-N 3.17Å; L571-A573 PolarHBondContact O-N 3.23Å
574	Q	92.1	Very high	94.5	Very high	99 Å²	99	31.4 Å²	31.4	46%	0.463	18%	0.179	S	C	.	.	H	α-helix	trans	-99.8	-30.1	-173.4	-68.3	174.1	24.9	0	0	113	D527 Q570 L571	D527-Q574 PolarHBondContact OD1-NE2 3.38Å; Q570-Q574 WeakPolarHBondContact O-CG 3.5Å; Q570-Q574 PolarHBondContact O-N 2.98Å; L571-Q574 PolarHBondContact O-N 3.01Å
575	F	92.8	Very high	94.5	Very high	38 Å²	38	35 Å²	35	17%	0.167	20%	0.195	C	C	.	.			trans	-118.1	160.3	-175.7	-62.3	-90.8	0	0	0	112.2	P381 P531 L571 V579	P381-F575 HydrophobicContact CB-CE1 4.15Å; P381-F575 HydrophobicContact CG-CE1 4.2Å; P531-F575 HydrophobicContact CB-CE1 4.24Å; P531-F575 HydrophobicContact CB-CZ 3.93Å; P531-F575 HydrophobicContact CG-CE1 4.41Å; P531-F575 HydrophobicContact CG-CZ 3.96Å; L571-F575 HydrophobicContact CD1-CD2 3.5Å; L571-F575 VanDerWaalsContact CD1-CD2 3.5Å; L571-F575 HydrophobicContact CD1-CE2 3.45Å; L571-F575 VanDerWaalsContact CD1-CE2 3.45Å; L571-F575 HydrophobicContact CG-CD2 4.01Å; L571-F575 HydrophobicContact CG-CE2 4.45Å; L571-F575 PolarHBondContact O-N 2.81Å; L571-F575 VanDerWaalsContact O-N 3.07Å; F575-V579 HydrophobicContact CB-CB 3.7Å; F575-V579 HydrophobicContact CB-CG1 3.47Å; F575-V579 VanDerWaalsContact CB-CG1 3.47Å; F575-V579 HydrophobicContact CB-CG2 4.38Å; F575-V579 HydrophobicContact CD1-CB 4.44Å; F575-V579 HydrophobicContact CD1-CG1 4.32Å; F575-V579 HydrophobicContact CD1-CG2 4.2Å; F575-V579 HydrophobicContact CD2-CG1 4.13Å; F575-V579 HydrophobicContact CG-CB 4.18Å; F575-V579 HydrophobicContact CG-CG1 3.72Å; F575-V579 HydrophobicContact CG-CG2 4.4Å
576	S	90.6	Very high	94.5	Very high	45 Å²	45	34.7 Å²	34.7	32%	0.315	19%	0.194	S	C	.	.			trans	-125.8	-172	175.2	64.1	0	0	0	0	110	Q382 E578 L580	Q382-S576 PolarHBondContact NE2-O 3.03Å; Q382-S576 PolarHBondContact OE1-O 2.91Å; S576-E578 PolarHBondContact O-N 3.08Å; S576-L580 PolarHBondContact O-N 3.47Å
577	S	89.1	Confident	94.6	Very high	51 Å²	51	29.7 Å²	29.7	36%	0.357	17%	0.17	S	C	.	.	H	α-helix	trans	55.6	-128.4	168.4	-46.4	0	0	0	0	112.4	L580 T581	S577-L580 WeakPolarHBondContact O-CB 3.45Å; S577-L580 PolarHBondContact O-N 3.42Å; S577-T581 PolarHBondContact O-N 3Å
578	E	92.1	Very high	94.7	Very high	76 Å²	76	30.4 Å²	30.4	36%	0.355	17%	0.174	S	C	.	.	H	α-helix	trans	-66.6	-40.1	-170.8	-57.2	72.3	-153.2	0	0	112.6	Q382 V385 S576 L580 T581 L582	Q382-E578 WeakPolarHBondContact CB-OE2 3.37Å; Q382-E578 PolarHBondContact OE1-OE2 3.47Å; V385-E578 HydrophobicContact CB-CB 4.15Å; V385-E578 HydrophobicContact CG1-CB 3.92Å; S576-E578 PolarHBondContact O-N 3.08Å; E578-L580 VanDerWaalsContact C-N 3.27Å; E578-L580 PolarHBondContact O-N 2.92Å; E578-T581 WeakPolarHBondContact CA-OG1 3.45Å; E578-T581 PolarHBondContact O-N 2.97Å; E578-T581 PolarHBondContact O-OG1 2.9Å; E578-L582 PolarHBondContact O-N 3.11Å
579	V	95.8	Very high	94.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.5	-38	172.7	174.7	0	0	0	0	110.8	Q382 V385 I535 L571 F575 V583	Q382-V579 VanDerWaalsContact OE1-CG2 3.24Å; V385-V579 HydrophobicContact CG2-CB 4.41Å; V385-V579 HydrophobicContact CG2-CG2 3.52Å; I535-V579 HydrophobicContact CD1-CG2 3.73Å; I535-V579 HydrophobicContact CG1-CG1 4.34Å; I535-V579 HydrophobicContact CG1-CG2 4.07Å; L571-V579 HydrophobicContact CD2-CG1 4.27Å; L571-V579 HydrophobicContact CG-CG1 4.23Å; F575-V579 HydrophobicContact CB-CB 3.7Å; F575-V579 HydrophobicContact CB-CG1 3.47Å; F575-V579 VanDerWaalsContact CB-CG1 3.47Å; F575-V579 HydrophobicContact CB-CG2 4.38Å; F575-V579 HydrophobicContact CD1-CB 4.44Å; F575-V579 HydrophobicContact CD1-CG1 4.32Å; F575-V579 HydrophobicContact CD1-CG2 4.2Å; F575-V579 HydrophobicContact CD2-CG1 4.13Å; F575-V579 HydrophobicContact CG-CB 4.18Å; F575-V579 HydrophobicContact CG-CG1 3.72Å; F575-V579 HydrophobicContact CG-CG2 4.4Å; V579-V583 HydrophobicContact CG1-CG2 4.47Å; V579-V583 VanDerWaalsContact O-CG2 3.22Å; V579-V583 WeakPolarHBondContact O-CG2 3.08Å; V579-V583 PolarHBondContact O-N 3Å; V579-V583 VanDerWaalsContact O-N 3.1Å
580	L	96.3	Very high	95	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-71.7	-40.1	-178.2	179.2	65.2	0	0	0	111.9	A572 S576 S577 E578 V583 M584 I612 Y616	A572-L580 HydrophobicContact CB-CD1 3.71Å; S576-L580 PolarHBondContact O-N 3.47Å; S577-L580 WeakPolarHBondContact O-CB 3.45Å; S577-L580 PolarHBondContact O-N 3.42Å; E578-L580 VanDerWaalsContact C-N 3.27Å; E578-L580 PolarHBondContact O-N 2.92Å; L580-V583 PolarHBondContact O-N 3.39Å; L580-M584 HydrophobicContact CD1-CG 4.23Å; L580-M584 HydrophobicContact CG-CG 4.33Å; L580-M584 WeakPolarHBondContact O-CB 3.5Å; L580-M584 VanDerWaalsContact O-CG 3.25Å; L580-M584 WeakPolarHBondContact O-CG 3.5Å; L580-M584 PolarHBondContact O-N 3.29Å; L580-I612 HydrophobicContact CD1-CD1 4.13Å; L580-I612 HydrophobicContact CD2-CG2 4.34Å; L580-Y616 HydrophobicContact CD2-CD2 3.73Å; L580-Y616 HydrophobicContact CD2-CE1 4.39Å; L580-Y616 HydrophobicContact CD2-CE2 3.2Å; L580-Y616 HydrophobicContact CD2-CG 4.48Å
581	T	95.6	Very high	95.2	Very high	27 Å²	27	26.6 Å²	26.6	17%	0.166	15%	0.154	C	C	.	.	H	α-helix	trans	-60.6	-48.4	176.1	52.4	0	0	0	0	110.5	S577 E578 V583 M584 E585 V621 V622 L625	S577-T581 PolarHBondContact O-N 3Å; E578-T581 WeakPolarHBondContact CA-OG1 3.45Å; E578-T581 PolarHBondContact O-N 2.97Å; E578-T581 PolarHBondContact O-OG1 2.9Å; T581-V583 VanDerWaalsContact C-N 3.28Å; T581-V583 PolarHBondContact O-N 3.34Å; T581-M584 WeakPolarHBondContact O-CB 3.35Å; T581-M584 PolarHBondContact O-N 3.39Å; T581-E585 WeakPolarHBondContact O-CG 3.21Å; T581-E585 PolarHBondContact O-N 3.15Å; T581-V621 HydrophobicContact CG2-CG1 3.98Å; T581-V622 HydrophobicContact CG2-CG2 4.26Å; T581-L625 HydrophobicContact CG2-CD1 3.99Å
582	L	97	Very high	95.2	Very high	10 Å²	10	28.2 Å²	28.2	5%	0.052	16%	0.164	C	C	.	.	H	α-helix	trans	-55.9	-41.3	174.6	174.8	64.8	0	0	0	112.5	V385 I535 V538 R539 E578 T586	V385-L582 HydrophobicContact CG1-CD2 4.49Å; I535-L582 HydrophobicContact CG2-CD2 3.89Å; V538-L582 HydrophobicContact CB-CD2 4.36Å; V538-L582 HydrophobicContact CG1-CD1 4.32Å; V538-L582 HydrophobicContact CG1-CD2 4.12Å; V538-L582 HydrophobicContact CG1-CG 3.75Å; R539-L582 HydrophobicContact CG-CD1 3.94Å; R539-L582 HydrophobicContact CG-CD2 3.84Å; E578-L582 PolarHBondContact O-N 3.11Å; L582-T586 WeakPolarHBondContact O-CB 3.24Å; L582-T586 PolarHBondContact O-N 2.95Å; L582-T586 PolarHBondContact O-OG1 3.49Å
583	V	97.9	Very high	95.4	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.006	16%	0.164	C	C	.	.	H	α-helix	trans	-67.6	-39.6	177.2	169.9	0	0	0	0	111.8	V538 L568 L571 A572 V579 L580 T581 T586 L587	V538-V583 HydrophobicContact CG1-CG2 4.3Å; V538-V583 HydrophobicContact CG2-CG2 4.29Å; L568-V583 HydrophobicContact CB-CG1 4.19Å; L568-V583 HydrophobicContact CD2-CG1 4.27Å; L568-V583 WeakPolarHBondContact O-CG1 3.47Å; L571-V583 HydrophobicContact CB-CG2 4.2Å; L571-V583 HydrophobicContact CD2-CG2 3.59Å; L571-V583 HydrophobicContact CG-CG2 4.04Å; A572-V583 HydrophobicContact CB-CG1 3.92Å; V579-V583 HydrophobicContact CG1-CG2 4.47Å; V579-V583 VanDerWaalsContact O-CG2 3.22Å; V579-V583 WeakPolarHBondContact O-CG2 3.08Å; V579-V583 PolarHBondContact O-N 3Å; V579-V583 VanDerWaalsContact O-N 3.1Å; L580-V583 PolarHBondContact O-N 3.39Å; T581-V583 VanDerWaalsContact C-N 3.28Å; T581-V583 PolarHBondContact O-N 3.34Å; V583-T586 PolarHBondContact O-N 3.09Å; V583-L587 VanDerWaalsContact O-CB 3.24Å; V583-L587 WeakPolarHBondContact O-CB 3.31Å; V583-L587 PolarHBondContact O-N 2.85Å
584	M	97.5	Very high	95.6	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-68.1	-43.1	179.3	-74.1	-75.3	-70.4	0	0	111.6	L580 T581 L587 C588 T609 I612 L625 A626 I629	L580-M584 HydrophobicContact CD1-CG 4.23Å; L580-M584 HydrophobicContact CG-CG 4.33Å; L580-M584 WeakPolarHBondContact O-CB 3.5Å; L580-M584 VanDerWaalsContact O-CG 3.25Å; L580-M584 WeakPolarHBondContact O-CG 3.5Å; L580-M584 PolarHBondContact O-N 3.29Å; T581-M584 WeakPolarHBondContact O-CB 3.35Å; T581-M584 PolarHBondContact O-N 3.39Å; M584-L587 PolarHBondContact O-N 2.62Å; M584-C588 WeakPolarHBondContact O-CB 3.45Å; M584-C588 PolarHBondContact O-N 3.43Å; M584-T609 HydrophobicContact CE-CG2 4.35Å; M584-I612 HydrophobicContact CE-CG2 3.96Å; M584-I612 HydrophobicContact CG-CD1 4.48Å; M584-I612 HydrophobicContact SD-CD1 3.46Å; M584-I612 WeakPolarHBondContact SD-CD1 3.18Å; M584-I612 HydrophobicContact SD-CG2 4.03Å; M584-L625 HydrophobicContact CB-CB 4.02Å; M584-L625 HydrophobicContact CB-CD1 3.98Å; M584-L625 HydrophobicContact CE-CB 4.31Å; M584-A626 HydrophobicContact CE-CB 4.09Å; M584-I629 HydrophobicContact CE-CD1 3.56Å; M584-I629 HydrophobicContact SD-CD1 3.86Å
585	E	96.8	Very high	95.8	Very high	77 Å²	77	24.9 Å²	24.9	36%	0.36	14%	0.142	S	C	.	.	H	α-helix	trans	-59	-47.1	172.1	-70.9	165.1	-171	0	0	111.1	T581 L587 C588 I589 L625	T581-E585 WeakPolarHBondContact O-CG 3.21Å; T581-E585 PolarHBondContact O-N 3.15Å; E585-L587 VanDerWaalsContact C-N 3.33Å; E585-L587 PolarHBondContact O-N 2.68Å; E585-C588 WeakPolarHBondContact O-CB 3.49Å; E585-C588 PolarHBondContact O-N 3.4Å; E585-I589 PolarHBondContact O-N 3.36Å; E585-L625 HydrophobicContact CG-CD1 4.14Å; E585-L625 HydrophobicContact CG-CD2 3.42Å; E585-L625 VanDerWaalsContact CG-CD2 3.42Å; E585-L625 HydrophobicContact CG-CG 4.43Å
586	T	98.1	Very high	96	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-64.6	-38.7	177.5	-56	0	0	0	0	111.6	V538 I541 W542 L568 L582 V583 C588 I589 V590	V538-T586 HydrophobicContact CG1-CG2 3.97Å; V538-T586 WeakPolarHBondContact CG1-OG1 3.44Å; I541-T586 HydrophobicContact CB-CG2 4.11Å; I541-T586 HydrophobicContact CG2-CG2 3.68Å; W542-T586 HydrophobicContact CB-CG2 4.23Å; L568-T586 HydrophobicContact CD1-CG2 4.08Å; L568-T586 HydrophobicContact CD2-CG2 4.06Å; L582-T586 WeakPolarHBondContact O-CB 3.24Å; L582-T586 PolarHBondContact O-N 2.95Å; L582-T586 PolarHBondContact O-OG1 3.49Å; V583-T586 PolarHBondContact O-N 3.09Å; T586-C588 VanDerWaalsContact C-N 3.33Å; T586-I589 VanDerWaalsContact O-CG2 3.29Å; T586-I589 WeakPolarHBondContact O-CG2 3.39Å; T586-V590 HydrophobicContact CG2-CG2 4.46Å; T586-V590 WeakPolarHBondContact O-CB 3.47Å; T586-V590 WeakPolarHBondContact O-CG2 3.49Å; T586-V590 PolarHBondContact O-N 3.38Å
587	L	98.1	Very high	96.3	Very high	2 Å²	2	25 Å²	25	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-64.7	-39.3	175.2	179.6	59.6	0	0	0	111.4	L565 L568 V583 M584 E585 V590 C591 L608 I629	L565-L587 HydrophobicContact CD1-CD1 3.5Å; L565-L587 VanDerWaalsContact CD1-CD1 3.5Å; L568-L587 HydrophobicContact CD1-CB 4.44Å; L568-L587 HydrophobicContact CD1-CD1 4.5Å; V583-L587 VanDerWaalsContact O-CB 3.24Å; V583-L587 WeakPolarHBondContact O-CB 3.31Å; V583-L587 PolarHBondContact O-N 2.85Å; M584-L587 PolarHBondContact O-N 2.62Å; E585-L587 VanDerWaalsContact C-N 3.33Å; E585-L587 PolarHBondContact O-N 2.68Å; L587-V590 PolarHBondContact O-N 3.07Å; L587-C591 PolarHBondContact O-N 2.78Å; L587-C591 VanDerWaalsContact O-N 3.14Å; L587-C591 PolarHBondContact O-SG 2.83Å; L587-L608 HydrophobicContact CD2-CD2 4.21Å; L587-I629 HydrophobicContact CB-CD1 4.37Å; L587-I629 HydrophobicContact CD2-CD1 3.99Å; L587-I629 HydrophobicContact CG-CD1 4.15Å
588	C	97.6	Very high	96.8	Very high	20 Å²	20	22.6 Å²	22.6	14%	0.135	13%	0.132	C	C	.	.	H	α-helix	trans	-59.6	-55.6	176.3	-169.8	0	0	0	0	110.9	M584 E585 T586 V590 C591 I629	M584-C588 WeakPolarHBondContact O-CB 3.45Å; M584-C588 PolarHBondContact O-N 3.43Å; E585-C588 WeakPolarHBondContact O-CB 3.49Å; E585-C588 PolarHBondContact O-N 3.4Å; T586-C588 VanDerWaalsContact C-N 3.33Å; C588-V590 VanDerWaalsContact C-N 3.29Å; C588-V590 PolarHBondContact O-N 3.48Å; C588-C591 VanDerWaalsContact O-CB 3.31Å; C588-C591 WeakPolarHBondContact O-CB 3.44Å; C588-C591 PolarHBondContact O-N 2.98Å; C588-I629 HydrophobicContact CB-CG1 3.79Å
589	I	96.9	Very high	97	Very high	21 Å²	21	21.6 Å²	21.6	11%	0.108	13%	0.131	C	C	.	.	H	α-helix	trans	-63.4	-34.4	179.8	-164.3	172.8	0	0	0	112.4	W542 C545 D546 K549 E585 T586 C591 T592	W542-I589 HydrophobicContact CG-CG2 4.29Å; C545-I589 HydrophobicContact CB-CB 4.5Å; C545-I589 HydrophobicContact CB-CD1 3.95Å; C545-I589 HydrophobicContact CB-CG1 3.87Å; C545-I589 HydrophobicContact CB-CG2 3.96Å; D546-I589 HydrophobicContact CB-CD1 3.81Å; K549-I589 HydrophobicContact CD-CG1 4.49Å; E585-I589 PolarHBondContact O-N 3.36Å; T586-I589 VanDerWaalsContact O-CG2 3.29Å; T586-I589 WeakPolarHBondContact O-CG2 3.39Å; I589-C591 VanDerWaalsContact C-N 3.28Å; I589-C591 PolarHBondContact O-N 2.84Å; I589-T592 WeakPolarHBondContact O-CB 3.34Å; I589-T592 PolarHBondContact O-N 3.25Å; I589-T592 VanDerWaalsContact O-N 3.08Å; I589-T592 PolarHBondContact O-OG1 3.26Å
590	V	98.1	Very high	97.1	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.006	16%	0.158	C	C	.	.	H	α-helix	trans	-59.5	-37.4	174.1	164	0	0	0	0	111.8	I541 L561 I564 L568 T586 L587 C588 T592 V593	I541-V590 HydrophobicContact CG2-CG2 3.95Å; L561-V590 HydrophobicContact CD2-CG1 4.28Å; I564-V590 HydrophobicContact CG2-CG2 3.96Å; L568-V590 HydrophobicContact CD1-CG2 4.2Å; T586-V590 HydrophobicContact CG2-CG2 4.46Å; T586-V590 WeakPolarHBondContact O-CB 3.47Å; T586-V590 WeakPolarHBondContact O-CG2 3.49Å; T586-V590 PolarHBondContact O-N 3.38Å; L587-V590 PolarHBondContact O-N 3.07Å; C588-V590 VanDerWaalsContact C-N 3.29Å; C588-V590 PolarHBondContact O-N 3.48Å; V590-T592 PolarHBondContact O-N 2.75Å; V590-V593 PolarHBondContact O-N 3.45Å
591	C	96.9	Very high	97.1	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.007	16%	0.161	C	C	.	.	H	α-helix	trans	-61.9	-24	177.8	-67.2	0	0	0	0	112.9	L587 C588 I589 T598 E632	L587-C591 PolarHBondContact O-N 2.78Å; L587-C591 VanDerWaalsContact O-N 3.14Å; L587-C591 PolarHBondContact O-SG 2.83Å; C588-C591 VanDerWaalsContact O-CB 3.31Å; C588-C591 WeakPolarHBondContact O-CB 3.44Å; C588-C591 PolarHBondContact O-N 2.98Å; I589-C591 VanDerWaalsContact C-N 3.28Å; I589-C591 PolarHBondContact O-N 2.84Å; C591-T598 HydrophobicContact CB-CG2 3.99Å; C591-T598 PolarHBondContact O-OG1 3.06Å; C591-E632 HydrophobicContact CB-CB 4.31Å
592	T	95.8	Very high	97.2	Very high	35 Å²	35	24.8 Å²	24.8	22%	0.215	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-7.7	-176.8	76.7	0	0	0	0	114.2	K549 I589 V590 E632	K549-T592 WeakPolarHBondContact CD-OG1 3.24Å; K549-T592 WeakPolarHBondContact CE-OG1 3.43Å; K549-T592 PolarHBondContact NZ-OG1 2.87Å; I589-T592 WeakPolarHBondContact O-CB 3.34Å; I589-T592 PolarHBondContact O-N 3.25Å; I589-T592 VanDerWaalsContact O-N 3.08Å; I589-T592 PolarHBondContact O-OG1 3.26Å; V590-T592 PolarHBondContact O-N 2.75Å; T592-E632 HydrophobicContact CG2-CG 3.88Å; T592-E632 WeakPolarHBondContact CG2-OE2 3.36Å
593	V	96.3	Very high	97.1	Very high	10 Å²	10	28.7 Å²	28.7	6%	0.061	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-46.8	-173.7	177	0	0	0	0	112.6	C545 T554 L557 L561 V590	C545-V593 HydrophobicContact CB-CG2 4Å; T554-V593 HydrophobicContact CG2-CG1 4.12Å; L557-V593 HydrophobicContact CD2-CG1 3.97Å; L557-V593 HydrophobicContact CD2-CG2 4.13Å; L557-V593 HydrophobicContact CG-CG1 4.49Å; L561-V593 HydrophobicContact CD1-CB 4.43Å; L561-V593 HydrophobicContact CD1-CG1 4.11Å; L561-V593 HydrophobicContact CD2-CB 4.29Å; L561-V593 HydrophobicContact CD2-CG1 4.17Å; V590-V593 PolarHBondContact O-N 3.45Å
594	D	97.1	Very high	97	Very high	34 Å²	34	34.5 Å²	34.5	18%	0.182	20%	0.2	C	C	.	.			trans	-144.8	107.3	179.1	174.5	20.1	0	0	0	110.8	Q558 L561 A596 F597 T598	Q558-D594 HydrophobicContact CG-CB 4.26Å; L561-D594 HydrophobicContact CD1-CB 3.96Å; D594-A596 PolarHBondContact O-N 3.44Å; D594-A596 VanDerWaalsContact O-N 3.17Å; D594-A596 WeakPolarHBondContact OD1-CB 3.28Å; D594-A596 PolarHBondContact OD1-N 3.32Å; D594-F597 HydrophobicContact CB-CB 4.05Å; D594-F597 PolarHBondContact O-N 3.05Å; D594-F597 WeakPolarHBondContact OD2-CB 3.41Å; D594-F597 PolarHBondContact OD2-N 3.01Å; D594-T598 PolarHBondContact O-N 3.15Å; D594-T598 PolarHBondContact O-OG1 3.04Å
595	P	95.8	Very high	97	Very high	72 Å²	72	34.5 Å²	34.5	47%	0.468	20%	0.201	S	C	.	.	H	α-helix	trans	-57.7	-29.6	178.9	-26.9	35.4	0	0	0	114.4	T599 I636	P595-T599 WeakPolarHBondContact O-CB 3.24Å; P595-T599 PolarHBondContact O-N 3.07Å; P595-T599 PolarHBondContact O-OG1 3.33Å; P595-I636 HydrophobicContact CB-CD1 4.31Å; P595-I636 HydrophobicContact CB-CG1 4.29Å; P595-I636 HydrophobicContact CB-CG2 4.24Å
596	A	96.9	Very high	97	Very high	67 Å²	67	30.9 Å²	30.9	55%	0.554	18%	0.184	S	C	*	.	H	α-helix	trans	-70.2	-43.9	179	0	0	0	0	0	111.3	D594 S600	D594-A596 PolarHBondContact O-N 3.44Å; D594-A596 VanDerWaalsContact O-N 3.17Å; D594-A596 WeakPolarHBondContact OD1-CB 3.28Å; D594-A596 PolarHBondContact OD1-N 3.32Å; A596-S600 PolarHBondContact O-N 3.14Å; A596-S600 VanDerWaalsContact O-N 3.16Å
597	F	97.8	Very high	97	Very high	20 Å²	20	33.3 Å²	33.3	9%	0.088	20%	0.199	C	C	.	.	H	α-helix	trans	-59.3	-52	171.3	169.4	-103	0	0	0	111.4	L561 P562 L565 D594 T599 S600 A601	L561-F597 VanDerWaalsContact C-CZ 3.46Å; L561-F597 HydrophobicContact CB-CD1 3.76Å; L561-F597 HydrophobicContact CB-CD2 3.93Å; L561-F597 HydrophobicContact CB-CE1 3.68Å; L561-F597 HydrophobicContact CB-CE2 3.86Å; L561-F597 HydrophobicContact CB-CG 3.88Å; L561-F597 HydrophobicContact CB-CZ 3.73Å; L561-F597 HydrophobicContact CD1-CB 3.98Å; L561-F597 HydrophobicContact CD1-CD1 3.78Å; L561-F597 HydrophobicContact CD1-CE1 4.47Å; L561-F597 HydrophobicContact CD1-CG 3.85Å; L561-F597 HydrophobicContact CG-CD1 4.31Å; L561-F597 WeakPolarHBondContact O-CZ 3.37Å; P562-F597 HydrophobicContact CB-CE2 4.19Å; P562-F597 HydrophobicContact CG-CD2 4.31Å; P562-F597 HydrophobicContact CG-CE2 3.83Å; L565-F597 HydrophobicContact CB-CZ 3.98Å; L565-F597 HydrophobicContact CD2-CE1 4.44Å; L565-F597 HydrophobicContact CD2-CZ 3.87Å; D594-F597 HydrophobicContact CB-CB 4.05Å; D594-F597 PolarHBondContact O-N 3.05Å; D594-F597 WeakPolarHBondContact OD2-CB 3.41Å; D594-F597 PolarHBondContact OD2-N 3.01Å; F597-T599 VanDerWaalsContact C-N 3.27Å; F597-T599 PolarHBondContact O-N 2.86Å; F597-S600 WeakPolarHBondContact O-CA 3.4Å; F597-S600 WeakPolarHBondContact O-CB 3.4Å; F597-S600 PolarHBondContact O-N 3.26Å; F597-S600 PolarHBondContact O-OG 3.44Å; F597-A601 HydrophobicContact CE1-CB 4.44Å; F597-A601 HydrophobicContact CE2-CB 4.36Å; F597-A601 HydrophobicContact CZ-CB 4.16Å; F597-A601 PolarHBondContact O-N 3.18Å
598	T	97.6	Very high	96.9	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-58.1	-40.5	-178.6	-55.4	0	0	0	0	111.6	C591 D594 S600 A601 E602 I605 L633 I636	C591-T598 HydrophobicContact CB-CG2 3.99Å; C591-T598 PolarHBondContact O-OG1 3.06Å; D594-T598 PolarHBondContact O-N 3.15Å; D594-T598 PolarHBondContact O-OG1 3.04Å; T598-S600 PolarHBondContact O-N 3.34Å; T598-A601 CarbonylContact O-C 3.02Å; T598-A601 PolarHBondContact O-N 3.19Å; T598-E602 PolarHBondContact O-N 3.11Å; T598-I605 HydrophobicContact CG2-CD1 4.23Å; T598-L633 HydrophobicContact CG2-CD2 3.58Å; T598-I636 HydrophobicContact CG2-CD1 3.59Å
599	T	97.8	Very high	96.8	Very high	54 Å²	54	33.7 Å²	33.7	33%	0.331	20%	0.2	S	C	.	.	H	α-helix	trans	-58.3	-44.4	172.6	-60	0	0	0	0	112.4	P595 F597 A601 I636 C639	P595-T599 WeakPolarHBondContact O-CB 3.24Å; P595-T599 PolarHBondContact O-N 3.07Å; P595-T599 PolarHBondContact O-OG1 3.33Å; F597-T599 VanDerWaalsContact C-N 3.27Å; F597-T599 PolarHBondContact O-N 2.86Å; T599-A601 PolarHBondContact O-N 3.21Å; T599-I636 VanDerWaalsContact OG1-CG2 3.28Å; T599-I636 WeakPolarHBondContact OG1-CG2 3.48Å; T599-C639 VanDerWaalsContact CA-SG 3.56Å
600	S	97.3	Very high	96.8	Very high	82 Å²	82	33.5 Å²	33.5	57%	0.573	20%	0.199	S	C	*	.	H	α-helix	trans	-68.7	-24.6	179.8	78.8	0	0	0	0	113.5	A596 F597 T598	A596-S600 PolarHBondContact O-N 3.14Å; A596-S600 VanDerWaalsContact O-N 3.16Å; F597-S600 WeakPolarHBondContact O-CA 3.4Å; F597-S600 WeakPolarHBondContact O-CB 3.4Å; F597-S600 PolarHBondContact O-N 3.26Å; F597-S600 PolarHBondContact O-OG 3.44Å; T598-S600 PolarHBondContact O-N 3.34Å
601	A	97.3	Very high	96.7	Very high	7 Å²	7	36.1 Å²	36.1	6%	0.058	22%	0.22	C	C	.	.	H	α-helix	trans	-104.5	-3.2	-175	0	0	0	0	0	114.2	L565 F597 T598 T599 N603 K604 I605	L565-A601 HydrophobicContact CD2-CB 3.53Å; F597-A601 HydrophobicContact CE1-CB 4.44Å; F597-A601 HydrophobicContact CE2-CB 4.36Å; F597-A601 HydrophobicContact CZ-CB 4.16Å; F597-A601 PolarHBondContact O-N 3.18Å; T598-A601 CarbonylContact O-C 3.02Å; T598-A601 PolarHBondContact O-N 3.19Å; T599-A601 PolarHBondContact O-N 3.21Å; A601-N603 PolarHBondContact O-N 3.02Å; A601-N603 VanDerWaalsContact O-N 3.07Å; A601-K604 PolarHBondContact O-N 3.46Å; A601-I605 HydrophobicContact CB-CD1 3.87Å; A601-I605 HydrophobicContact CB-CG1 4.41Å; A601-I605 PolarHBondContact O-N 2.99Å; A601-I605 VanDerWaalsContact O-N 3.08Å
602	E	96.9	Very high	96.6	Very high	6 Å²	6	36.5 Å²	36.5	3%	0.028	22%	0.222	C	C	.	.	H	α-helix	trans	-50.9	-37.2	-179.7	179.1	-77.8	156.5	0	0	112	T598 K604 I605 C606 P607 C639 P642 M643 R646	T598-E602 PolarHBondContact O-N 3.11Å; E602-K604 PolarHBondContact O-N 3.31Å; E602-I605 PolarHBondContact O-N 3.11Å; E602-C606 HydrophobicContact CG-CB 4.31Å; E602-C606 WeakPolarHBondContact O-CB 3.49Å; E602-C606 PolarHBondContact O-N 3.11Å; E602-C606 WeakPolarHBondContact OE1-CB 3.41Å; E602-P607 WeakPolarHBondContact O-CD 3.43Å; E602-C639 HydrophobicContact CG-CB 4.14Å; E602-P642 VanDerWaalsContact OE2-CB 3.28Å; E602-P642 WeakPolarHBondContact OE2-CB 3.37Å; E602-M643 HydrophobicContact CG-CB 4.43Å; E602-M643 WeakPolarHBondContact OE1-CA 3.34Å; E602-M643 PolarHBondContact OE1-N 2.97Å; E602-R646 IonicContact OE1-CZ 3.56Å; E602-R646 IonicContact OE1-NH1 3.42Å; E602-R646 PolarHBondContact OE1-NH1 3.24Å; E602-R646 IonicContact OE2-CZ 3.45Å; E602-R646 IonicContact OE2-NH1 2.64Å; E602-R646 PolarHBondContact OE2-NH1 3.34Å; E602-R646 IonicContact OE2-NH2 3.62Å
603	N	95.7	Very high	96.5	Very high	91 Å²	91	34.9 Å²	34.9	49%	0.487	21%	0.213	S	C	.	.	H	α-helix	trans	-65.2	-9.2	179.6	69.4	-16.5	0	0	0	114.6	A601 P607	A601-N603 PolarHBondContact O-N 3.02Å; A601-N603 VanDerWaalsContact O-N 3.07Å; N603-P607 WeakPolarHBondContact O-CG 3.26Å
604	K	95.5	Very high	96.4	Very high	123 Å²	123	37.7 Å²	37.7	54%	0.535	23%	0.227	S	C	.	.	H	α-helix	trans	-109.2	-45.4	171.4	-65.1	-179.4	-179.4	-178.2	0	111.4	A601 E602 L608	A601-K604 PolarHBondContact O-N 3.46Å; E602-K604 PolarHBondContact O-N 3.31Å; K604-L608 WeakPolarHBondContact O-CB 3.46Å; K604-L608 PolarHBondContact O-N 3.16Å
605	I	97.1	Very high	96.2	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-63.5	-56.8	-175.6	-60.8	166.3	0	0	0	110.3	L565 T598 A601 E602 L608 T609 I629 L633	L565-I605 HydrophobicContact CD1-CD1 4.35Å; L565-I605 HydrophobicContact CD1-CG1 3.79Å; L565-I605 HydrophobicContact CD2-CD1 4.24Å; L565-I605 HydrophobicContact CD2-CG1 4.03Å; T598-I605 HydrophobicContact CG2-CD1 4.23Å; A601-I605 HydrophobicContact CB-CD1 3.87Å; A601-I605 HydrophobicContact CB-CG1 4.41Å; A601-I605 PolarHBondContact O-N 2.99Å; A601-I605 VanDerWaalsContact O-N 3.08Å; E602-I605 PolarHBondContact O-N 3.11Å; I605-L608 WeakPolarHBondContact O-CB 3.46Å; I605-L608 PolarHBondContact O-N 3.35Å; I605-L608 VanDerWaalsContact O-N 3.14Å; I605-T609 PolarHBondContact O-N 2.91Å; I605-T609 PolarHBondContact O-OG1 2.9Å; I605-T609 VanDerWaalsContact O-OG1 3.04Å; I605-I629 HydrophobicContact CG2-CG2 3.85Å; I605-L633 HydrophobicContact CG2-CD1 4.13Å; I605-L633 HydrophobicContact CG2-CD2 4.43Å
606	C	97.3	Very high	96	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.8	-47.9	-175.3	171.7	0	0	0	0	112.9	E602 L608 T609 I610 L633 M643	E602-C606 HydrophobicContact CG-CB 4.31Å; E602-C606 WeakPolarHBondContact O-CB 3.49Å; E602-C606 PolarHBondContact O-N 3.11Å; E602-C606 WeakPolarHBondContact OE1-CB 3.41Å; C606-L608 VanDerWaalsContact C-N 3.33Å; C606-L608 PolarHBondContact O-N 3.42Å; C606-T609 PolarHBondContact O-N 3.23Å; C606-I610 VanDerWaalsContact O-CG1 3.29Å; C606-I610 WeakPolarHBondContact O-CG1 3.3Å; C606-I610 PolarHBondContact O-N 2.93Å; C606-L633 HydrophobicContact CB-CD1 3.98Å; C606-M643 HydrophobicContact CB-CG 4.46Å
607	P	96.6	Very high	95.4	Very high	51 Å²	51	40.1 Å²	40.1	33%	0.331	22%	0.217	S	C	.	.	H	α-helix	trans	-60.9	-37	175.1	-26.1	35.5	0	0	0	114.4	E602 N603 A611	E602-P607 WeakPolarHBondContact O-CD 3.43Å; N603-P607 WeakPolarHBondContact O-CG 3.26Å; P607-A611 WeakPolarHBondContact O-CB 3.46Å; P607-A611 PolarHBondContact O-N 3.11Å
608	L	96	Very high	94.7	Very high	31 Å²	31	45.4 Å²	45.4	16%	0.162	25%	0.246	C	C	.	.	H	α-helix	trans	-64.1	-49.9	176.6	176	65.3	0	0	0	110.3	V569 L587 K604 I605 C606 I610 A611 I612	V569-L608 HydrophobicContact CB-CD2 4.15Å; V569-L608 HydrophobicContact CG1-CD2 4.18Å; V569-L608 HydrophobicContact CG2-CD2 3.7Å; L587-L608 HydrophobicContact CD2-CD2 4.21Å; K604-L608 WeakPolarHBondContact O-CB 3.46Å; K604-L608 PolarHBondContact O-N 3.16Å; I605-L608 WeakPolarHBondContact O-CB 3.46Å; I605-L608 PolarHBondContact O-N 3.35Å; I605-L608 VanDerWaalsContact O-N 3.14Å; C606-L608 VanDerWaalsContact C-N 3.33Å; C606-L608 PolarHBondContact O-N 3.42Å; L608-I610 VanDerWaalsContact C-N 3.33Å; L608-I610 PolarHBondContact O-N 3.21Å; L608-A611 WeakPolarHBondContact O-CB 3.45Å; L608-A611 PolarHBondContact O-N 3.1Å; L608-A611 VanDerWaalsContact O-N 3.1Å; L608-I612 HydrophobicContact CD1-CD1 3.83Å; L608-I612 HydrophobicContact CD1-CG1 4.22Å; L608-I612 HydrophobicContact CD2-CD1 4.41Å; L608-I612 HydrophobicContact CG-CD1 3.78Å; L608-I612 HydrophobicContact CG-CG1 4.49Å; L608-I612 WeakPolarHBondContact O-CG1 3.37Å; L608-I612 PolarHBondContact O-N 3.11Å
609	T	97	Very high	94.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-59.5	-42.9	178.8	-51.9	0	0	0	0	111.4	M584 I605 C606 A611 I612 F613 A626 I629 F630	M584-T609 HydrophobicContact CE-CG2 4.35Å; I605-T609 PolarHBondContact O-N 2.91Å; I605-T609 PolarHBondContact O-OG1 2.9Å; I605-T609 VanDerWaalsContact O-OG1 3.04Å; C606-T609 PolarHBondContact O-N 3.23Å; T609-A611 PolarHBondContact O-N 2.86Å; T609-I612 PolarHBondContact O-N 3.32Å; T609-F613 VanDerWaalsContact O-CB 3.29Å; T609-F613 WeakPolarHBondContact O-CB 3.36Å; T609-F613 PolarHBondContact O-N 3.21Å; T609-A626 HydrophobicContact CG2-CB 3.78Å; T609-I629 HydrophobicContact CG2-CB 4.02Å; T609-I629 HydrophobicContact CG2-CD1 4.25Å; T609-I629 HydrophobicContact CG2-CG2 4.14Å; T609-I629 WeakPolarHBondContact OG1-CG2 3.16Å; T609-F630 HydrophobicContact CG2-CD1 4.26Å; T609-F630 HydrophobicContact CG2-CD2 4.36Å; T609-F630 HydrophobicContact CG2-CE1 3.72Å; T609-F630 HydrophobicContact CG2-CE2 3.84Å; T609-F630 HydrophobicContact CG2-CZ 3.48Å; T609-F630 VanDerWaalsContact CG2-CZ 3.48Å
610	I	96.6	Very high	93.8	Very high	17 Å²	17	50.1 Å²	50.1	9%	0.087	28%	0.275	C	S	.	.	H	α-helix	trans	-60.3	-45.5	174.1	-68.4	167.3	0	0	0	111	C606 L608 I612 F613 L614 F630 R646 L647 T650	C606-I610 VanDerWaalsContact O-CG1 3.29Å; C606-I610 WeakPolarHBondContact O-CG1 3.3Å; C606-I610 PolarHBondContact O-N 2.93Å; L608-I610 VanDerWaalsContact C-N 3.33Å; L608-I610 PolarHBondContact O-N 3.21Å; I610-I612 VanDerWaalsContact C-N 3.34Å; I610-I612 PolarHBondContact O-N 2.99Å; I610-F613 PolarHBondContact O-N 2.93Å; I610-L614 HydrophobicContact CG2-CD1 3.96Å; I610-L614 HydrophobicContact CG2-CG 4.4Å; I610-L614 WeakPolarHBondContact O-CB 3.34Å; I610-L614 WeakPolarHBondContact O-CG 3.05Å; I610-L614 PolarHBondContact O-N 3.46Å; I610-F630 HydrophobicContact CG1-CE1 3.95Å; I610-F630 HydrophobicContact CG1-CZ 3.69Å; I610-R646 HydrophobicContact CD1-CB 4.12Å; I610-L647 HydrophobicContact CD1-CB 4.17Å; I610-L647 HydrophobicContact CD1-CD1 4.22Å; I610-L647 HydrophobicContact CG1-CD1 3.92Å; I610-T650 HydrophobicContact CG2-CG2 4.13Å
611	A	95.3	Very high	93.4	Very high	55 Å²	55	50 Å²	50	46%	0.455	27%	0.271	S	S	.	.	H	α-helix	trans	-64	-39.9	-179.6	0	0	0	0	0	112	P607 L608 T609 K615	P607-A611 WeakPolarHBondContact O-CB 3.46Å; P607-A611 PolarHBondContact O-N 3.11Å; L608-A611 WeakPolarHBondContact O-CB 3.45Å; L608-A611 PolarHBondContact O-N 3.1Å; L608-A611 VanDerWaalsContact O-N 3.1Å; T609-A611 PolarHBondContact O-N 2.86Å; A611-K615 WeakPolarHBondContact O-CB 3.32Å; A611-K615 PolarHBondContact O-N 3.03Å
612	I	95.3	Very high	93.1	Very high	9 Å²	9	49.8 Å²	49.8	5%	0.046	27%	0.268	C	S	.	.	H	α-helix	trans	-65.7	-50.9	176.3	-70.8	170.7	0	0	0	110.1	A572 L580 M584 L608 T609 I610 L614 K615 Y616 V622	A572-I612 HydrophobicContact CB-CD1 4.28Å; L580-I612 HydrophobicContact CD1-CD1 4.13Å; L580-I612 HydrophobicContact CD2-CG2 4.34Å; M584-I612 HydrophobicContact CE-CG2 3.96Å; M584-I612 HydrophobicContact CG-CD1 4.48Å; M584-I612 HydrophobicContact SD-CD1 3.46Å; M584-I612 WeakPolarHBondContact SD-CD1 3.18Å; M584-I612 HydrophobicContact SD-CG2 4.03Å; L608-I612 HydrophobicContact CD1-CD1 3.83Å; L608-I612 HydrophobicContact CD1-CG1 4.22Å; L608-I612 HydrophobicContact CD2-CD1 4.41Å; L608-I612 HydrophobicContact CG-CD1 3.78Å; L608-I612 HydrophobicContact CG-CG1 4.49Å; L608-I612 WeakPolarHBondContact O-CG1 3.37Å; L608-I612 PolarHBondContact O-N 3.11Å; T609-I612 PolarHBondContact O-N 3.32Å; I610-I612 VanDerWaalsContact C-N 3.34Å; I610-I612 PolarHBondContact O-N 2.99Å; I612-L614 VanDerWaalsContact C-N 3.3Å; I612-L614 PolarHBondContact O-N 3.35Å; I612-K615 PolarHBondContact O-N 3.45Å; I612-K615 VanDerWaalsContact O-N 3.09Å; I612-Y616 HydrophobicContact CG2-CD2 3.96Å; I612-Y616 HydrophobicContact CG2-CE2 4.44Å; I612-Y616 WeakPolarHBondContact O-CD2 3.44Å; I612-Y616 PolarHBondContact O-N 2.94Å; I612-V622 HydrophobicContact CG2-CG1 3.43Å; I612-V622 VanDerWaalsContact CG2-CG1 3.43Å
613	F	94.6	Very high	92.7	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.009	27%	0.27	C	S	.	.	H	α-helix	trans	-53	-46.1	176.9	173	-116.7	0	0	0	112.4	T609 I610 N617 A623 A626 I654 L666 T669 I673	T609-F613 VanDerWaalsContact O-CB 3.29Å; T609-F613 WeakPolarHBondContact O-CB 3.36Å; T609-F613 PolarHBondContact O-N 3.21Å; I610-F613 PolarHBondContact O-N 2.93Å; F613-N617 WeakPolarHBondContact O-CA 3.32Å; F613-N617 PolarHBondContact O-N 3.33Å; F613-A623 HydrophobicContact CD2-CB 4.36Å; F613-A623 HydrophobicContact CE2-CB 4.27Å; F613-A626 HydrophobicContact CB-CB 4Å; F613-A626 HydrophobicContact CD2-CB 4.35Å; F613-I654 HydrophobicContact CE1-CD1 3.68Å; F613-I654 HydrophobicContact CZ-CD1 4.32Å; F613-L666 HydrophobicContact CE1-CD1 4Å; F613-L666 HydrophobicContact CE2-CD1 3.75Å; F613-L666 HydrophobicContact CZ-CD1 3.4Å; F613-L666 VanDerWaalsContact CZ-CD1 3.4Å; F613-T669 HydrophobicContact CE2-CG2 4.06Å; F613-I673 HydrophobicContact CD2-CD1 4.4Å; F613-I673 HydrophobicContact CE1-CD1 4.38Å; F613-I673 HydrophobicContact CE2-CD1 3.93Å; F613-I673 HydrophobicContact CZ-CD1 3.9Å
614	L	92.8	Very high	92.5	Very high	68 Å²	68	47.7 Å²	47.7	36%	0.356	27%	0.265	S	S	.	.	H	α-helix	trans	-73	-34	178.5	-68.2	177.6	0	0	0	113.3	I610 I612 N617 T650 I654	I610-L614 HydrophobicContact CG2-CD1 3.96Å; I610-L614 HydrophobicContact CG2-CG 4.4Å; I610-L614 WeakPolarHBondContact O-CB 3.34Å; I610-L614 WeakPolarHBondContact O-CG 3.05Å; I610-L614 PolarHBondContact O-N 3.46Å; I612-L614 VanDerWaalsContact C-N 3.3Å; I612-L614 PolarHBondContact O-N 3.35Å; L614-N617 PolarHBondContact O-ND2 3.15Å; L614-T650 HydrophobicContact CD1-CG2 3.86Å; L614-T650 HydrophobicContact CD2-CG2 3.91Å; L614-T650 HydrophobicContact CG-CG2 4.18Å; L614-I654 HydrophobicContact CD2-CD1 3.96Å
615	K	92.8	Very high	92.4	Very high	139 Å²	139	42.6 Å²	42.6	60%	0.604	24%	0.244	S	C	*	.	H	α-helix	trans	-72.5	-39.7	-178.6	-178.1	-178.9	176.6	-159.8	0	111.6	A611 I612	A611-K615 WeakPolarHBondContact O-CB 3.32Å; A611-K615 PolarHBondContact O-N 3.03Å; I612-K615 PolarHBondContact O-N 3.45Å; I612-K615 VanDerWaalsContact O-N 3.09Å
616	Y	91.6	Very high	92.2	Very high	41 Å²	41	42.5 Å²	42.5	16%	0.161	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	36.9	-177.3	-56.3	-78.9	0	0	0	111.6	L580 I612 N618 D619 V622	L580-Y616 HydrophobicContact CD2-CD2 3.73Å; L580-Y616 HydrophobicContact CD2-CE1 4.39Å; L580-Y616 HydrophobicContact CD2-CE2 3.2Å; L580-Y616 HydrophobicContact CD2-CG 4.48Å; I612-Y616 HydrophobicContact CG2-CD2 3.96Å; I612-Y616 HydrophobicContact CG2-CE2 4.44Å; I612-Y616 WeakPolarHBondContact O-CD2 3.44Å; I612-Y616 PolarHBondContact O-N 2.94Å; Y616-N618 PolarHBondContact O-N 2.98Å; Y616-D619 WeakPolarHBondContact O-CB 3.46Å; Y616-D619 PolarHBondContact O-N 3.24Å; Y616-V622 HydrophobicContact CD2-CG1 4.29Å; Y616-V622 HydrophobicContact CG-CG1 4.4Å
617	N	84.4	Confident	92	Very high	45 Å²	45	44.7 Å²	44.7	24%	0.241	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-9.9	-176.9	58.5	45.1	0	0	0	116.1	F613 L614 P663 L666	F613-N617 WeakPolarHBondContact O-CA 3.32Å; F613-N617 PolarHBondContact O-N 3.33Å; L614-N617 PolarHBondContact O-ND2 3.15Å; N617-P663 HydrophobicContact CB-CG 4.14Å; N617-P663 WeakPolarHBondContact OD1-CG 3.47Å; N617-L666 HydrophobicContact CB-CD1 3.85Å; N617-L666 HydrophobicContact CB-CD2 3.97Å; N617-L666 HydrophobicContact CB-CG 4.43Å
618	N	84.3	Confident	91.8	Very high	130 Å²	130	45.3 Å²	45.3	70%	0.695	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-5.8	174.6	-67.5	-42.3	0	0	0	112.5	Y616 P663	Y616-N618 PolarHBondContact O-N 2.98Å; N618-P663 WeakPolarHBondContact OD1-CB 3.44Å; N618-P663 VanDerWaalsContact OD1-CG 3.26Å; N618-P663 WeakPolarHBondContact OD1-CG 3.37Å
619	D	88.8	Confident	91.8	Very high	53 Å²	53	43.9 Å²	43.9	28%	0.283	25%	0.246	S	C	.	.			trans	-103.8	106.7	-177.2	-172.1	-31.6	0	0	0	109.4	Y616 V621 V622 A623	Y616-D619 WeakPolarHBondContact O-CB 3.46Å; Y616-D619 PolarHBondContact O-N 3.24Å; D619-V621 VanDerWaalsContact C-N 3.29Å; D619-V621 PolarHBondContact O-N 3.49Å; D619-V621 WeakPolarHBondContact OD1-CB 3.49Å; D619-V621 PolarHBondContact OD1-N 2.85Å; D619-V622 HydrophobicContact CB-CB 4.15Å; D619-V622 HydrophobicContact CB-CG2 4.13Å; D619-V622 PolarHBondContact O-N 2.91Å; D619-V622 PolarHBondContact OD1-N 3.32Å; D619-A623 PolarHBondContact O-N 3.15Å; D619-A623 VanDerWaalsContact O-N 3.12Å
620	P	86.3	Confident	91.8	Very high	101 Å²	101	43.9 Å²	43.9	66%	0.656	25%	0.246	S	C	*	.	H	α-helix	trans	-66.8	-29.2	-177.3	26.9	-33.6	0	0	0	112.9	A623 A624	P620-A623 WeakPolarHBondContact O-CB 3.08Å; P620-A623 PolarHBondContact O-N 3.11Å; P620-A624 PolarHBondContact O-N 3.48Å
621	V	89.6	Confident	91.6	Very high	80 Å²	80	46.6 Å²	46.6	49%	0.485	26%	0.258	S	S	.	.	H	α-helix	trans	-67.6	-47.6	179.1	179	0	0	0	0	109.6	T581 D619 A623 A624 L625	T581-V621 HydrophobicContact CG2-CG1 3.98Å; D619-V621 VanDerWaalsContact C-N 3.29Å; D619-V621 PolarHBondContact O-N 3.49Å; D619-V621 WeakPolarHBondContact OD1-CB 3.49Å; D619-V621 PolarHBondContact OD1-N 2.85Å; V621-A623 PolarHBondContact O-N 3.16Å; V621-A624 PolarHBondContact O-N 3.4Å; V621-L625 HydrophobicContact CG1-CD1 4.29Å; V621-L625 WeakPolarHBondContact O-CG 3.34Å; V621-L625 PolarHBondContact O-N 2.8Å
622	V	91.4	Very high	91.5	Very high	1 Å²	1	46 Å²	46	1%	0.006	25%	0.245	C	C	.	.	H	α-helix	trans	-63.9	-33.3	176.3	178	0	0	0	0	111.5	T581 I612 Y616 D619 A626	T581-V622 HydrophobicContact CG2-CG2 4.26Å; I612-V622 HydrophobicContact CG2-CG1 3.43Å; I612-V622 VanDerWaalsContact CG2-CG1 3.43Å; Y616-V622 HydrophobicContact CD2-CG1 4.29Å; Y616-V622 HydrophobicContact CG-CG1 4.4Å; D619-V622 HydrophobicContact CB-CB 4.15Å; D619-V622 HydrophobicContact CB-CG2 4.13Å; D619-V622 PolarHBondContact O-N 2.91Å; D619-V622 PolarHBondContact OD1-N 3.32Å; V622-A626 WeakPolarHBondContact O-CB 3.23Å; V622-A626 PolarHBondContact O-N 3.29Å
623	A	88.8	Confident	91.6	Very high	8 Å²	8	45.5 Å²	45.5	7%	0.066	24%	0.243	C	C	.	.	H	α-helix	trans	-66.3	-43.7	176.8	0	0	0	0	0	112.1	F613 D619 P620 V621 A626 Q627 T669	F613-A623 HydrophobicContact CD2-CB 4.36Å; F613-A623 HydrophobicContact CE2-CB 4.27Å; D619-A623 PolarHBondContact O-N 3.15Å; D619-A623 VanDerWaalsContact O-N 3.12Å; P620-A623 WeakPolarHBondContact O-CB 3.08Å; P620-A623 PolarHBondContact O-N 3.11Å; V621-A623 PolarHBondContact O-N 3.16Å; A623-A626 PolarHBondContact O-N 2.92Å; A623-Q627 PolarHBondContact O-N 2.9Å; A623-T669 HydrophobicContact CB-CG2 4.01Å
624	A	89.7	Confident	91.4	Very high	46 Å²	46	45.4 Å²	45.4	38%	0.38	24%	0.242	S	C	.	.	H	α-helix	trans	-61.3	-48.7	174.6	0	0	0	0	0	111.5	P620 V621 A626 Q627 D628	P620-A624 PolarHBondContact O-N 3.48Å; V621-A624 PolarHBondContact O-N 3.4Å; A624-A626 VanDerWaalsContact C-N 3.27Å; A624-A626 PolarHBondContact O-N 3.45Å; A624-Q627 CarbonylContact O-C 3.44Å; A624-Q627 WeakPolarHBondContact O-CA 3.22Å; A624-Q627 VanDerWaalsContact O-CB 3.29Å; A624-Q627 WeakPolarHBondContact O-CB 3.42Å; A624-Q627 PolarHBondContact O-N 3.33Å; A624-D628 PolarHBondContact O-N 2.97Å
625	L	93.8	Very high	91.3	Very high	16 Å²	16	46.7 Å²	46.7	8%	0.084	25%	0.247	C	C	.	.	H	α-helix	trans	-61.4	-34.9	177.1	-67	174	0	0	0	112.9	T581 M584 E585 V621 I629	T581-L625 HydrophobicContact CG2-CD1 3.99Å; M584-L625 HydrophobicContact CB-CB 4.02Å; M584-L625 HydrophobicContact CB-CD1 3.98Å; M584-L625 HydrophobicContact CE-CB 4.31Å; E585-L625 HydrophobicContact CG-CD1 4.14Å; E585-L625 HydrophobicContact CG-CD2 3.42Å; E585-L625 VanDerWaalsContact CG-CD2 3.42Å; E585-L625 HydrophobicContact CG-CG 4.43Å; V621-L625 HydrophobicContact CG1-CD1 4.29Å; V621-L625 WeakPolarHBondContact O-CG 3.34Å; V621-L625 PolarHBondContact O-N 2.8Å; L625-I629 WeakPolarHBondContact O-CG1 3.17Å; L625-I629 PolarHBondContact O-N 3.24Å
626	A	94.4	Very high	91.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-66.8	-40.9	173.2	0	0	0	0	0	111.8	M584 T609 F613 V622 A623 A624 D628 I629 F630	M584-A626 HydrophobicContact CE-CB 4.09Å; T609-A626 HydrophobicContact CG2-CB 3.78Å; F613-A626 HydrophobicContact CB-CB 4Å; F613-A626 HydrophobicContact CD2-CB 4.35Å; V622-A626 WeakPolarHBondContact O-CB 3.23Å; V622-A626 PolarHBondContact O-N 3.29Å; A623-A626 PolarHBondContact O-N 2.92Å; A624-A626 VanDerWaalsContact C-N 3.27Å; A624-A626 PolarHBondContact O-N 3.45Å; A626-D628 VanDerWaalsContact C-N 3.35Å; A626-I629 PolarHBondContact O-N 3Å; A626-F630 HydrophobicContact CB-CE2 4.31Å; A626-F630 WeakPolarHBondContact O-CD2 3.3Å; A626-F630 WeakPolarHBondContact O-CG 3.39Å; A626-F630 PolarHBondContact O-N 3.1Å
627	Q	91.4	Very high	91.4	Very high	46 Å²	46	45.3 Å²	45.3	22%	0.215	24%	0.244	C	C	.	.	H	α-helix	trans	-60.9	-41.8	174.8	177.6	175.6	-10.2	0	0	111.8	A623 A624 I629 F630 K631 I673	A623-Q627 PolarHBondContact O-N 2.9Å; A624-Q627 CarbonylContact O-C 3.44Å; A624-Q627 WeakPolarHBondContact O-CA 3.22Å; A624-Q627 VanDerWaalsContact O-CB 3.29Å; A624-Q627 WeakPolarHBondContact O-CB 3.42Å; A624-Q627 PolarHBondContact O-N 3.33Å; Q627-I629 PolarHBondContact O-N 3.15Å; Q627-F630 CarbonylContact O-C 3.47Å; Q627-F630 PolarHBondContact O-N 3.07Å; Q627-F630 VanDerWaalsContact O-N 3.14Å; Q627-K631 PolarHBondContact O-N 2.97Å; Q627-I673 HydrophobicContact CB-CD1 4.39Å; Q627-I673 HydrophobicContact CB-CG1 3.81Å; Q627-I673 HydrophobicContact CG-CG1 3.86Å
628	D	93.3	Very high	91.8	Very high	64 Å²	64	45 Å²	45	34%	0.342	25%	0.252	S	S	.	.	H	α-helix	trans	-61.3	-44.5	176.8	-65.2	-29.6	0	0	0	111.9	A624 A626 F630 K631 E632	A624-D628 PolarHBondContact O-N 2.97Å; A626-D628 VanDerWaalsContact C-N 3.35Å; D628-F630 VanDerWaalsContact C-N 3.3Å; D628-F630 PolarHBondContact O-N 2.97Å; D628-K631 VanDerWaalsContact O-CB 3.29Å; D628-K631 WeakPolarHBondContact O-CB 3.06Å; D628-K631 PolarHBondContact O-N 3.24Å; D628-K631 VanDerWaalsContact O-N 3.13Å; D628-E632 WeakPolarHBondContact O-CG 3.19Å; D628-E632 PolarHBondContact O-N 3.34Å
629	I	96.6	Very high	92.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.5	-40	175.3	-63.1	168.4	0	0	0	110.7	M584 L587 C588 I605 T609 L625 A626 Q627 K631 E632 L633	M584-I629 HydrophobicContact CE-CD1 3.56Å; M584-I629 HydrophobicContact SD-CD1 3.86Å; L587-I629 HydrophobicContact CB-CD1 4.37Å; L587-I629 HydrophobicContact CD2-CD1 3.99Å; L587-I629 HydrophobicContact CG-CD1 4.15Å; C588-I629 HydrophobicContact CB-CG1 3.79Å; I605-I629 HydrophobicContact CG2-CG2 3.85Å; T609-I629 HydrophobicContact CG2-CB 4.02Å; T609-I629 HydrophobicContact CG2-CD1 4.25Å; T609-I629 HydrophobicContact CG2-CG2 4.14Å; T609-I629 WeakPolarHBondContact OG1-CG2 3.16Å; L625-I629 WeakPolarHBondContact O-CG1 3.17Å; L625-I629 PolarHBondContact O-N 3.24Å; A626-I629 PolarHBondContact O-N 3Å; Q627-I629 PolarHBondContact O-N 3.15Å; I629-K631 VanDerWaalsContact C-N 3.34Å; I629-E632 PolarHBondContact O-N 2.98Å; I629-L633 HydrophobicContact CG2-CD1 4.23Å; I629-L633 HydrophobicContact CG2-CG 4.44Å; I629-L633 VanDerWaalsContact O-CG 3.29Å; I629-L633 WeakPolarHBondContact O-CG 3.38Å; I629-L633 PolarHBondContact O-N 3.41Å
630	F	95.6	Very high	92.5	Very high	1 Å²	1	37.1 Å²	37.1	0%	0.004	21%	0.209	C	C	.	.	H	α-helix	trans	-66.6	-34.4	175.4	-64.8	-47.5	0	0	0	112.7	T609 I610 A626 Q627 D628 L633 A634 L647 I673	T609-F630 HydrophobicContact CG2-CD1 4.26Å; T609-F630 HydrophobicContact CG2-CD2 4.36Å; T609-F630 HydrophobicContact CG2-CE1 3.72Å; T609-F630 HydrophobicContact CG2-CE2 3.84Å; T609-F630 HydrophobicContact CG2-CZ 3.48Å; T609-F630 VanDerWaalsContact CG2-CZ 3.48Å; I610-F630 HydrophobicContact CG1-CE1 3.95Å; I610-F630 HydrophobicContact CG1-CZ 3.69Å; A626-F630 HydrophobicContact CB-CE2 4.31Å; A626-F630 WeakPolarHBondContact O-CD2 3.3Å; A626-F630 WeakPolarHBondContact O-CG 3.39Å; A626-F630 PolarHBondContact O-N 3.1Å; Q627-F630 CarbonylContact O-C 3.47Å; Q627-F630 PolarHBondContact O-N 3.07Å; Q627-F630 VanDerWaalsContact O-N 3.14Å; D628-F630 VanDerWaalsContact C-N 3.3Å; D628-F630 PolarHBondContact O-N 2.97Å; F630-L633 PolarHBondContact O-N 3.47Å; F630-A634 VanDerWaalsContact O-CB 3.27Å; F630-A634 WeakPolarHBondContact O-CB 3.38Å; F630-A634 PolarHBondContact O-N 3.37Å; F630-L647 HydrophobicContact CB-CD2 4.32Å; F630-L647 HydrophobicContact CD1-CD1 4.38Å; F630-L647 HydrophobicContact CD1-CD2 3.71Å; F630-L647 HydrophobicContact CD2-CD1 4.39Å; F630-L647 HydrophobicContact CD2-CD2 4.25Å; F630-L647 HydrophobicContact CE1-CD1 3.89Å; F630-L647 HydrophobicContact CE1-CD2 4.03Å; F630-L647 HydrophobicContact CE1-CG 4.48Å; F630-L647 HydrophobicContact CE2-CD1 3.91Å; F630-L647 HydrophobicContact CG-CD2 3.85Å; F630-L647 HydrophobicContact CZ-CD1 3.63Å; F630-L647 HydrophobicContact CZ-CD2 4.44Å; F630-I673 HydrophobicContact CB-CG2 4.22Å; F630-I673 HydrophobicContact CD2-CD1 4.09Å; F630-I673 HydrophobicContact CD2-CG1 4.35Å; F630-I673 HydrophobicContact CD2-CG2 3.72Å; F630-I673 HydrophobicContact CE2-CD1 4.24Å; F630-I673 HydrophobicContact CE2-CG2 4.44Å; F630-I673 HydrophobicContact CG-CG2 4.21Å
631	K	92.5	Very high	92.8	Very high	74 Å²	74	34.1 Å²	34.1	32%	0.322	20%	0.197	S	C	.	.	H	α-helix	trans	-58.3	-53.4	172.5	-179.3	-177.7	172.6	179.7	0	110.1	Q627 D628 I629 L633 A634 Q635 T676	Q627-K631 PolarHBondContact O-N 2.97Å; D628-K631 VanDerWaalsContact O-CB 3.29Å; D628-K631 WeakPolarHBondContact O-CB 3.06Å; D628-K631 PolarHBondContact O-N 3.24Å; D628-K631 VanDerWaalsContact O-N 3.13Å; I629-K631 VanDerWaalsContact C-N 3.34Å; K631-L633 PolarHBondContact O-N 3.03Å; K631-A634 PolarHBondContact O-N 3.44Å; K631-A634 VanDerWaalsContact O-N 3.13Å; K631-Q635 WeakPolarHBondContact O-CG 3.46Å; K631-Q635 PolarHBondContact O-N 3.42Å; K631-Q635 VanDerWaalsContact O-N 3.14Å; K631-T676 HydrophobicContact CB-CG2 3.67Å; K631-T676 HydrophobicContact CG-CG2 3.85Å
632	E	94.5	Very high	93.1	Very high	41 Å²	41	33 Å²	33	19%	0.192	19%	0.191	C	C	.	.	H	α-helix	trans	-60.4	-42.7	179.6	-65.9	-51.5	132.3	0	0	112.2	C591 T592 D628 I629 A634 Q635	C591-E632 HydrophobicContact CB-CB 4.31Å; T592-E632 HydrophobicContact CG2-CG 3.88Å; T592-E632 WeakPolarHBondContact CG2-OE2 3.36Å; D628-E632 WeakPolarHBondContact O-CG 3.19Å; D628-E632 PolarHBondContact O-N 3.34Å; I629-E632 PolarHBondContact O-N 2.98Å; E632-A634 PolarHBondContact O-N 2.91Å; E632-Q635 PolarHBondContact O-N 3.18Å
633	L	95.6	Very high	93.3	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65.8	-37.4	175.8	-68.2	177.9	0	0	0	112.5	T598 I605 C606 I629 F630 K631 Q635 I636 C639 M643	T598-L633 HydrophobicContact CG2-CD2 3.58Å; I605-L633 HydrophobicContact CG2-CD1 4.13Å; I605-L633 HydrophobicContact CG2-CD2 4.43Å; C606-L633 HydrophobicContact CB-CD1 3.98Å; I629-L633 HydrophobicContact CG2-CD1 4.23Å; I629-L633 HydrophobicContact CG2-CG 4.44Å; I629-L633 VanDerWaalsContact O-CG 3.29Å; I629-L633 WeakPolarHBondContact O-CG 3.38Å; I629-L633 PolarHBondContact O-N 3.41Å; F630-L633 PolarHBondContact O-N 3.47Å; K631-L633 PolarHBondContact O-N 3.03Å; L633-Q635 VanDerWaalsContact C-N 3.3Å; L633-Q635 PolarHBondContact O-N 3.24Å; L633-I636 PolarHBondContact O-N 3.47Å; L633-C639 HydrophobicContact CB-CB 4.47Å; L633-C639 HydrophobicContact CD2-CB 4.49Å; L633-C639 VanDerWaalsContact O-CB 3.25Å; L633-C639 WeakPolarHBondContact O-CB 3.32Å; L633-M643 HydrophobicContact CB-SD 3.44Å; L633-M643 WeakPolarHBondContact CB-SD 3.05Å; L633-M643 HydrophobicContact CD1-SD 4.21Å
634	A	92.4	Very high	93.6	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-67.5	-30.8	180	0	0	0	0	0	112.5	F630 K631 E632 I636 Q640 M643 V677 N680	F630-A634 VanDerWaalsContact O-CB 3.27Å; F630-A634 WeakPolarHBondContact O-CB 3.38Å; F630-A634 PolarHBondContact O-N 3.37Å; K631-A634 PolarHBondContact O-N 3.44Å; K631-A634 VanDerWaalsContact O-N 3.13Å; E632-A634 PolarHBondContact O-N 2.91Å; A634-I636 VanDerWaalsContact C-N 3.25Å; A634-I636 PolarHBondContact O-N 3.36Å; A634-Q640 VanDerWaalsContact O-CG 3.31Å; A634-Q640 WeakPolarHBondContact O-CG 3.3Å; A634-Q640 PolarHBondContact O-NE2 3.18Å; A634-M643 HydrophobicContact CB-CE 3.92Å; A634-V677 HydrophobicContact CB-CG2 4.43Å; A634-N680 HydrophobicContact CB-CB 3.72Å
635	Q	90.1	Very high	93.9	Very high	95 Å²	95	37.1 Å²	37.1	44%	0.444	20%	0.203	S	C	.	.	H	α-helix	trans	-69.7	-21.8	176.5	-69.8	177.8	8.6	0	0	113.1	K631 E632 L633 N680	K631-Q635 WeakPolarHBondContact O-CG 3.46Å; K631-Q635 PolarHBondContact O-N 3.42Å; K631-Q635 VanDerWaalsContact O-N 3.14Å; E632-Q635 PolarHBondContact O-N 3.18Å; L633-Q635 VanDerWaalsContact C-N 3.3Å; L633-Q635 PolarHBondContact O-N 3.24Å; Q635-N680 HydrophobicContact CG-CB 4.1Å; Q635-N680 VanDerWaalsContact CG-OD1 3.25Å; Q635-N680 WeakPolarHBondContact CG-OD1 3.45Å
636	I	93.9	Very high	93.9	Very high	22 Å²	22	40.6 Å²	40.6	11%	0.113	22%	0.215	C	C	.	.	S	Bend	trans	-91.6	111	-178.7	-58.5	169.1	0	0	0	110.2	P595 T598 T599 L633 A634 G638 C639 Q640	P595-I636 HydrophobicContact CB-CD1 4.31Å; P595-I636 HydrophobicContact CB-CG1 4.29Å; P595-I636 HydrophobicContact CB-CG2 4.24Å; T598-I636 HydrophobicContact CG2-CD1 3.59Å; T599-I636 VanDerWaalsContact OG1-CG2 3.28Å; T599-I636 WeakPolarHBondContact OG1-CG2 3.48Å; L633-I636 PolarHBondContact O-N 3.47Å; A634-I636 VanDerWaalsContact C-N 3.25Å; A634-I636 PolarHBondContact O-N 3.36Å; I636-G638 PolarHBondContact O-N 3.11Å; I636-G638 VanDerWaalsContact O-N 3.12Å; I636-C639 HydrophobicContact CB-CB 4.17Å; I636-C639 HydrophobicContact CG2-CB 4.36Å; I636-C639 WeakPolarHBondContact O-CB 3.26Å; I636-C639 PolarHBondContact O-N 3.01Å; I636-Q640 PolarHBondContact O-N 3.08Å
637	E	91.3	Very high	94.1	Very high	128 Å²	128	40.6 Å²	40.6	60%	0.598	22%	0.215	S	C	*	.	H	α-helix	trans	-54.2	-37.1	-176.4	-169.4	171.9	151.9	0	0	113.5	C639 K682	E637-C639 VanDerWaalsContact C-N 3.28Å; E637-C639 PolarHBondContact O-N 2.87Å; E637-K682 IonicContact OE2-NZ 2.79Å; E637-K682 PolarHBondContact OE2-NZ 3.21Å
638	G	93.2	Very high	94.3	Very high	39 Å²	39	38.4 Å²	38.4	40%	0.402	20%	0.204	S	C	.	.	H	α-helix	trans	-66.7	-24.8	176.5	0	0	0	0	0	114.7	I636	I636-G638 PolarHBondContact O-N 3.11Å; I636-G638 VanDerWaalsContact O-N 3.12Å
639	C	95.6	Very high	94.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-88.1	-29.2	-179.7	-66	0	0	0	0	112.8	T599 E602 L633 I636 E637 G641 P642 M643	T599-C639 VanDerWaalsContact CA-SG 3.56Å; E602-C639 HydrophobicContact CG-CB 4.14Å; L633-C639 HydrophobicContact CB-CB 4.47Å; L633-C639 HydrophobicContact CD2-CB 4.49Å; L633-C639 VanDerWaalsContact O-CB 3.25Å; L633-C639 WeakPolarHBondContact O-CB 3.32Å; I636-C639 HydrophobicContact CB-CB 4.17Å; I636-C639 HydrophobicContact CG2-CB 4.36Å; I636-C639 WeakPolarHBondContact O-CB 3.26Å; I636-C639 PolarHBondContact O-N 3.01Å; E637-C639 VanDerWaalsContact C-N 3.28Å; E637-C639 PolarHBondContact O-N 2.87Å; C639-G641 PolarHBondContact O-N 3.48Å; C639-P642 WeakPolarHBondContact O-CD 3.32Å; C639-M643 WeakPolarHBondContact O-CB 3.34Å; C639-M643 PolarHBondContact O-N 3.49Å
640	Q	92.4	Very high	94.5	Very high	18 Å²	18	39.6 Å²	39.6	8%	0.084	22%	0.215	C	C	.	.	H	α-helix	trans	-51.5	-54.7	-169.7	-73.1	172.8	3.6	0	0	113.4	A634 I636 Q644 N680	A634-Q640 VanDerWaalsContact O-CG 3.31Å; A634-Q640 WeakPolarHBondContact O-CG 3.3Å; A634-Q640 PolarHBondContact O-NE2 3.18Å; I636-Q640 PolarHBondContact O-N 3.08Å; Q640-Q644 VanDerWaalsContact O-CB 3.23Å; Q640-Q644 WeakPolarHBondContact O-CB 3.46Å; Q640-Q644 WeakPolarHBondContact O-CG 3.19Å; Q640-Q644 PolarHBondContact O-N 3.31Å; Q640-N680 PolarHBondContact NE2-O 2.91Å
641	G	92.8	Very high	94.6	Very high	38 Å²	38	39.6 Å²	39.6	39%	0.392	22%	0.215	S	C	.	.	H	α-helix	trans	-60.9	-58.6	-178.5	0	0	0	0	0	113.3	C639 M643 Q644 M645	C639-G641 PolarHBondContact O-N 3.48Å; G641-M643 VanDerWaalsContact C-N 3.34Å; G641-M643 PolarHBondContact O-N 3.48Å; G641-Q644 PolarHBondContact O-N 3.25Å; G641-M645 WeakPolarHBondContact O-CG 3.39Å; G641-M645 PolarHBondContact O-N 3.33Å; G641-M645 VanDerWaalsContact O-N 3.12Å
642	P	95.7	Very high	94.8	Very high	57 Å²	57	36.8 Å²	36.8	37%	0.37	20%	0.203	S	C	.	.	H	α-helix	trans	-57	-42.2	177.3	-27.1	35.7	0	0	0	113.9	E602 C639 M645 R646	E602-P642 VanDerWaalsContact OE2-CB 3.28Å; E602-P642 WeakPolarHBondContact OE2-CB 3.37Å; C639-P642 WeakPolarHBondContact O-CD 3.32Å; P642-M645 PolarHBondContact O-N 3.13Å; P642-R646 VanDerWaalsContact C-NH1 3.25Å; P642-R646 VanDerWaalsContact CB-NH1 3.3Å; P642-R646 PolarHBondContact O-N 3.25Å; P642-R646 PolarHBondContact O-NH1 3.48Å
643	M	95.6	Very high	94.9	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.5	-49	179.6	-179.1	-163.8	62.9	0	0	110.7	E602 C606 L633 A634 C639 G641 M645 R646 L647 V677	E602-M643 HydrophobicContact CG-CB 4.43Å; E602-M643 WeakPolarHBondContact OE1-CA 3.34Å; E602-M643 PolarHBondContact OE1-N 2.97Å; C606-M643 HydrophobicContact CB-CG 4.46Å; L633-M643 HydrophobicContact CB-SD 3.44Å; L633-M643 WeakPolarHBondContact CB-SD 3.05Å; L633-M643 HydrophobicContact CD1-SD 4.21Å; A634-M643 HydrophobicContact CB-CE 3.92Å; C639-M643 WeakPolarHBondContact O-CB 3.34Å; C639-M643 PolarHBondContact O-N 3.49Å; G641-M643 VanDerWaalsContact C-N 3.34Å; G641-M643 PolarHBondContact O-N 3.48Å; M643-M645 VanDerWaalsContact C-N 3.28Å; M643-M645 PolarHBondContact O-N 3.36Å; M643-R646 PolarHBondContact O-N 3.34Å; M643-L647 HydrophobicContact CG-CB 4.49Å; M643-L647 WeakPolarHBondContact O-CB 3.2Å; M643-L647 PolarHBondContact O-N 2.8Å; M643-V677 HydrophobicContact CE-CG1 4.2Å; M643-V677 HydrophobicContact CE-CG2 4.11Å
644	Q	94.8	Very high	94.8	Very high	9 Å²	9	39 Å²	39	4%	0.042	22%	0.222	C	C	.	.	H	α-helix	trans	-57.9	-42	179.5	-75	168.4	18.5	0	0	111.4	Q640 G641 R646 I648 V677 T681 S686 L688 L689	Q640-Q644 VanDerWaalsContact O-CB 3.23Å; Q640-Q644 WeakPolarHBondContact O-CB 3.46Å; Q640-Q644 WeakPolarHBondContact O-CG 3.19Å; Q640-Q644 PolarHBondContact O-N 3.31Å; G641-Q644 PolarHBondContact O-N 3.25Å; Q644-R646 PolarHBondContact O-N 3.09Å; Q644-R646 VanDerWaalsContact O-N 3.15Å; Q644-I648 HydrophobicContact CB-CG1 4Å; Q644-I648 HydrophobicContact CG-CG1 4.28Å; Q644-I648 VanDerWaalsContact O-CB 3.28Å; Q644-I648 WeakPolarHBondContact O-CB 3.42Å; Q644-I648 VanDerWaalsContact O-CG1 3.26Å; Q644-I648 WeakPolarHBondContact O-CG1 3.38Å; Q644-I648 PolarHBondContact O-N 3.21Å; Q644-I648 VanDerWaalsContact O-N 3.08Å; Q644-V677 HydrophobicContact CG-CG1 4.2Å; Q644-T681 PolarHBondContact NE2-OG1 3.02Å; Q644-T681 VanDerWaalsContact NE2-OG1 3.11Å; Q644-S686 PolarHBondContact OE1-OG 3.14Å; Q644-L688 HydrophobicContact CB-CD2 4.46Å; Q644-L688 VanDerWaalsContact O-CD2 3.3Å; Q644-L688 WeakPolarHBondContact O-CD2 3.41Å; Q644-L689 HydrophobicContact CG-CD1 4.46Å
645	M	95.7	Very high	95	Very high	132 Å²	132	39.6 Å²	39.6	65%	0.65	23%	0.225	S	C	*	.	H	α-helix	trans	-61.3	-22	177.5	-73	-63.1	-59	0	0	113.8	G641 P642 M643 L688	G641-M645 WeakPolarHBondContact O-CG 3.39Å; G641-M645 PolarHBondContact O-N 3.33Å; G641-M645 VanDerWaalsContact O-N 3.12Å; P642-M645 PolarHBondContact O-N 3.13Å; M643-M645 VanDerWaalsContact C-N 3.28Å; M643-M645 PolarHBondContact O-N 3.36Å; M645-L688 HydrophobicContact SD-CD2 3.97Å
646	R	95.8	Very high	95.2	Very high	89 Å²	89	41.3 Å²	41.3	34%	0.336	23%	0.233	S	C	.	.	H	α-helix	trans	-99.5	-45.1	178.6	-65.3	-177.6	-176.6	91.2	-12.1	112.9	E602 I610 P642 M643 Q644 T650	E602-R646 IonicContact OE1-CZ 3.56Å; E602-R646 IonicContact OE1-NH1 3.42Å; E602-R646 PolarHBondContact OE1-NH1 3.24Å; E602-R646 IonicContact OE2-CZ 3.45Å; E602-R646 IonicContact OE2-NH1 2.64Å; E602-R646 PolarHBondContact OE2-NH1 3.34Å; E602-R646 IonicContact OE2-NH2 3.62Å; I610-R646 HydrophobicContact CD1-CB 4.12Å; P642-R646 VanDerWaalsContact C-NH1 3.25Å; P642-R646 VanDerWaalsContact CB-NH1 3.3Å; P642-R646 PolarHBondContact O-N 3.25Å; P642-R646 PolarHBondContact O-NH1 3.48Å; M643-R646 PolarHBondContact O-N 3.34Å; Q644-R646 PolarHBondContact O-N 3.09Å; Q644-R646 VanDerWaalsContact O-N 3.15Å; R646-T650 PolarHBondContact O-OG1 3.36Å
647	L	96.8	Very high	95.2	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-78.3	-48.7	-172.9	178.1	60.1	0	0	0	112.3	I610 F630 M643 T650 L651 I673 V677	I610-L647 HydrophobicContact CD1-CB 4.17Å; I610-L647 HydrophobicContact CD1-CD1 4.22Å; I610-L647 HydrophobicContact CG1-CD1 3.92Å; F630-L647 HydrophobicContact CB-CD2 4.32Å; F630-L647 HydrophobicContact CD1-CD1 4.38Å; F630-L647 HydrophobicContact CD1-CD2 3.71Å; F630-L647 HydrophobicContact CD2-CD1 4.39Å; F630-L647 HydrophobicContact CD2-CD2 4.25Å; F630-L647 HydrophobicContact CE1-CD1 3.89Å; F630-L647 HydrophobicContact CE1-CD2 4.03Å; F630-L647 HydrophobicContact CE1-CG 4.48Å; F630-L647 HydrophobicContact CE2-CD1 3.91Å; F630-L647 HydrophobicContact CG-CD2 3.85Å; F630-L647 HydrophobicContact CZ-CD1 3.63Å; F630-L647 HydrophobicContact CZ-CD2 4.44Å; M643-L647 HydrophobicContact CG-CB 4.49Å; M643-L647 WeakPolarHBondContact O-CB 3.2Å; M643-L647 PolarHBondContact O-N 2.8Å; L647-T650 WeakPolarHBondContact O-CA 3.31Å; L647-T650 VanDerWaalsContact O-CB 3.24Å; L647-T650 WeakPolarHBondContact O-CB 3.43Å; L647-T650 PolarHBondContact O-N 3.11Å; L647-L651 HydrophobicContact CD1-CD1 4.31Å; L647-L651 HydrophobicContact CD1-CD2 4.03Å; L647-L651 HydrophobicContact CD1-CG 4.03Å; L647-L651 HydrophobicContact CD2-CD1 4.39Å; L647-L651 HydrophobicContact CG-CD1 3.96Å; L647-L651 HydrophobicContact CG-CG 4.1Å; L647-L651 PolarHBondContact O-N 2.88Å; L647-L651 VanDerWaalsContact O-N 3.1Å; L647-I673 HydrophobicContact CD2-CG2 3.95Å; L647-V677 HydrophobicContact CD2-CG2 4.04Å
648	I	96.9	Very high	95.1	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.2	-41.8	-171.6	-57.7	-58.4	0	0	0	113.1	Q644 T650 L651 I652 L674 V677 L688 L689 A693	Q644-I648 HydrophobicContact CB-CG1 4Å; Q644-I648 HydrophobicContact CG-CG1 4.28Å; Q644-I648 VanDerWaalsContact O-CB 3.28Å; Q644-I648 WeakPolarHBondContact O-CB 3.42Å; Q644-I648 VanDerWaalsContact O-CG1 3.26Å; Q644-I648 WeakPolarHBondContact O-CG1 3.38Å; Q644-I648 PolarHBondContact O-N 3.21Å; Q644-I648 VanDerWaalsContact O-N 3.08Å; I648-T650 PolarHBondContact O-N 2.95Å; I648-L651 HydrophobicContact CD1-CD1 4.22Å; I648-L651 PolarHBondContact O-N 2.73Å; I648-I652 HydrophobicContact CG2-CD1 3.72Å; I648-I652 HydrophobicContact CG2-CG1 4.21Å; I648-I652 WeakPolarHBondContact O-CB 3.35Å; I648-I652 WeakPolarHBondContact O-CG1 3.39Å; I648-I652 PolarHBondContact O-N 3.06Å; I648-L674 HydrophobicContact CD1-CD1 3.73Å; I648-V677 HydrophobicContact CD1-CG1 4.42Å; I648-L688 HydrophobicContact CB-CD2 3.9Å; I648-L688 HydrophobicContact CB-CG 4.05Å; I648-L688 HydrophobicContact CG1-CD2 4.28Å; I648-L688 HydrophobicContact CG2-CD1 4.28Å; I648-L688 HydrophobicContact CG2-CD2 4.28Å; I648-L688 HydrophobicContact CG2-CG 3.86Å; I648-L689 HydrophobicContact CD1-CD2 3.56Å; I648-L689 HydrophobicContact CG1-CD2 3.97Å; I648-A693 HydrophobicContact CG2-CB 3.74Å
649	P	97.4	Very high	94.7	Very high	60 Å²	60	41.3 Å²	41.3	39%	0.39	24%	0.241	S	C	.	.	H	α-helix	trans	-58.7	-34	174.1	-25.5	36	0	0	0	113.5	S653	P649-S653 WeakPolarHBondContact O-CB 3.47Å; P649-S653 PolarHBondContact O-N 2.67Å
650	T	96.4	Very high	94.2	Very high	29 Å²	29	47.7 Å²	47.7	18%	0.178	28%	0.275	C	S	.	.	H	α-helix	trans	-68.1	-48.6	176.9	-55.9	0	0	0	0	110.7	I610 L614 R646 L647 I648 I652 S653 I654	I610-T650 HydrophobicContact CG2-CG2 4.13Å; L614-T650 HydrophobicContact CD1-CG2 3.86Å; L614-T650 HydrophobicContact CD2-CG2 3.91Å; L614-T650 HydrophobicContact CG-CG2 4.18Å; R646-T650 PolarHBondContact O-OG1 3.36Å; L647-T650 WeakPolarHBondContact O-CA 3.31Å; L647-T650 VanDerWaalsContact O-CB 3.24Å; L647-T650 WeakPolarHBondContact O-CB 3.43Å; L647-T650 PolarHBondContact O-N 3.11Å; I648-T650 PolarHBondContact O-N 2.95Å; T650-I652 VanDerWaalsContact C-N 3.33Å; T650-I652 PolarHBondContact O-N 3.38Å; T650-S653 WeakPolarHBondContact O-CB 3.37Å; T650-S653 PolarHBondContact O-N 2.8Å; T650-S653 VanDerWaalsContact O-N 3.14Å; T650-I654 HydrophobicContact CG2-CD1 4.34Å; T650-I654 WeakPolarHBondContact O-CG1 3.49Å; T650-I654 PolarHBondContact O-N 3.08Å
651	L	96.6	Very high	93.9	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.9	-42.5	177.7	-56.7	-178.7	0	0	0	111.5	L647 I648 S653 I654 M655 I673 L674	L647-L651 HydrophobicContact CD1-CD1 4.31Å; L647-L651 HydrophobicContact CD1-CD2 4.03Å; L647-L651 HydrophobicContact CD1-CG 4.03Å; L647-L651 HydrophobicContact CD2-CD1 4.39Å; L647-L651 HydrophobicContact CG-CD1 3.96Å; L647-L651 HydrophobicContact CG-CG 4.1Å; L647-L651 PolarHBondContact O-N 2.88Å; L647-L651 VanDerWaalsContact O-N 3.1Å; I648-L651 HydrophobicContact CD1-CD1 4.22Å; I648-L651 PolarHBondContact O-N 2.73Å; L651-S653 VanDerWaalsContact C-N 3.34Å; L651-S653 PolarHBondContact O-N 3.48Å; L651-I654 PolarHBondContact O-N 3.25Å; L651-M655 HydrophobicContact CB-CE 4.27Å; L651-M655 WeakPolarHBondContact O-CE 3.42Å; L651-M655 WeakPolarHBondContact O-CG 3.48Å; L651-M655 PolarHBondContact O-N 3.19Å; L651-I673 HydrophobicContact CD1-CB 4.43Å; L651-I673 HydrophobicContact CD1-CG2 3.95Å; L651-I673 HydrophobicContact CD2-CB 4.44Å; L651-I673 HydrophobicContact CD2-CG2 4.27Å; L651-L674 HydrophobicContact CD1-CB 4.06Å
652	I	97.2	Very high	93.6	Very high	15 Å²	15	54.4 Å²	54.4	8%	0.077	30%	0.295	C	S	.	.	H	α-helix	trans	-58.6	-45.9	174.1	-72.5	169.8	0	0	0	111	I648 T650 I654 M655 Q656 Q692 A693 V696	I648-I652 HydrophobicContact CG2-CD1 3.72Å; I648-I652 HydrophobicContact CG2-CG1 4.21Å; I648-I652 WeakPolarHBondContact O-CB 3.35Å; I648-I652 WeakPolarHBondContact O-CG1 3.39Å; I648-I652 PolarHBondContact O-N 3.06Å; T650-I652 VanDerWaalsContact C-N 3.33Å; T650-I652 PolarHBondContact O-N 3.38Å; I652-I654 VanDerWaalsContact C-N 3.27Å; I652-I654 PolarHBondContact O-N 3.13Å; I652-M655 HydrophobicContact CG1-CE 4.38Å; I652-M655 PolarHBondContact O-N 2.87Å; I652-Q656 HydrophobicContact CG2-CG 4.34Å; I652-Q656 WeakPolarHBondContact O-CB 3.39Å; I652-Q656 WeakPolarHBondContact O-CG 3.34Å; I652-Q656 PolarHBondContact O-N 3.34Å; I652-Q692 HydrophobicContact CD1-CB 3.65Å; I652-A693 HydrophobicContact CD1-CB 4.36Å; I652-A693 HydrophobicContact CG1-CB 4.49Å; I652-V696 HydrophobicContact CG1-CB 4.5Å; I652-V696 HydrophobicContact CG2-CG1 4.31Å; I652-V696 HydrophobicContact CG2-CG2 4.05Å
653	S	96	Very high	93.2	Very high	76 Å²	76	53.1 Å²	53.1	53%	0.531	29%	0.287	S	S	.	.	H	α-helix	trans	-60.7	-36.7	178.6	-176.1	0	0	0	0	112.3	P649 T650 L651 A657	P649-S653 WeakPolarHBondContact O-CB 3.47Å; P649-S653 PolarHBondContact O-N 2.67Å; T650-S653 WeakPolarHBondContact O-CB 3.37Å; T650-S653 PolarHBondContact O-N 2.8Å; T650-S653 VanDerWaalsContact O-N 3.14Å; L651-S653 VanDerWaalsContact C-N 3.34Å; L651-S653 PolarHBondContact O-N 3.48Å; S653-A657 PolarHBondContact O-N 3.49Å
654	I	94.6	Very high	92.6	Very high	11 Å²	11	58.6 Å²	58.6	6%	0.056	33%	0.325	C	S	.	.	H	α-helix	trans	-69.1	-49.1	177.5	-65.7	166.9	0	0	0	110.1	F613 L614 T650 L651 I652 Q656 A657 I662 L666 C667 S670	F613-I654 HydrophobicContact CE1-CD1 3.68Å; F613-I654 HydrophobicContact CZ-CD1 4.32Å; L614-I654 HydrophobicContact CD2-CD1 3.96Å; T650-I654 HydrophobicContact CG2-CD1 4.34Å; T650-I654 WeakPolarHBondContact O-CG1 3.49Å; T650-I654 PolarHBondContact O-N 3.08Å; L651-I654 PolarHBondContact O-N 3.25Å; I652-I654 VanDerWaalsContact C-N 3.27Å; I652-I654 PolarHBondContact O-N 3.13Å; I654-Q656 PolarHBondContact O-N 3Å; I654-A657 WeakPolarHBondContact O-CB 3.39Å; I654-A657 PolarHBondContact O-N 3.15Å; I654-I662 HydrophobicContact CG2-CD1 4.32Å; I654-L666 HydrophobicContact CD1-CD1 4.42Å; I654-L666 HydrophobicContact CD1-CD2 4.36Å; I654-L666 HydrophobicContact CD1-CG 4.32Å; I654-L666 HydrophobicContact CG1-CD2 4.46Å; I654-L666 HydrophobicContact CG2-CD2 4.19Å; I654-L666 HydrophobicContact CG2-CG 3.98Å; I654-C667 HydrophobicContact CG2-CB 4.35Å; I654-S670 VanDerWaalsContact CD1-OG 3.28Å; I654-S670 WeakPolarHBondContact CD1-OG 3.38Å; I654-S670 WeakPolarHBondContact CG2-OG 3.34Å
655	M	95.8	Very high	92.2	Very high	13 Å²	13	59.9 Å²	59.9	6%	0.064	34%	0.341	C	S	.	.	H	α-helix	trans	-64.5	-24.7	-179.2	-71.1	-175.5	-77.1	0	0	113.9	L651 I652 I671 L674 V696 V697 C700	L651-M655 HydrophobicContact CB-CE 4.27Å; L651-M655 WeakPolarHBondContact O-CE 3.42Å; L651-M655 WeakPolarHBondContact O-CG 3.48Å; L651-M655 PolarHBondContact O-N 3.19Å; I652-M655 HydrophobicContact CG1-CE 4.38Å; I652-M655 PolarHBondContact O-N 2.87Å; M655-I671 HydrophobicContact CG-CG1 4.1Å; M655-I671 HydrophobicContact SD-CG1 3.73Å; M655-L674 HydrophobicContact CE-CD2 3.99Å; M655-V696 HydrophobicContact CB-CG1 3.59Å; M655-V696 HydrophobicContact CE-CG1 3.92Å; M655-V696 HydrophobicContact SD-CG1 4.24Å; M655-V697 HydrophobicContact SD-CB 3.82Å; M655-V697 HydrophobicContact SD-CG2 4.2Å; M655-C700 HydrophobicContact CB-CB 4.26Å
656	Q	95.3	Very high	91.9	Very high	131 Å²	131	54.2 Å²	54.2	61%	0.612	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-11.7	175.5	-69.5	-179	-13.6	0	0	113.5	I652 I654 V696	I652-Q656 HydrophobicContact CG2-CG 4.34Å; I652-Q656 WeakPolarHBondContact O-CB 3.39Å; I652-Q656 WeakPolarHBondContact O-CG 3.34Å; I652-Q656 PolarHBondContact O-N 3.34Å; I654-Q656 PolarHBondContact O-N 3Å; Q656-V696 HydrophobicContact CG-CG1 3.85Å; Q656-V696 HydrophobicContact CG-CG2 4.38Å; Q656-V696 VanDerWaalsContact NE2-CG2 3.34Å
657	A	93.2	Very high	91.8	Very high	28 Å²	28	50.3 Å²	50.3	23%	0.231	30%	0.299	C	S	.	.	S	Bend	trans	-68.6	147.4	-179.4	0	0	0	0	0	110.7	S653 I654 I662	S653-A657 PolarHBondContact O-N 3.49Å; I654-A657 WeakPolarHBondContact O-CB 3.39Å; I654-A657 PolarHBondContact O-N 3.15Å; A657-I662 HydrophobicContact CB-CG2 3.57Å
658	P	89.9	Confident	91.5	Very high	59 Å²	59	50.5 Å²	50.5	38%	0.383	30%	0.3	S	S	.	.			trans	-59.8	132.2	173.2	-23.8	35.3	0	0	0	110.8	D660 K661	P658-D660 WeakPolarHBondContact CB-OD1 3.44Å; P658-D660 PolarHBondContact O-N 3.21Å; P658-D660 VanDerWaalsContact O-N 3.13Å; P658-K661 HydrophobicContact CB-CB 4.41Å; P658-K661 HydrophobicContact CB-CD 4.21Å; P658-K661 HydrophobicContact CB-CG 4.15Å; P658-K661 HydrophobicContact CG-CD 4.05Å; P658-K661 PolarHBondContact O-N 2.67Å
659	P	84.3	Confident	91.3	Very high	103 Å²	103	51.9 Å²	51.9	67%	0.669	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-57.1	-29.8	-177.1	-26.1	33.6	0	0	0	113.9	K661	P659-K661 PolarHBondContact O-N 3.5Å
660	D	85.1	Confident	91.2	Very high	134 Å²	134	49 Å²	49	72%	0.717	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-72.5	-9.3	177.6	59.7	-54.8	0	0	0	114.1	P658	P658-D660 WeakPolarHBondContact CB-OD1 3.44Å; P658-D660 PolarHBondContact O-N 3.21Å; P658-D660 VanDerWaalsContact O-N 3.13Å
661	K	86.4	Confident	91.2	Very high	158 Å²	158	47.7 Å²	47.7	69%	0.687	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-113.3	-5.5	-174.8	-64.8	-170.2	-178	-179.6	0	114.4	P658 P659	P658-K661 HydrophobicContact CB-CB 4.41Å; P658-K661 HydrophobicContact CB-CD 4.21Å; P658-K661 HydrophobicContact CB-CG 4.15Å; P658-K661 HydrophobicContact CG-CD 4.05Å; P658-K661 PolarHBondContact O-N 2.67Å; P659-K661 PolarHBondContact O-N 3.5Å
662	I	87.2	Confident	91	Very high	39 Å²	39	49.8 Å²	49.8	20%	0.2	29%	0.293	C	S	.	.	S	Bend	trans	-116.4	151.7	177.1	58.5	173.7	0	0	0	109.5	I654 A657 C667	I654-I662 HydrophobicContact CG2-CD1 4.32Å; A657-I662 HydrophobicContact CB-CG2 3.57Å; I662-C667 HydrophobicContact CD1-CB 3.82Å
663	P	85.4	Confident	90.9	Very high	30 Å²	30	49.1 Å²	49.1	20%	0.195	29%	0.29	C	S	.	.			trans	-53.5	147.5	170.5	-24.5	32	0	0	0	112.7	N617 N618 L666	N617-P663 HydrophobicContact CB-CG 4.14Å; N617-P663 WeakPolarHBondContact OD1-CG 3.47Å; N618-P663 WeakPolarHBondContact OD1-CB 3.44Å; N618-P663 VanDerWaalsContact OD1-CG 3.26Å; N618-P663 WeakPolarHBondContact OD1-CG 3.37Å; P663-L666 HydrophobicContact CB-CB 4.28Å; P663-L666 HydrophobicContact CG-CD2 4.4Å; P663-L666 PolarHBondContact O-N 3.12Å
664	S	84.6	Confident	90.9	Very high	115 Å²	115	45.5 Å²	45.5	80%	0.804	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	139.9	167.3	-168.8	0	0	0	0	109.7	L666	S664-L666 VanDerWaalsContact C-N 3.27Å; S664-L666 PolarHBondContact O-N 3.07Å
665	G	85.4	Confident	91	Very high	36 Å²	36	45.6 Å²	45.6	37%	0.371	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.7	-31.6	179.3	0	0	0	0	0	115.4	C667 A668 T669	G665-C667 VanDerWaalsContact C-N 3.28Å; G665-C667 PolarHBondContact O-N 2.8Å; G665-C667 VanDerWaalsContact O-N 3.15Å; G665-A668 WeakPolarHBondContact O-CA 3.36Å; G665-A668 WeakPolarHBondContact O-CB 3.46Å; G665-A668 PolarHBondContact O-N 2.91Å; G665-T669 PolarHBondContact O-N 2.6Å; G665-T669 PolarHBondContact O-OG1 2.72Å
666	L	89.4	Confident	90.8	Very high	12 Å²	12	46.2 Å²	46.2	6%	0.063	27%	0.272	C	S	.	.	H	α-helix	trans	-56.3	-40.3	-175.4	-178.4	64.2	0	0	0	113.3	F613 N617 I654 P663 S664 S670	F613-L666 HydrophobicContact CE1-CD1 4Å; F613-L666 HydrophobicContact CE2-CD1 3.75Å; F613-L666 HydrophobicContact CZ-CD1 3.4Å; F613-L666 VanDerWaalsContact CZ-CD1 3.4Å; N617-L666 HydrophobicContact CB-CD1 3.85Å; N617-L666 HydrophobicContact CB-CD2 3.97Å; N617-L666 HydrophobicContact CB-CG 4.43Å; I654-L666 HydrophobicContact CD1-CD1 4.42Å; I654-L666 HydrophobicContact CD1-CD2 4.36Å; I654-L666 HydrophobicContact CD1-CG 4.32Å; I654-L666 HydrophobicContact CG1-CD2 4.46Å; I654-L666 HydrophobicContact CG2-CD2 4.19Å; I654-L666 HydrophobicContact CG2-CG 3.98Å; P663-L666 HydrophobicContact CB-CB 4.28Å; P663-L666 HydrophobicContact CG-CD2 4.4Å; P663-L666 PolarHBondContact O-N 3.12Å; S664-L666 VanDerWaalsContact C-N 3.27Å; S664-L666 PolarHBondContact O-N 3.07Å; L666-S670 WeakPolarHBondContact O-CB 3.27Å; L666-S670 PolarHBondContact O-N 3.02Å; L666-S670 PolarHBondContact O-OG 3.33Å
667	C	93.3	Very high	90.7	Very high	7 Å²	7	40 Å²	40	5%	0.047	24%	0.242	C	C	.	.	H	α-helix	trans	-68	-40.6	177	-171.4	0	0	0	0	112.1	I654 I662 G665 S670 I671 I709	I654-C667 HydrophobicContact CG2-CB 4.35Å; I662-C667 HydrophobicContact CD1-CB 3.82Å; G665-C667 VanDerWaalsContact C-N 3.28Å; G665-C667 PolarHBondContact O-N 2.8Å; G665-C667 VanDerWaalsContact O-N 3.15Å; C667-S670 WeakPolarHBondContact O-CB 3.3Å; C667-S670 PolarHBondContact O-N 3.41Å; C667-I671 WeakPolarHBondContact O-CG1 3.14Å; C667-I671 PolarHBondContact O-N 3.47Å; C667-I671 VanDerWaalsContact O-N 3.11Å; C667-I709 HydrophobicContact CB-CD1 3.72Å; C667-I709 HydrophobicContact CB-CG1 4.27Å
668	A	92.1	Very high	90.8	Very high	4 Å²	4	38.6 Å²	38.6	3%	0.033	23%	0.231	C	C	.	.	H	α-helix	trans	-62.7	-49.7	177.8	0	0	0	0	0	110.7	G665 S670 I671 D672 T708 I709 N712	G665-A668 WeakPolarHBondContact O-CA 3.36Å; G665-A668 WeakPolarHBondContact O-CB 3.46Å; G665-A668 PolarHBondContact O-N 2.91Å; A668-S670 VanDerWaalsContact C-N 3.27Å; A668-S670 PolarHBondContact O-N 2.86Å; A668-I671 WeakPolarHBondContact O-CB 3.4Å; A668-I671 PolarHBondContact O-N 3.38Å; A668-D672 PolarHBondContact O-N 3.39Å; A668-T708 HydrophobicContact CB-CG2 3.77Å; A668-I709 HydrophobicContact CB-CG1 4.1Å; A668-N712 PolarHBondContact O-ND2 3.14Å
669	T	91.4	Very high	90.9	Very high	30 Å²	30	38.2 Å²	38.2	18%	0.184	22%	0.222	C	C	.	.	H	α-helix	trans	-59.5	-37.6	175.1	-49.1	0	0	0	0	112.2	F613 A623 G665 I671 D672 I673	F613-T669 HydrophobicContact CE2-CG2 4.06Å; A623-T669 HydrophobicContact CB-CG2 4.01Å; G665-T669 PolarHBondContact O-N 2.6Å; G665-T669 PolarHBondContact O-OG1 2.72Å; T669-I671 VanDerWaalsContact C-N 3.26Å; T669-I671 PolarHBondContact O-N 2.77Å; T669-D672 PolarHBondContact O-N 3.47Å; T669-I673 HydrophobicContact CG2-CD1 4.13Å; T669-I673 HydrophobicContact CG2-CG1 4.49Å; T669-I673 VanDerWaalsContact O-CG1 3.3Å; T669-I673 WeakPolarHBondContact O-CG1 3.41Å; T669-I673 PolarHBondContact O-N 2.86Å
670	S	94.9	Very high	91.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.3	-32.9	176.7	-62.9	0	0	0	0	112.8	I654 L666 C667 A668 L674	I654-S670 VanDerWaalsContact CD1-OG 3.28Å; I654-S670 WeakPolarHBondContact CD1-OG 3.38Å; I654-S670 WeakPolarHBondContact CG2-OG 3.34Å; L666-S670 WeakPolarHBondContact O-CB 3.27Å; L666-S670 PolarHBondContact O-N 3.02Å; L666-S670 PolarHBondContact O-OG 3.33Å; C667-S670 WeakPolarHBondContact O-CB 3.3Å; C667-S670 PolarHBondContact O-N 3.41Å; A668-S670 VanDerWaalsContact C-N 3.27Å; A668-S670 PolarHBondContact O-N 2.86Å; S670-L674 PolarHBondContact O-N 3.26Å; S670-L674 VanDerWaalsContact O-N 3.12Å
671	I	96.6	Very high	91.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-73	-39	175.5	-67.4	168.2	0	0	0	110.5	M655 C667 A668 T669 L674 A675 V697 I709 N712 C716	M655-I671 HydrophobicContact CG-CG1 4.1Å; M655-I671 HydrophobicContact SD-CG1 3.73Å; C667-I671 WeakPolarHBondContact O-CG1 3.14Å; C667-I671 PolarHBondContact O-N 3.47Å; C667-I671 VanDerWaalsContact O-N 3.11Å; A668-I671 WeakPolarHBondContact O-CB 3.4Å; A668-I671 PolarHBondContact O-N 3.38Å; T669-I671 VanDerWaalsContact C-N 3.26Å; T669-I671 PolarHBondContact O-N 2.77Å; I671-L674 WeakPolarHBondContact O-CB 3.16Å; I671-L674 PolarHBondContact O-N 2.62Å; I671-A675 PolarHBondContact O-N 2.66Å; I671-V697 HydrophobicContact CD1-CG2 4.36Å; I671-V697 HydrophobicContact CG1-CG2 4.09Å; I671-V697 HydrophobicContact CG2-CG2 3.85Å; I671-I709 HydrophobicContact CD1-CG2 3.67Å; I671-N712 HydrophobicContact CB-CB 4.26Å; I671-N712 HydrophobicContact CG2-CB 3.92Å; I671-N712 VanDerWaalsContact CG2-O 3.28Å; I671-N712 WeakPolarHBondContact CG2-O 3.26Å; I671-C716 HydrophobicContact CG2-CB 3.65Å
672	D	93.1	Very high	91.2	Very high	44 Å²	44	28.2 Å²	28.2	24%	0.235	17%	0.165	C	C	.	.	H	α-helix	trans	-64	-46.6	175.1	-65.6	-27.7	0	0	0	111.4	A668 T669 L674 A675 T676 N712	A668-D672 PolarHBondContact O-N 3.39Å; T669-D672 PolarHBondContact O-N 3.47Å; D672-L674 PolarHBondContact O-N 2.78Å; D672-A675 CarbonylContact O-C 3.28Å; D672-A675 WeakPolarHBondContact O-CA 3.29Å; D672-A675 WeakPolarHBondContact O-CB 3.49Å; D672-A675 PolarHBondContact O-N 3.39Å; D672-T676 PolarHBondContact O-N 2.84Å; D672-T676 PolarHBondContact O-OG1 3.4Å; D672-T676 VanDerWaalsContact O-OG1 3.07Å; D672-N712 VanDerWaalsContact OD1-CB 3.23Å; D672-N712 WeakPolarHBondContact OD1-CB 3.24Å; D672-N712 PolarHBondContact OD1-ND2 3.2Å; D672-N712 PolarHBondContact OD2-ND2 2.87Å
673	I	93.9	Very high	91.2	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-55.4	-43.1	173.5	-66.8	166.1	0	0	0	110.2	F613 Q627 F630 L647 L651 T669 T676 V677	F613-I673 HydrophobicContact CD2-CD1 4.4Å; F613-I673 HydrophobicContact CE1-CD1 4.38Å; F613-I673 HydrophobicContact CE2-CD1 3.93Å; F613-I673 HydrophobicContact CZ-CD1 3.9Å; Q627-I673 HydrophobicContact CB-CD1 4.39Å; Q627-I673 HydrophobicContact CB-CG1 3.81Å; Q627-I673 HydrophobicContact CG-CG1 3.86Å; F630-I673 HydrophobicContact CB-CG2 4.22Å; F630-I673 HydrophobicContact CD2-CD1 4.09Å; F630-I673 HydrophobicContact CD2-CG1 4.35Å; F630-I673 HydrophobicContact CD2-CG2 3.72Å; F630-I673 HydrophobicContact CE2-CD1 4.24Å; F630-I673 HydrophobicContact CE2-CG2 4.44Å; F630-I673 HydrophobicContact CG-CG2 4.21Å; L647-I673 HydrophobicContact CD2-CG2 3.95Å; L651-I673 HydrophobicContact CD1-CB 4.43Å; L651-I673 HydrophobicContact CD1-CG2 3.95Å; L651-I673 HydrophobicContact CD2-CB 4.44Å; L651-I673 HydrophobicContact CD2-CG2 4.27Å; T669-I673 HydrophobicContact CG2-CD1 4.13Å; T669-I673 HydrophobicContact CG2-CG1 4.49Å; T669-I673 VanDerWaalsContact O-CG1 3.3Å; T669-I673 WeakPolarHBondContact O-CG1 3.41Å; T669-I673 PolarHBondContact O-N 2.86Å; I673-T676 PolarHBondContact O-N 2.85Å; I673-V677 VanDerWaalsContact O-CG2 3.27Å; I673-V677 WeakPolarHBondContact O-CG2 3.37Å; I673-V677 PolarHBondContact O-N 2.83Å
674	L	96.9	Very high	91.5	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.7	-44.5	175.5	179.8	62.5	0	0	0	111.7	I648 L651 M655 S670 I671 D672 V677 V678 L689 A693 V697 Y720	I648-L674 HydrophobicContact CD1-CD1 3.73Å; L651-L674 HydrophobicContact CD1-CB 4.06Å; M655-L674 HydrophobicContact CE-CD2 3.99Å; S670-L674 PolarHBondContact O-N 3.26Å; S670-L674 VanDerWaalsContact O-N 3.12Å; I671-L674 WeakPolarHBondContact O-CB 3.16Å; I671-L674 PolarHBondContact O-N 2.62Å; D672-L674 PolarHBondContact O-N 2.78Å; L674-V677 PolarHBondContact O-N 3.3Å; L674-V678 HydrophobicContact CD1-CG2 4.33Å; L674-V678 VanDerWaalsContact O-CG2 3.28Å; L674-V678 WeakPolarHBondContact O-CG2 3.12Å; L674-V678 PolarHBondContact O-N 2.91Å; L674-L689 HydrophobicContact CD1-CD2 3.82Å; L674-A693 HydrophobicContact CD1-CB 3.97Å; L674-A693 HydrophobicContact CD2-CB 4.11Å; L674-V697 HydrophobicContact CD2-CB 4.08Å; L674-V697 HydrophobicContact CD2-CG1 4.16Å; L674-Y720 HydrophobicContact CD2-CE2 4.45Å
675	A	95.7	Very high	92	Very high	13 Å²	13	28.6 Å²	28.6	11%	0.107	17%	0.167	C	C	.	.	H	α-helix	trans	-59.7	-46.2	177	0	0	0	0	0	111.1	I671 D672 V677 V678 R679 C716	I671-A675 PolarHBondContact O-N 2.66Å; D672-A675 CarbonylContact O-C 3.28Å; D672-A675 WeakPolarHBondContact O-CA 3.29Å; D672-A675 WeakPolarHBondContact O-CB 3.49Å; D672-A675 PolarHBondContact O-N 3.39Å; A675-V677 PolarHBondContact O-N 3.04Å; A675-V678 PolarHBondContact O-N 2.83Å; A675-R679 WeakPolarHBondContact O-CB 3.45Å; A675-R679 VanDerWaalsContact O-CG 3.31Å; A675-R679 WeakPolarHBondContact O-CG 3.38Å; A675-R679 PolarHBondContact O-N 3.29Å; A675-C716 HydrophobicContact CB-CB 3.92Å
676	T	92	Very high	92.4	Very high	26 Å²	26	28.8 Å²	28.8	16%	0.16	16%	0.163	C	C	.	.	H	α-helix	trans	-58.6	-45.6	174.9	-57	0	0	0	0	111.4	K631 D672 I673 V678 R679 N680	K631-T676 HydrophobicContact CB-CG2 3.67Å; K631-T676 HydrophobicContact CG-CG2 3.85Å; D672-T676 PolarHBondContact O-N 2.84Å; D672-T676 PolarHBondContact O-OG1 3.4Å; D672-T676 VanDerWaalsContact O-OG1 3.07Å; I673-T676 PolarHBondContact O-N 2.85Å; T676-V678 PolarHBondContact O-N 3.1Å; T676-R679 PolarHBondContact O-N 3.35Å; T676-N680 WeakPolarHBondContact O-CB 3.26Å; T676-N680 PolarHBondContact O-N 3.39Å; T676-N680 VanDerWaalsContact O-N 3.1Å; T676-N680 PolarHBondContact O-ND2 3.3Å
677	V	93.3	Very high	92.5	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.6	-43.8	176.7	170.7	0	0	0	0	111.1	A634 M643 Q644 L647 I648 I673 L674 A675 N680 T681 L689	A634-V677 HydrophobicContact CB-CG2 4.43Å; M643-V677 HydrophobicContact CE-CG1 4.2Å; M643-V677 HydrophobicContact CE-CG2 4.11Å; Q644-V677 HydrophobicContact CG-CG1 4.2Å; L647-V677 HydrophobicContact CD2-CG2 4.04Å; I648-V677 HydrophobicContact CD1-CG1 4.42Å; I673-V677 VanDerWaalsContact O-CG2 3.27Å; I673-V677 WeakPolarHBondContact O-CG2 3.37Å; I673-V677 PolarHBondContact O-N 2.83Å; L674-V677 PolarHBondContact O-N 3.3Å; A675-V677 PolarHBondContact O-N 3.04Å; V677-N680 PolarHBondContact O-N 2.91Å; V677-T681 WeakPolarHBondContact O-CB 3.18Å; V677-T681 PolarHBondContact O-N 3.07Å; V677-T681 PolarHBondContact O-OG1 2.75Å; V677-L689 HydrophobicContact CG1-CD2 4.48Å
678	V	95.3	Very high	92.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63.9	-46	178.6	171.6	0	0	0	0	111.1	L674 A675 T676 N680 T681 L685 L689 A719 Y720 V723	L674-V678 HydrophobicContact CD1-CG2 4.33Å; L674-V678 VanDerWaalsContact O-CG2 3.28Å; L674-V678 WeakPolarHBondContact O-CG2 3.12Å; L674-V678 PolarHBondContact O-N 2.91Å; A675-V678 PolarHBondContact O-N 2.83Å; T676-V678 PolarHBondContact O-N 3.1Å; V678-N680 VanDerWaalsContact C-N 3.26Å; V678-N680 PolarHBondContact O-N 3.37Å; V678-T681 PolarHBondContact O-N 2.66Å; V678-L685 HydrophobicContact CG1-CD1 4.17Å; V678-L689 HydrophobicContact CG2-CD2 4.37Å; V678-A719 HydrophobicContact CB-CB 4.36Å; V678-A719 HydrophobicContact CG1-CB 3.97Å; V678-Y720 HydrophobicContact CG1-CD1 4.08Å; V678-Y720 HydrophobicContact CG1-CD2 4.4Å; V678-Y720 HydrophobicContact CG1-CE1 4.37Å; V678-Y720 HydrophobicContact CG1-CG 4.11Å; V678-Y720 HydrophobicContact CG2-CD1 4.28Å; V678-Y720 HydrophobicContact CG2-CD2 4.22Å; V678-Y720 HydrophobicContact CG2-CE1 3.78Å; V678-Y720 HydrophobicContact CG2-CE2 3.69Å; V678-Y720 HydrophobicContact CG2-CG 4.5Å; V678-Y720 VanDerWaalsContact CG2-CZ 3.45Å; V678-V723 HydrophobicContact CG1-CB 4.44Å; V678-V723 HydrophobicContact CG1-CG2 4.45Å
679	R	92.6	Very high	92.8	Very high	50 Å²	50	35 Å²	35	19%	0.189	19%	0.191	C	C	.	.	H	α-helix	trans	-59.2	-36.3	178.7	-74.6	-65.9	-172	178.5	-0.2	112.9	A675 T676 A719 S722 D994	A675-R679 WeakPolarHBondContact O-CB 3.45Å; A675-R679 VanDerWaalsContact O-CG 3.31Å; A675-R679 WeakPolarHBondContact O-CG 3.38Å; A675-R679 PolarHBondContact O-N 3.29Å; T676-R679 PolarHBondContact O-N 3.35Å; R679-A719 HydrophobicContact CG-CB 3.8Å; R679-S722 PolarHBondContact NH1-OG 3.35Å; R679-D994 IonicContact CZ-OD1 2.83Å; R679-D994 IonicContact CZ-OD2 3.66Å; R679-D994 IonicContact NH1-OD1 2.65Å; R679-D994 PolarHBondContact NH1-OD1 2.97Å; R679-D994 IonicContact NH1-OD2 3.45Å; R679-D994 PolarHBondContact NH1-OD2 3.06Å; R679-D994 IonicContact NH2-OD2 2.8Å; R679-D994 PolarHBondContact NH2-OD2 3.22Å
680	N	89.6	Confident	93	Very high	47 Å²	47	33.9 Å²	33.9	25%	0.251	18%	0.183	S	C	.	.	H	α-helix	trans	-95.8	-4.8	-176.1	-68.8	-77.6	0	0	0	113.8	A634 Q635 Q640 T676 V677 V678	A634-N680 HydrophobicContact CB-CB 3.72Å; Q635-N680 HydrophobicContact CG-CB 4.1Å; Q635-N680 VanDerWaalsContact CG-OD1 3.25Å; Q635-N680 WeakPolarHBondContact CG-OD1 3.45Å; Q640-N680 PolarHBondContact NE2-O 2.91Å; T676-N680 WeakPolarHBondContact O-CB 3.26Å; T676-N680 PolarHBondContact O-N 3.39Å; T676-N680 VanDerWaalsContact O-N 3.1Å; T676-N680 PolarHBondContact O-ND2 3.3Å; V677-N680 PolarHBondContact O-N 2.91Å; V678-N680 VanDerWaalsContact C-N 3.26Å; V678-N680 PolarHBondContact O-N 3.37Å
681	T	89.4	Confident	93	Very high	8 Å²	8	36.7 Å²	36.7	5%	0.049	20%	0.202	C	C	.	.	S	Bend	trans	-89.7	128.6	175.3	-60.4	0	0	0	0	110.6	Q644 V677 V678 L685 L689	Q644-T681 PolarHBondContact NE2-OG1 3.02Å; Q644-T681 VanDerWaalsContact NE2-OG1 3.11Å; V677-T681 WeakPolarHBondContact O-CB 3.18Å; V677-T681 PolarHBondContact O-N 3.07Å; V677-T681 PolarHBondContact O-OG1 2.75Å; V678-T681 PolarHBondContact O-N 2.66Å; T681-L685 HydrophobicContact CG2-CD2 3.73Å; T681-L689 HydrophobicContact CG2-CD1 4.39Å
682	K	83.9	Confident	93	Very high	131 Å²	131	41.8 Å²	41.8	57%	0.57	23%	0.226	S	C	*	.	P	Polyproline II helix	trans	-70.8	136.1	176.5	-66.2	179.2	-173.2	166.8	0	110.5	E637	E637-K682 IonicContact OE2-NZ 2.79Å; E637-K682 PolarHBondContact OE2-NZ 3.21Å
683	P	87.1	Confident	93.2	Very high	79 Å²	79	39.7 Å²	39.7	51%	0.513	22%	0.215	S	C	.	.	S	Bend	trans	-70.1	151.8	174.3	29.2	-33.9	0	0	0	111.5	V723	P683-V723 HydrophobicContact CB-CG1 4.38Å; P683-V723 HydrophobicContact CG-CG1 4.39Å
684	P	91.6	Very high	93.4	Very high	108 Å²	108	39.7 Å²	39.7	70%	0.701	22%	0.215	S	C	*	.	S	Bend	cis	-73.6	139.6	0.7	30.8	-34.6	0	0	0	112.4
685	L	94	Very high	93.4	Very high	5 Å²	5	40.8 Å²	40.8	3%	0.026	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-66.5	151	175	-58.8	-179	0	0	0	110.4	V678 T681 L689 V690 Y720 V723 A724 Q727	V678-L685 HydrophobicContact CG1-CD1 4.17Å; T681-L685 HydrophobicContact CG2-CD2 3.73Å; L685-L689 HydrophobicContact CB-CB 4.28Å; L685-L689 HydrophobicContact CB-CD1 4.31Å; L685-L689 HydrophobicContact CD2-CD1 4.2Å; L685-V690 HydrophobicContact CB-CG2 3.8Å; L685-Y720 HydrophobicContact CD1-CD1 3.68Å; L685-Y720 HydrophobicContact CD1-CE1 3.79Å; L685-V723 HydrophobicContact CD2-CG1 4.1Å; L685-A724 HydrophobicContact CD1-CB 3.6Å; L685-A724 HydrophobicContact CG-CB 3.73Å; L685-Q727 PolarHBondContact O-NE2 3.09Å
686	S	93.6	Very high	93.5	Very high	40 Å²	40	41 Å²	41	28%	0.28	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-65.5	153.4	178.4	65.6	0	0	0	0	112.1	Q644 L688 L689 V690	Q644-S686 PolarHBondContact OE1-OG 3.14Å; S686-L688 PolarHBondContact O-N 3.29Å; S686-L688 VanDerWaalsContact O-N 3.11Å; S686-L689 PolarHBondContact O-N 2.89Å; S686-L689 PolarHBondContact OG-N 2.7Å; S686-V690 PolarHBondContact O-N 2.8Å
687	E	92.9	Very high	93.7	Very high	134 Å²	134	39.8 Å²	39.8	63%	0.626	21%	0.214	S	C	*	.	H	α-helix	trans	-55.7	-28.4	173	-70.2	-64.6	151.6	0	0	112.3	C691	E687-C691 WeakPolarHBondContact O-CA 3.24Å; E687-C691 VanDerWaalsContact O-CB 3.25Å; E687-C691 WeakPolarHBondContact O-CB 3.39Å; E687-C691 PolarHBondContact O-N 3.24Å; E687-C691 PolarHBondContact OE2-SG 3.45Å
688	L	94.8	Very high	93.9	Very high	20 Å²	20	39.8 Å²	39.8	11%	0.105	21%	0.214	C	C	.	.	I	π-helix	trans	-64.5	-43.8	174.9	-175.3	60.9	0	0	0	111.5	Q644 M645 I648 S686 Q692 A693	Q644-L688 HydrophobicContact CB-CD2 4.46Å; Q644-L688 VanDerWaalsContact O-CD2 3.3Å; Q644-L688 WeakPolarHBondContact O-CD2 3.41Å; M645-L688 HydrophobicContact SD-CD2 3.97Å; I648-L688 HydrophobicContact CB-CD2 3.9Å; I648-L688 HydrophobicContact CB-CG 4.05Å; I648-L688 HydrophobicContact CG1-CD2 4.28Å; I648-L688 HydrophobicContact CG2-CD1 4.28Å; I648-L688 HydrophobicContact CG2-CD2 4.28Å; I648-L688 HydrophobicContact CG2-CG 3.86Å; S686-L688 PolarHBondContact O-N 3.29Å; S686-L688 VanDerWaalsContact O-N 3.11Å; L688-Q692 HydrophobicContact CD1-CB 4.24Å; L688-Q692 HydrophobicContact CD1-CG 4.21Å; L688-Q692 WeakPolarHBondContact O-CB 3.29Å; L688-Q692 PolarHBondContact O-N 2.93Å; L688-A693 PolarHBondContact O-N 3.49Å
689	L	96.2	Very high	94	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.227	C	C	.	.	I	π-helix	trans	-71	-39.3	177.1	-74.2	174.3	0	0	0	112.5	Q644 I648 L674 V677 V678 T681 L685 S686 A693 F694 Y720	Q644-L689 HydrophobicContact CG-CD1 4.46Å; I648-L689 HydrophobicContact CD1-CD2 3.56Å; I648-L689 HydrophobicContact CG1-CD2 3.97Å; L674-L689 HydrophobicContact CD1-CD2 3.82Å; V677-L689 HydrophobicContact CG1-CD2 4.48Å; V678-L689 HydrophobicContact CG2-CD2 4.37Å; T681-L689 HydrophobicContact CG2-CD1 4.39Å; L685-L689 HydrophobicContact CB-CB 4.28Å; L685-L689 HydrophobicContact CB-CD1 4.31Å; L685-L689 HydrophobicContact CD2-CD1 4.2Å; S686-L689 PolarHBondContact O-N 2.89Å; S686-L689 PolarHBondContact OG-N 2.7Å; L689-A693 HydrophobicContact CD2-CB 4.36Å; L689-F694 WeakPolarHBondContact O-CB 3.14Å; L689-F694 PolarHBondContact O-N 3.26Å; L689-Y720 HydrophobicContact CB-CE1 4.44Å; L689-Y720 PolarHBondContact O-OH 3.3Å
690	V	96.3	Very high	94.2	Very high	6 Å²	6	40.8 Å²	40.8	4%	0.036	22%	0.223	C	C	.	.	I	π-helix	trans	-85.1	-45	-174.3	179.7	0	0	0	0	112.6	L685 S686 P695 Q727 W731	L685-V690 HydrophobicContact CB-CG2 3.8Å; S686-V690 PolarHBondContact O-N 2.8Å; V690-P695 WeakPolarHBondContact O-CD 3.45Å; V690-Q727 HydrophobicContact CG1-CB 4.4Å; V690-Q727 HydrophobicContact CG2-CB 4.25Å; V690-W731 HydrophobicContact CG1-CB 4.19Å; V690-W731 HydrophobicContact CG1-CG 4.35Å
691	C	94.8	Very high	94.5	Very high	59 Å²	59	38.6 Å²	38.6	40%	0.399	21%	0.211	S	C	.	.	I	π-helix	trans	-93.4	-16.4	-173.8	-70.2	0	0	0	0	113.9	E687	E687-C691 WeakPolarHBondContact O-CA 3.24Å; E687-C691 VanDerWaalsContact O-CB 3.25Å; E687-C691 WeakPolarHBondContact O-CB 3.39Å; E687-C691 PolarHBondContact O-N 3.24Å; E687-C691 PolarHBondContact OE2-SG 3.45Å
692	Q	95.3	Very high	94.8	Very high	107 Å²	107	40.3 Å²	40.3	50%	0.5	22%	0.22	S	C	.	.	I	π-helix	trans	-117.4	-52	178.5	-52.4	-172.4	24.2	0	0	113.2	I652 L688 P695 V696	I652-Q692 HydrophobicContact CD1-CB 3.65Å; L688-Q692 HydrophobicContact CD1-CB 4.24Å; L688-Q692 HydrophobicContact CD1-CG 4.21Å; L688-Q692 WeakPolarHBondContact O-CB 3.29Å; L688-Q692 PolarHBondContact O-N 2.93Å; Q692-P695 WeakPolarHBondContact O-CD 3.42Å; Q692-V696 WeakPolarHBondContact O-CG2 3.39Å
693	A	97.3	Very high	95.3	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.226	C	C	.	.	I	π-helix	trans	-72.3	-50.3	-175.5	0	0	0	0	0	112.7	I648 I652 L674 L688 L689 V696 V697 Y720	I648-A693 HydrophobicContact CG2-CB 3.74Å; I652-A693 HydrophobicContact CD1-CB 4.36Å; I652-A693 HydrophobicContact CG1-CB 4.49Å; L674-A693 HydrophobicContact CD1-CB 3.97Å; L674-A693 HydrophobicContact CD2-CB 4.11Å; L688-A693 PolarHBondContact O-N 3.49Å; L689-A693 HydrophobicContact CD2-CB 4.36Å; A693-V696 PolarHBondContact O-N 3.25Å; A693-V696 VanDerWaalsContact O-N 3.1Å; A693-V697 PolarHBondContact O-N 3.02Å; A693-Y720 WeakPolarHBondContact CB-OH 3.42Å
694	F	98.1	Very high	95.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-54	-48.5	-179.4	171.3	-88.9	0	0	0	113.6	L689 V696 V697 A698 L717 Y720 I728 W731 V743	L689-F694 WeakPolarHBondContact O-CB 3.14Å; L689-F694 PolarHBondContact O-N 3.26Å; F694-V696 VanDerWaalsContact C-N 3.27Å; F694-V696 PolarHBondContact O-N 3.43Å; F694-V697 VanDerWaalsContact O-CG1 3.24Å; F694-V697 WeakPolarHBondContact O-CG1 3.42Å; F694-V697 PolarHBondContact O-N 2.85Å; F694-A698 WeakPolarHBondContact O-CB 3.42Å; F694-A698 PolarHBondContact O-N 2.77Å; F694-L717 HydrophobicContact CD2-CD2 3.82Å; F694-L717 HydrophobicContact CE2-CD2 3.4Å; F694-L717 HydrophobicContact CZ-CD2 4.12Å; F694-Y720 HydrophobicContact CB-CD1 4.44Å; F694-Y720 HydrophobicContact CB-CE1 3.99Å; F694-Y720 HydrophobicContact CB-CE2 4.26Å; F694-Y720 HydrophobicContact CD2-CD1 4.1Å; F694-Y720 AromaticContact CD2-CD2 3.86Å; F694-Y720 HydrophobicContact CD2-CD2 3.86Å; F694-Y720 HydrophobicContact CD2-CE1 4.44Å; F694-Y720 HydrophobicContact CD2-CE2 4.25Å; F694-Y720 AromaticContact CD2-CG 3.77Å; F694-Y720 HydrophobicContact CD2-CG 3.77Å; F694-Y720 HydrophobicContact CE2-CG 4.48Å; F694-I728 HydrophobicContact CB-CD1 4.48Å; F694-I728 HydrophobicContact CD1-CD1 4.33Å; F694-I728 HydrophobicContact CD2-CD1 3.58Å; F694-I728 HydrophobicContact CE1-CG2 4.48Å; F694-I728 HydrophobicContact CE2-CD1 3.79Å; F694-I728 HydrophobicContact CE2-CG1 4.37Å; F694-I728 HydrophobicContact CE2-CG2 3.89Å; F694-I728 HydrophobicContact CG-CD1 3.87Å; F694-I728 HydrophobicContact CZ-CD1 4.29Å; F694-I728 HydrophobicContact CZ-CG2 3.75Å; F694-W731 HydrophobicContact CD1-CE3 4.47Å; F694-W731 HydrophobicContact CE1-CE3 4.18Å; F694-W731 HydrophobicContact CE1-CZ3 4.28Å; F694-V743 HydrophobicContact CE2-CG2 4.37Å; F694-V743 HydrophobicContact CZ-CG2 4.29Å
695	P	97.2	Very high	95.6	Very high	23 Å²	23	41.9 Å²	41.9	15%	0.149	21%	0.211	C	C	.	.	H	α-helix	trans	-65.5	-32.4	179.5	-22.6	35.8	0	0	0	112.5	V690 Q692 Q699 W731	V690-P695 WeakPolarHBondContact O-CD 3.45Å; Q692-P695 WeakPolarHBondContact O-CD 3.42Å; P695-Q699 WeakPolarHBondContact O-CB 3.5Å; P695-Q699 WeakPolarHBondContact O-CG 3.35Å; P695-Q699 PolarHBondContact O-N 3.15Å; P695-W731 HydrophobicContact CB-CH2 4.07Å; P695-W731 HydrophobicContact CB-CZ2 3.91Å; P695-W731 HydrophobicContact CG-CH2 3.87Å; P695-W731 HydrophobicContact CG-CZ2 3.31Å
696	V	97.7	Very high	95.5	Very high	18 Å²	18	44.4 Å²	44.4	11%	0.109	22%	0.224	C	C	.	.	H	α-helix	trans	-71.6	-46.6	-179.8	171	0	0	0	0	111.1	I652 M655 Q656 Q692 A693 F694 A698 Q699 C700	I652-V696 HydrophobicContact CG1-CB 4.5Å; I652-V696 HydrophobicContact CG2-CG1 4.31Å; I652-V696 HydrophobicContact CG2-CG2 4.05Å; M655-V696 HydrophobicContact CB-CG1 3.59Å; M655-V696 HydrophobicContact CE-CG1 3.92Å; M655-V696 HydrophobicContact SD-CG1 4.24Å; Q656-V696 HydrophobicContact CG-CG1 3.85Å; Q656-V696 HydrophobicContact CG-CG2 4.38Å; Q656-V696 VanDerWaalsContact NE2-CG2 3.34Å; Q692-V696 WeakPolarHBondContact O-CG2 3.39Å; A693-V696 PolarHBondContact O-N 3.25Å; A693-V696 VanDerWaalsContact O-N 3.1Å; F694-V696 VanDerWaalsContact C-N 3.27Å; F694-V696 PolarHBondContact O-N 3.43Å; V696-A698 VanDerWaalsContact C-N 3.35Å; V696-A698 PolarHBondContact O-N 3.38Å; V696-Q699 PolarHBondContact O-N 3.08Å; V696-C700 VanDerWaalsContact O-CB 3.22Å; V696-C700 WeakPolarHBondContact O-CB 3.39Å; V696-C700 PolarHBondContact O-N 2.84Å
697	V	97.8	Very high	95.4	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.2	-40.7	176.8	64.2	0	0	0	0	111.4	M655 I671 L674 A693 F694 Q699 C700 T701 C716 L717 Y720	M655-V697 HydrophobicContact SD-CB 3.82Å; M655-V697 HydrophobicContact SD-CG2 4.2Å; I671-V697 HydrophobicContact CD1-CG2 4.36Å; I671-V697 HydrophobicContact CG1-CG2 4.09Å; I671-V697 HydrophobicContact CG2-CG2 3.85Å; L674-V697 HydrophobicContact CD2-CB 4.08Å; L674-V697 HydrophobicContact CD2-CG1 4.16Å; A693-V697 PolarHBondContact O-N 3.02Å; F694-V697 VanDerWaalsContact O-CG1 3.24Å; F694-V697 WeakPolarHBondContact O-CG1 3.42Å; F694-V697 PolarHBondContact O-N 2.85Å; V697-Q699 PolarHBondContact O-N 3.39Å; V697-C700 PolarHBondContact O-N 3.2Å; V697-T701 WeakPolarHBondContact O-CB 3.42Å; V697-T701 PolarHBondContact O-N 3.4Å; V697-T701 PolarHBondContact O-OG1 2.99Å; V697-C716 HydrophobicContact CG2-CB 4.12Å; V697-L717 HydrophobicContact CG1-CD2 4.23Å; V697-Y720 HydrophobicContact CG1-CE2 4.33Å
698	A	97.4	Very high	95.4	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.6	-46.2	175.7	0	0	0	0	0	111.9	F694 V696 L702 L717 Y742	F694-A698 WeakPolarHBondContact O-CB 3.42Å; F694-A698 PolarHBondContact O-N 2.77Å; V696-A698 VanDerWaalsContact C-N 3.35Å; V696-A698 PolarHBondContact O-N 3.38Å; A698-L702 WeakPolarHBondContact O-CB 3.5Å; A698-L702 VanDerWaalsContact O-CG 3.26Å; A698-L702 WeakPolarHBondContact O-CG 3.38Å; A698-L702 PolarHBondContact O-N 2.94Å; A698-L717 HydrophobicContact CB-CD2 4.25Å; A698-Y742 HydrophobicContact CB-CD1 4.05Å; A698-Y742 HydrophobicContact CB-CG 4.26Å
699	Q	96	Very high	95.4	Very high	55 Å²	55	42.9 Å²	42.9	26%	0.257	22%	0.217	S	C	.	.	H	α-helix	trans	-69	-36.7	178.1	-73.1	-77.5	-19	0	0	112.9	P695 V696 V697 L702 R703 Y742	P695-Q699 WeakPolarHBondContact O-CB 3.5Å; P695-Q699 WeakPolarHBondContact O-CG 3.35Å; P695-Q699 PolarHBondContact O-N 3.15Å; V696-Q699 PolarHBondContact O-N 3.08Å; V697-Q699 PolarHBondContact O-N 3.39Å; Q699-L702 PolarHBondContact O-N 3.05Å; Q699-R703 WeakPolarHBondContact O-CB 3.34Å; Q699-R703 WeakPolarHBondContact O-CG 3.18Å; Q699-R703 PolarHBondContact O-N 3.08Å; Q699-R703 VanDerWaalsContact O-N 3.17Å; Q699-R703 VanDerWaalsContact OE1-NE 3.09Å; Q699-Y742 HydrophobicContact CG-CE1 4.46Å; Q699-Y742 PolarHBondContact NE2-OH 2.99Å
700	C	96.4	Very high	95.4	Very high	17 Å²	17	43.3 Å²	43.3	12%	0.115	22%	0.219	C	C	.	.	H	α-helix	trans	-60.7	-49.3	176	-172.6	0	0	0	0	110.2	M655 V696 V697 L702 R703 T704	M655-C700 HydrophobicContact CB-CB 4.26Å; V696-C700 VanDerWaalsContact O-CB 3.22Å; V696-C700 WeakPolarHBondContact O-CB 3.39Å; V696-C700 PolarHBondContact O-N 2.84Å; V697-C700 PolarHBondContact O-N 3.2Å; C700-L702 VanDerWaalsContact C-N 3.33Å; C700-L702 PolarHBondContact O-N 3.27Å; C700-R703 PolarHBondContact O-N 3.09Å; C700-T704 WeakPolarHBondContact O-CB 3.37Å; C700-T704 PolarHBondContact O-N 2.75Å
701	T	96.6	Very high	95.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.7	-42.5	176.2	-49.1	0	0	0	0	111.8	V697 R703 G713 V746 Q749	V697-T701 WeakPolarHBondContact O-CB 3.42Å; V697-T701 PolarHBondContact O-N 3.4Å; V697-T701 PolarHBondContact O-OG1 2.99Å; T701-R703 VanDerWaalsContact C-N 3.3Å; T701-R703 PolarHBondContact O-N 2.96Å; T701-G713 WeakPolarHBondContact OG1-CA 3.43Å; T701-V746 HydrophobicContact CG2-CG1 3.7Å; T701-V746 HydrophobicContact CG2-CG2 4.02Å; T701-Q749 PolarHBondContact O-OE1 2.95Å
702	L	96.5	Very high	95.3	Very high	44 Å²	44	42.5 Å²	42.5	23%	0.23	21%	0.21	C	C	.	.	H	α-helix	trans	-70.2	-20.5	-179.8	-72.3	172.2	0	0	0	114.9	A698 Q699 C700 Y742 Q745 V746 Q749	A698-L702 WeakPolarHBondContact O-CB 3.5Å; A698-L702 VanDerWaalsContact O-CG 3.26Å; A698-L702 WeakPolarHBondContact O-CG 3.38Å; A698-L702 PolarHBondContact O-N 2.94Å; Q699-L702 PolarHBondContact O-N 3.05Å; C700-L702 VanDerWaalsContact C-N 3.33Å; C700-L702 PolarHBondContact O-N 3.27Å; L702-Y742 HydrophobicContact CD1-CD1 3.91Å; L702-Y742 HydrophobicContact CD1-CE1 4.3Å; L702-Q745 HydrophobicContact CD1-CB 4.14Å; L702-Q745 HydrophobicContact CD2-CB 3.8Å; L702-V746 HydrophobicContact CD1-CG2 4.46Å; L702-V746 HydrophobicContact CD2-CG2 3.72Å; L702-V746 HydrophobicContact CG-CG2 3.77Å; L702-Q749 VanDerWaalsContact CA-OE1 3.28Å; L702-Q749 PolarHBondContact O-NE2 3.02Å
703	R	94.1	Very high	95.5	Very high	188 Å²	188	37.4 Å²	37.4	71%	0.709	19%	0.186	S	C	*	.	H	α-helix	trans	-108.9	-18.2	-172.7	-68.7	175.7	-170.6	-166.6	2.8	114.2	Q699 C700 T701	Q699-R703 WeakPolarHBondContact O-CB 3.34Å; Q699-R703 WeakPolarHBondContact O-CG 3.18Å; Q699-R703 PolarHBondContact O-N 3.08Å; Q699-R703 VanDerWaalsContact O-N 3.17Å; Q699-R703 VanDerWaalsContact OE1-NE 3.09Å; C700-R703 PolarHBondContact O-N 3.09Å; T701-R703 VanDerWaalsContact C-N 3.3Å; T701-R703 PolarHBondContact O-N 2.96Å
704	T	93.5	Very high	95.4	Very high	13 Å²	13	37.6 Å²	37.6	8%	0.08	19%	0.188	C	C	.	.			trans	-72.9	155.7	-178.7	-166.6	0	0	0	0	111.1	C700 D706 I709 M710	C700-T704 WeakPolarHBondContact O-CB 3.37Å; C700-T704 PolarHBondContact O-N 2.75Å; T704-D706 WeakPolarHBondContact OG1-CB 3.32Å; T704-D706 PolarHBondContact OG1-N 2.89Å; T704-D706 VanDerWaalsContact OG1-N 3.08Å; T704-I709 HydrophobicContact CG2-CB 3.94Å; T704-I709 HydrophobicContact CG2-CG2 3.71Å; T704-M710 HydrophobicContact CG2-CE 4.06Å; T704-M710 HydrophobicContact CG2-CG 3.54Å; T704-M710 WeakPolarHBondContact O-CE 3.39Å
705	D	90.5	Very high	95.3	Very high	150 Å²	150	39.2 Å²	39.2	80%	0.802	20%	0.195	S	C	*	.			trans	-107.1	-2.9	165.4	-65.2	-40.7	0	0	0	111.3
706	D	92.2	Very high	95.4	Very high	59 Å²	59	38.1 Å²	38.1	32%	0.316	19%	0.188	S	C	.	.			trans	-82	124.2	179.7	-175.8	-74	0	0	0	111.1	T704 T708 I709 M710	T704-D706 WeakPolarHBondContact OG1-CB 3.32Å; T704-D706 PolarHBondContact OG1-N 2.89Å; T704-D706 VanDerWaalsContact OG1-N 3.08Å; D706-T708 PolarHBondContact O-N 2.87Å; D706-T708 WeakPolarHBondContact OD1-CA 3.38Å; D706-T708 WeakPolarHBondContact OD1-CB 3.31Å; D706-T708 PolarHBondContact OD1-N 3.45Å; D706-I709 HydrophobicContact CB-CB 4.15Å; D706-I709 HydrophobicContact CB-CD1 3.83Å; D706-I709 HydrophobicContact CB-CG1 3.97Å; D706-I709 PolarHBondContact O-N 3.31Å; D706-I709 PolarHBondContact OD1-N 2.96Å; D706-M710 WeakPolarHBondContact O-CG 3.39Å; D706-M710 PolarHBondContact O-N 3.47Å; D706-M710 VanDerWaalsContact O-N 3.11Å
707	H	92.3	Very high	95.4	Very high	75 Å²	75	37.2 Å²	37.2	35%	0.347	18%	0.183	S	C	.	.	H	α-helix	trans	-67.6	-34.7	-175.4	-56.4	155	0	0	0	113.1	M710 Q711 S756 S758	H707-M710 WeakPolarHBondContact O-CB 2.96Å; H707-M710 PolarHBondContact O-N 3.35Å; H707-Q711 WeakPolarHBondContact O-CB 3.34Å; H707-Q711 VanDerWaalsContact O-CG 3.22Å; H707-Q711 WeakPolarHBondContact O-CG 3.48Å; H707-Q711 PolarHBondContact O-N 3.42Å; H707-S756 WeakPolarHBondContact CE1-CB 3.37Å; H707-S756 PolarHBondContact CE1-OG 3.12Å; H707-S756 VanDerWaalsContact NE2-CB 3.29Å; H707-S756 WeakPolarHBondContact NE2-CB 3.5Å; H707-S758 PolarHBondContact ND1-OG 2.92Å
708	T	92.4	Very high	95.3	Very high	68 Å²	68	38 Å²	38	42%	0.417	19%	0.186	S	C	.	.	H	α-helix	trans	-70.2	-42.5	179.8	-50.8	0	0	0	0	110	A668 D706 M710 Q711 N712	A668-T708 HydrophobicContact CB-CG2 3.77Å; D706-T708 PolarHBondContact O-N 2.87Å; D706-T708 WeakPolarHBondContact OD1-CA 3.38Å; D706-T708 WeakPolarHBondContact OD1-CB 3.31Å; D706-T708 PolarHBondContact OD1-N 3.45Å; T708-M710 VanDerWaalsContact C-N 3.28Å; T708-M710 PolarHBondContact O-N 3.27Å; T708-Q711 PolarHBondContact O-N 3.5Å; T708-N712 WeakPolarHBondContact O-CB 3.48Å; T708-N712 PolarHBondContact O-N 3.27Å; T708-N712 PolarHBondContact O-OD1 3.21Å; T708-N712 VanDerWaalsContact O-OD1 3.05Å
709	I	95.2	Very high	95.3	Very high	19 Å²	19	38 Å²	38	10%	0.097	19%	0.186	C	C	.	.	H	α-helix	trans	-60.2	-40.2	173.1	-62.3	178	0	0	0	110.7	C667 A668 I671 T704 D706 G713	C667-I709 HydrophobicContact CB-CD1 3.72Å; C667-I709 HydrophobicContact CB-CG1 4.27Å; A668-I709 HydrophobicContact CB-CG1 4.1Å; I671-I709 HydrophobicContact CD1-CG2 3.67Å; T704-I709 HydrophobicContact CG2-CB 3.94Å; T704-I709 HydrophobicContact CG2-CG2 3.71Å; D706-I709 HydrophobicContact CB-CB 4.15Å; D706-I709 HydrophobicContact CB-CD1 3.83Å; D706-I709 HydrophobicContact CB-CG1 3.97Å; D706-I709 PolarHBondContact O-N 3.31Å; D706-I709 PolarHBondContact OD1-N 2.96Å; I709-G713 WeakPolarHBondContact O-CA 3.46Å; I709-G713 PolarHBondContact O-N 3.19Å
710	M	95.7	Very high	95.3	Very high	8 Å²	8	35.3 Å²	35.3	4%	0.039	17%	0.173	C	C	.	.	H	α-helix	trans	-62.8	-47.4	176.4	-73.8	-173.9	-170	0	0	112.6	T704 D706 H707 T708 G713 G714 L750 T759	T704-M710 HydrophobicContact CG2-CE 4.06Å; T704-M710 HydrophobicContact CG2-CG 3.54Å; T704-M710 WeakPolarHBondContact O-CE 3.39Å; D706-M710 WeakPolarHBondContact O-CG 3.39Å; D706-M710 PolarHBondContact O-N 3.47Å; D706-M710 VanDerWaalsContact O-N 3.11Å; H707-M710 WeakPolarHBondContact O-CB 2.96Å; H707-M710 PolarHBondContact O-N 3.35Å; T708-M710 VanDerWaalsContact C-N 3.28Å; T708-M710 PolarHBondContact O-N 3.27Å; M710-G713 PolarHBondContact O-N 3.47Å; M710-G714 PolarHBondContact O-N 3.48Å; M710-L750 HydrophobicContact CB-CD2 3.75Å; M710-T759 HydrophobicContact SD-CG2 3.69Å
711	Q	94.6	Very high	95.3	Very high	29 Å²	29	34.5 Å²	34.5	14%	0.136	17%	0.168	C	C	.	.	H	α-helix	trans	-60.5	-54.6	179.3	-76.8	167	-1	0	0	111.2	H707 T708 G713 G714 E715 S758 F762	H707-Q711 WeakPolarHBondContact O-CB 3.34Å; H707-Q711 VanDerWaalsContact O-CG 3.22Å; H707-Q711 WeakPolarHBondContact O-CG 3.48Å; H707-Q711 PolarHBondContact O-N 3.42Å; T708-Q711 PolarHBondContact O-N 3.5Å; Q711-G713 VanDerWaalsContact C-N 3.28Å; Q711-G713 PolarHBondContact O-N 2.99Å; Q711-G714 WeakPolarHBondContact O-CA 3.45Å; Q711-G714 PolarHBondContact O-N 3.35Å; Q711-G714 VanDerWaalsContact O-N 3.1Å; Q711-E715 PolarHBondContact O-N 2.9Å; Q711-S758 PolarHBondContact NE2-O 3.15Å; Q711-F762 HydrophobicContact CB-CD2 3.95Å; Q711-F762 HydrophobicContact CB-CE2 4.3Å; Q711-F762 HydrophobicContact CG-CD2 4.1Å; Q711-F762 HydrophobicContact CG-CE2 4.42Å
712	N	95.7	Very high	95.1	Very high	20 Å²	20	34.8 Å²	34.8	11%	0.107	17%	0.17	C	C	.	.	H	α-helix	trans	-65.2	-36.5	-178.2	-61.3	17.5	0	0	0	110.5	A668 I671 D672 T708 E715 C716	A668-N712 PolarHBondContact O-ND2 3.14Å; I671-N712 HydrophobicContact CB-CB 4.26Å; I671-N712 HydrophobicContact CG2-CB 3.92Å; I671-N712 VanDerWaalsContact CG2-O 3.28Å; I671-N712 WeakPolarHBondContact CG2-O 3.26Å; D672-N712 VanDerWaalsContact OD1-CB 3.23Å; D672-N712 WeakPolarHBondContact OD1-CB 3.24Å; D672-N712 PolarHBondContact OD1-ND2 3.2Å; D672-N712 PolarHBondContact OD2-ND2 2.87Å; T708-N712 WeakPolarHBondContact O-CB 3.48Å; T708-N712 PolarHBondContact O-N 3.27Å; T708-N712 PolarHBondContact O-OD1 3.21Å; T708-N712 VanDerWaalsContact O-OD1 3.05Å; N712-E715 PolarHBondContact O-N 3.3Å; N712-C716 VanDerWaalsContact O-CB 3.3Å; N712-C716 WeakPolarHBondContact O-CB 3.48Å; N712-C716 PolarHBondContact O-N 3.18Å
713	G	97.4	Very high	95	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-59.4	-45.3	172.1	0	0	0	0	0	112.7	T701 I709 M710 Q711 C716 L717	T701-G713 WeakPolarHBondContact OG1-CA 3.43Å; I709-G713 WeakPolarHBondContact O-CA 3.46Å; I709-G713 PolarHBondContact O-N 3.19Å; M710-G713 PolarHBondContact O-N 3.47Å; Q711-G713 VanDerWaalsContact C-N 3.28Å; Q711-G713 PolarHBondContact O-N 2.99Å; G713-C716 PolarHBondContact O-N 3.33Å; G713-L717 VanDerWaalsContact O-CG 3.27Å; G713-L717 WeakPolarHBondContact O-CG 3.31Å; G713-L717 PolarHBondContact O-N 2.99Å
714	G	97.1	Very high	95	Very high	3 Å²	3	25.1 Å²	25.1	3%	0.031	13%	0.134	C	C	.	.	H	α-helix	trans	-59.1	-46.6	173.4	0	0	0	0	0	112.8	M710 Q711 L717 R718	M710-G714 PolarHBondContact O-N 3.48Å; Q711-G714 WeakPolarHBondContact O-CA 3.45Å; Q711-G714 PolarHBondContact O-N 3.35Å; Q711-G714 VanDerWaalsContact O-N 3.1Å; G714-L717 PolarHBondContact O-N 2.92Å; G714-R718 PolarHBondContact O-N 3.46Å
715	E	96.2	Very high	95	Very high	34 Å²	34	25.7 Å²	25.7	16%	0.159	14%	0.137	C	C	.	.	H	α-helix	trans	-67.3	-36.8	177.7	-76	-59.9	104.2	0	0	112.9	Q711 N712 R718 A719 F762	Q711-E715 PolarHBondContact O-N 2.9Å; N712-E715 PolarHBondContact O-N 3.3Å; E715-R718 WeakPolarHBondContact O-CB 3.48Å; E715-R718 PolarHBondContact O-N 2.87Å; E715-R718 IonicContact OE1-NE 3.33Å; E715-R718 PolarHBondContact OE1-NE 3.1Å; E715-R718 IonicContact OE2-CZ 3.29Å; E715-R718 IonicContact OE2-NE 3.74Å; E715-R718 PolarHBondContact OE2-NE 3.49Å; E715-R718 IonicContact OE2-NH2 3.15Å; E715-R718 PolarHBondContact OE2-NH2 3.27Å; E715-A719 PolarHBondContact O-N 3.15Å; E715-F762 HydrophobicContact CG-CB 4Å; E715-F762 HydrophobicContact CG-CG 4.36Å
716	C	97.7	Very high	95	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-63.1	-44.4	173.3	-169.4	0	0	0	0	111.1	I671 A675 V697 N712 G713 R718 A719 Y720	I671-C716 HydrophobicContact CG2-CB 3.65Å; A675-C716 HydrophobicContact CB-CB 3.92Å; V697-C716 HydrophobicContact CG2-CB 4.12Å; N712-C716 VanDerWaalsContact O-CB 3.3Å; N712-C716 WeakPolarHBondContact O-CB 3.48Å; N712-C716 PolarHBondContact O-N 3.18Å; G713-C716 PolarHBondContact O-N 3.33Å; C716-R718 VanDerWaalsContact C-N 3.31Å; C716-R718 PolarHBondContact O-N 3.45Å; C716-A719 WeakPolarHBondContact O-CB 3.21Å; C716-A719 PolarHBondContact O-N 3.1Å; C716-Y720 VanDerWaalsContact O-CD2 3.27Å; C716-Y720 WeakPolarHBondContact O-CD2 3.27Å; C716-Y720 PolarHBondContact O-N 2.78Å
717	L	97.8	Very high	95.2	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-65	-35.5	174.4	-67	175.1	0	0	0	112	F694 V697 A698 G713 G714 A719 Y720 V721 V743 V746	F694-L717 HydrophobicContact CD2-CD2 3.82Å; F694-L717 HydrophobicContact CE2-CD2 3.4Å; F694-L717 HydrophobicContact CZ-CD2 4.12Å; V697-L717 HydrophobicContact CG1-CD2 4.23Å; A698-L717 HydrophobicContact CB-CD2 4.25Å; G713-L717 VanDerWaalsContact O-CG 3.27Å; G713-L717 WeakPolarHBondContact O-CG 3.31Å; G713-L717 PolarHBondContact O-N 2.99Å; G714-L717 PolarHBondContact O-N 2.92Å; L717-A719 VanDerWaalsContact C-N 3.31Å; L717-A719 PolarHBondContact O-N 2.93Å; L717-Y720 PolarHBondContact O-N 3.4Å; L717-V721 WeakPolarHBondContact O-CG2 3.38Å; L717-V721 PolarHBondContact O-N 3.36Å; L717-V743 HydrophobicContact CB-CG2 4.46Å; L717-V746 HydrophobicContact CD1-CB 3.91Å; L717-V746 HydrophobicContact CD1-CG1 3.97Å; L717-V746 HydrophobicContact CD1-CG2 3.68Å
718	R	96.8	Very high	95.3	Very high	15 Å²	15	21.1 Å²	21.1	6%	0.057	11%	0.109	C	C	.	.	H	α-helix	trans	-58.8	-44.8	171.5	-175.1	179.7	73.3	106	-13	110.6	G714 E715 C716 Y720 V721 S722 R765 L766 T769 D992 D994	G714-R718 PolarHBondContact O-N 3.46Å; E715-R718 WeakPolarHBondContact O-CB 3.48Å; E715-R718 PolarHBondContact O-N 2.87Å; E715-R718 IonicContact OE1-NE 3.33Å; E715-R718 PolarHBondContact OE1-NE 3.1Å; E715-R718 IonicContact OE2-CZ 3.29Å; E715-R718 IonicContact OE2-NE 3.74Å; E715-R718 PolarHBondContact OE2-NE 3.49Å; E715-R718 IonicContact OE2-NH2 3.15Å; E715-R718 PolarHBondContact OE2-NH2 3.27Å; C716-R718 VanDerWaalsContact C-N 3.31Å; C716-R718 PolarHBondContact O-N 3.45Å; R718-Y720 PolarHBondContact O-N 2.87Å; R718-V721 PolarHBondContact O-N 3.36Å; R718-S722 WeakPolarHBondContact O-CB 3.3Å; R718-S722 PolarHBondContact O-N 3.41Å; R718-R765 VanDerWaalsContact CD-C 3.48Å; R718-L766 HydrophobicContact CB-CB 4.27Å; R718-L766 HydrophobicContact CB-CD1 3.77Å; R718-L766 HydrophobicContact CG-CD1 4.42Å; R718-T769 HydrophobicContact CG-CG2 4.13Å; R718-D992 IonicContact CZ-OD2 3.66Å; R718-D992 VanDerWaalsContact CZ-OD2 3.25Å; R718-D992 IonicContact NH1-OD1 3.04Å; R718-D992 PolarHBondContact NH1-OD1 3.39Å; R718-D992 IonicContact NH1-OD2 3.78Å; R718-D992 PolarHBondContact NH1-OD2 2.99Å; R718-D992 IonicContact NH2-OD1 3.37Å; R718-D992 IonicContact NH2-OD2 3.58Å; R718-D992 PolarHBondContact NH2-OD2 3.1Å; R718-D994 IonicContact CZ-OD2 3.33Å; R718-D994 IonicContact NH1-OD2 2.69Å; R718-D994 PolarHBondContact NH1-OD2 2.87Å
719	A	96.1	Very high	95.3	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-58.8	-45.7	175.9	0	0	0	0	0	112	V678 R679 E715 C716 L717 S722 V723	V678-A719 HydrophobicContact CB-CB 4.36Å; V678-A719 HydrophobicContact CG1-CB 3.97Å; R679-A719 HydrophobicContact CG-CB 3.8Å; E715-A719 PolarHBondContact O-N 3.15Å; C716-A719 WeakPolarHBondContact O-CB 3.21Å; C716-A719 PolarHBondContact O-N 3.1Å; L717-A719 VanDerWaalsContact C-N 3.31Å; L717-A719 PolarHBondContact O-N 2.93Å; A719-S722 PolarHBondContact O-N 2.97Å; A719-V723 WeakPolarHBondContact O-CB 3.49Å; A719-V723 VanDerWaalsContact O-CG2 3.28Å; A719-V723 WeakPolarHBondContact O-CG2 3.48Å; A719-V723 PolarHBondContact O-N 3.25Å
720	Y	97.2	Very high	95.1	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-60.9	-45.2	176.2	-84.5	-76.1	0	0	0	113.1	L674 V678 L685 L689 A693 F694 V697 C716 L717 R718 A724 I728	L674-Y720 HydrophobicContact CD2-CE2 4.45Å; V678-Y720 HydrophobicContact CG1-CD1 4.08Å; V678-Y720 HydrophobicContact CG1-CD2 4.4Å; V678-Y720 HydrophobicContact CG1-CE1 4.37Å; V678-Y720 HydrophobicContact CG1-CG 4.11Å; V678-Y720 HydrophobicContact CG2-CD1 4.28Å; V678-Y720 HydrophobicContact CG2-CD2 4.22Å; V678-Y720 HydrophobicContact CG2-CE1 3.78Å; V678-Y720 HydrophobicContact CG2-CE2 3.69Å; V678-Y720 HydrophobicContact CG2-CG 4.5Å; V678-Y720 VanDerWaalsContact CG2-CZ 3.45Å; L685-Y720 HydrophobicContact CD1-CD1 3.68Å; L685-Y720 HydrophobicContact CD1-CE1 3.79Å; L689-Y720 HydrophobicContact CB-CE1 4.44Å; L689-Y720 PolarHBondContact O-OH 3.3Å; A693-Y720 WeakPolarHBondContact CB-OH 3.42Å; F694-Y720 HydrophobicContact CB-CD1 4.44Å; F694-Y720 HydrophobicContact CB-CE1 3.99Å; F694-Y720 HydrophobicContact CB-CE2 4.26Å; F694-Y720 HydrophobicContact CD2-CD1 4.1Å; F694-Y720 AromaticContact CD2-CD2 3.86Å; F694-Y720 HydrophobicContact CD2-CD2 3.86Å; F694-Y720 HydrophobicContact CD2-CE1 4.44Å; F694-Y720 HydrophobicContact CD2-CE2 4.25Å; F694-Y720 AromaticContact CD2-CG 3.77Å; F694-Y720 HydrophobicContact CD2-CG 3.77Å; F694-Y720 HydrophobicContact CE2-CG 4.48Å; V697-Y720 HydrophobicContact CG1-CE2 4.33Å; C716-Y720 VanDerWaalsContact O-CD2 3.27Å; C716-Y720 WeakPolarHBondContact O-CD2 3.27Å; C716-Y720 PolarHBondContact O-N 2.78Å; L717-Y720 PolarHBondContact O-N 3.4Å; R718-Y720 PolarHBondContact O-N 2.87Å; Y720-A724 CarbonylContact O-C 3.59Å; Y720-A724 PolarHBondContact O-N 2.84Å; Y720-I728 HydrophobicContact CD1-CD1 3.87Å; Y720-I728 HydrophobicContact CG-CD1 4.32Å
721	V	95.1	Very high	95.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-65.7	-41.6	178.2	172.2	0	0	0	0	111	L717 R718 L725 V743 T769 L770 R773	L717-V721 WeakPolarHBondContact O-CG2 3.38Å; L717-V721 PolarHBondContact O-N 3.36Å; R718-V721 PolarHBondContact O-N 3.36Å; V721-L725 HydrophobicContact CG1-CD1 4.37Å; V721-L725 WeakPolarHBondContact O-CB 3.48Å; V721-V743 HydrophobicContact CG2-CG1 4.3Å; V721-V743 HydrophobicContact CG2-CG2 3.97Å; V721-T769 HydrophobicContact CG1-CG2 4.25Å; V721-L770 HydrophobicContact CG1-CD1 4.06Å; V721-L770 HydrophobicContact CG2-CD1 4.47Å; V721-R773 HydrophobicContact CG1-CB 4.35Å
722	S	94.3	Very high	95.2	Very high	6 Å²	6	30.5 Å²	30.5	4%	0.042	14%	0.143	C	C	.	.	H	α-helix	trans	-64.7	-48.1	177	178.1	0	0	0	0	111.5	R679 R718 A719 R773 D994	R679-S722 PolarHBondContact NH1-OG 3.35Å; R718-S722 WeakPolarHBondContact O-CB 3.3Å; R718-S722 PolarHBondContact O-N 3.41Å; A719-S722 PolarHBondContact O-N 2.97Å; S722-R773 VanDerWaalsContact O-CZ 3.3Å; S722-R773 PolarHBondContact O-NE 3.42Å; S722-R773 PolarHBondContact O-NH2 3.29Å; S722-D994 WeakPolarHBondContact CB-OD1 3.23Å; S722-D994 PolarHBondContact OG-OD1 2.95Å
723	V	93.8	Very high	95.1	Very high	23 Å²	23	30.7 Å²	30.7	14%	0.139	14%	0.144	C	C	.	.	H	α-helix	trans	-80.4	-42.6	-171.6	176.5	0	0	0	0	112.7	V678 P683 L685 A719	V678-V723 HydrophobicContact CG1-CB 4.44Å; V678-V723 HydrophobicContact CG1-CG2 4.45Å; P683-V723 HydrophobicContact CB-CG1 4.38Å; P683-V723 HydrophobicContact CG-CG1 4.39Å; L685-V723 HydrophobicContact CD2-CG1 4.1Å; A719-V723 WeakPolarHBondContact O-CB 3.49Å; A719-V723 VanDerWaalsContact O-CG2 3.28Å; A719-V723 WeakPolarHBondContact O-CG2 3.48Å; A719-V723 PolarHBondContact O-N 3.25Å
724	A	93.8	Very high	94.8	Very high	6 Å²	6	39.7 Å²	39.7	5%	0.05	19%	0.186	C	C	.	.	H	α-helix	trans	-141	46.1	-166.1	0	0	0	0	0	114	L685 Y720 E726 Q727 I728	L685-A724 HydrophobicContact CD1-CB 3.6Å; L685-A724 HydrophobicContact CG-CB 3.73Å; Y720-A724 CarbonylContact O-C 3.59Å; Y720-A724 PolarHBondContact O-N 2.84Å; A724-E726 VanDerWaalsContact C-N 3.28Å; A724-E726 PolarHBondContact O-N 3.42Å; A724-E726 VanDerWaalsContact O-N 3.16Å; A724-Q727 HydrophobicContact CB-CB 4.44Å; A724-Q727 PolarHBondContact O-N 3.45Å; A724-Q727 VanDerWaalsContact O-N 3.08Å; A724-I728 PolarHBondContact O-N 3.33Å
725	L	92.9	Very high	94.6	Very high	25 Å²	25	46 Å²	46	13%	0.131	22%	0.215	C	C	.	.	H	α-helix	trans	-45.6	-48	179.5	175.2	61.6	0	0	0	113.4	V721 Q727 I728 A729 L740 R773 A774	V721-L725 HydrophobicContact CG1-CD1 4.37Å; V721-L725 WeakPolarHBondContact O-CB 3.48Å; L725-Q727 VanDerWaalsContact C-N 3.31Å; L725-Q727 PolarHBondContact O-N 3.21Å; L725-I728 PolarHBondContact O-N 3.01Å; L725-A729 VanDerWaalsContact O-CB 3.26Å; L725-A729 WeakPolarHBondContact O-CB 3.47Å; L725-A729 PolarHBondContact O-N 3.45Å; L725-L740 HydrophobicContact CD1-CD1 4.43Å; L725-L740 HydrophobicContact CD1-CD2 3.83Å; L725-R773 VanDerWaalsContact CD2-C 3.47Å; L725-R773 HydrophobicContact CD2-CB 3.86Å; L725-R773 WeakPolarHBondContact CD2-O 3.3Å; L725-A774 HydrophobicContact CD1-CB 4.43Å; L725-A774 HydrophobicContact CD2-CB 4.43Å
726	E	91.9	Very high	94.4	Very high	151 Å²	151	46.6 Å²	46.6	71%	0.706	23%	0.23	S	C	*	.	H	α-helix	trans	-59.1	-41.7	-176.5	-65.5	-177.9	-175.2	0	0	112.4	A724 A729 Q730	A724-E726 VanDerWaalsContact C-N 3.28Å; A724-E726 PolarHBondContact O-N 3.42Å; A724-E726 VanDerWaalsContact O-N 3.16Å; E726-A729 PolarHBondContact O-N 2.69Å; E726-Q730 WeakPolarHBondContact O-CB 3.35Å; E726-Q730 WeakPolarHBondContact O-CG 3.28Å; E726-Q730 PolarHBondContact O-N 3.1Å
727	Q	95.3	Very high	94.2	Very high	37 Å²	37	48.8 Å²	48.8	17%	0.173	24%	0.242	C	C	.	.	H	α-helix	trans	-68.6	-41.2	178.8	-67.7	179.9	-91.6	0	0	111.2	L685 V690 A724 L725 Q730 W731	L685-Q727 PolarHBondContact O-NE2 3.09Å; V690-Q727 HydrophobicContact CG1-CB 4.4Å; V690-Q727 HydrophobicContact CG2-CB 4.25Å; A724-Q727 HydrophobicContact CB-CB 4.44Å; A724-Q727 PolarHBondContact O-N 3.45Å; A724-Q727 VanDerWaalsContact O-N 3.08Å; L725-Q727 VanDerWaalsContact C-N 3.31Å; L725-Q727 PolarHBondContact O-N 3.21Å; Q727-Q730 PolarHBondContact O-N 3.41Å; Q727-W731 WeakPolarHBondContact O-CB 2.98Å; Q727-W731 PolarHBondContact O-N 2.93Å
728	I	94.8	Very high	93.9	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-66.8	-38.9	177	-59.8	-51.4	0	0	0	111.5	F694 Y720 A724 L725 Q730 G739	F694-I728 HydrophobicContact CB-CD1 4.48Å; F694-I728 HydrophobicContact CD1-CD1 4.33Å; F694-I728 HydrophobicContact CD2-CD1 3.58Å; F694-I728 HydrophobicContact CE1-CG2 4.48Å; F694-I728 HydrophobicContact CE2-CD1 3.79Å; F694-I728 HydrophobicContact CE2-CG1 4.37Å; F694-I728 HydrophobicContact CE2-CG2 3.89Å; F694-I728 HydrophobicContact CG-CD1 3.87Å; F694-I728 HydrophobicContact CZ-CD1 4.29Å; F694-I728 HydrophobicContact CZ-CG2 3.75Å; Y720-I728 HydrophobicContact CD1-CD1 3.87Å; Y720-I728 HydrophobicContact CG-CD1 4.32Å; A724-I728 PolarHBondContact O-N 3.33Å; L725-I728 PolarHBondContact O-N 3.01Å; I728-Q730 VanDerWaalsContact C-N 3.32Å; I728-Q730 PolarHBondContact O-N 2.91Å; I728-G739 VanDerWaalsContact O-CA 3.26Å; I728-G739 WeakPolarHBondContact O-CA 3.38Å; I728-G739 PolarHBondContact O-N 3.5Å
729	A	91.3	Very high	93.8	Very high	18 Å²	18	49.3 Å²	49.3	15%	0.149	25%	0.248	C	C	.	.	H	α-helix	trans	-70.2	-27.4	177	0	0	0	0	0	112.7	L725 E726 R732 L740	L725-A729 VanDerWaalsContact O-CB 3.26Å; L725-A729 WeakPolarHBondContact O-CB 3.47Å; L725-A729 PolarHBondContact O-N 3.45Å; E726-A729 PolarHBondContact O-N 2.69Å; A729-R732 PolarHBondContact O-NH1 3.2Å; A729-R732 PolarHBondContact O-NH2 3.46Å; A729-L740 HydrophobicContact CB-CD1 3.84Å; A729-L740 HydrophobicContact CB-CG 4.28Å
730	Q	92.6	Very high	93.6	Very high	141 Å²	141	50.5 Å²	50.5	66%	0.659	25%	0.254	S	S	*	.	H	α-helix	trans	-88.2	-30.3	177.5	-72.4	172.2	21	0	0	113.8	E726 Q727 I728 R732	E726-Q730 WeakPolarHBondContact O-CB 3.35Å; E726-Q730 WeakPolarHBondContact O-CG 3.28Å; E726-Q730 PolarHBondContact O-N 3.1Å; Q727-Q730 PolarHBondContact O-N 3.41Å; I728-Q730 VanDerWaalsContact C-N 3.32Å; I728-Q730 PolarHBondContact O-N 2.91Å; Q730-R732 VanDerWaalsContact C-NH1 3.27Å; Q730-R732 PolarHBondContact O-NH1 3.04Å; Q730-R732 VanDerWaalsContact O-NH1 3.1Å
731	W	95.9	Very high	93.3	Very high	35 Å²	35	55.1 Å²	55.1	13%	0.133	27%	0.271	C	S	.	.			trans	-60.4	141.8	178.6	179.3	88.7	0	0	0	111.8	V690 F694 P695 Q727 D733 S738 G739 Y742	V690-W731 HydrophobicContact CG1-CB 4.19Å; V690-W731 HydrophobicContact CG1-CG 4.35Å; F694-W731 HydrophobicContact CD1-CE3 4.47Å; F694-W731 HydrophobicContact CE1-CE3 4.18Å; F694-W731 HydrophobicContact CE1-CZ3 4.28Å; P695-W731 HydrophobicContact CB-CH2 4.07Å; P695-W731 HydrophobicContact CB-CZ2 3.91Å; P695-W731 HydrophobicContact CG-CH2 3.87Å; P695-W731 HydrophobicContact CG-CZ2 3.31Å; Q727-W731 WeakPolarHBondContact O-CB 2.98Å; Q727-W731 PolarHBondContact O-N 2.93Å; W731-D733 HydrophobicContact CH2-CB 3.7Å; W731-D733 HydrophobicContact CZ2-CB 4.27Å; W731-D733 HydrophobicContact CZ3-CB 4.27Å; W731-S738 WeakPolarHBondContact O-CA 3.49Å; W731-G739 PolarHBondContact O-N 3.03Å; W731-Y742 HydrophobicContact CH2-CD2 4.25Å; W731-Y742 AromaticContact CH2-CE2 3.88Å; W731-Y742 HydrophobicContact CH2-CE2 3.88Å; W731-Y742 AromaticContact CZ3-CD2 3.7Å; W731-Y742 HydrophobicContact CZ3-CD2 3.7Å; W731-Y742 AromaticContact CZ3-CE2 3.69Å; W731-Y742 HydrophobicContact CZ3-CE2 3.69Å
732	R	94.9	Very high	93.4	Very high	127 Å²	127	55.9 Å²	55.9	48%	0.479	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-136.2	141.5	179.1	-63.6	-70.6	177.3	-75.4	1.3	110.3	A729 Q730 G736 N737 S738	A729-R732 PolarHBondContact O-NH1 3.2Å; A729-R732 PolarHBondContact O-NH2 3.46Å; Q730-R732 VanDerWaalsContact C-NH1 3.27Å; Q730-R732 PolarHBondContact O-NH1 3.04Å; Q730-R732 VanDerWaalsContact O-NH1 3.1Å; R732-G736 WeakPolarHBondContact CD-O 3.46Å; R732-N737 CarbonylContact C-O 3.59Å; R732-N737 VanDerWaalsContact CA-O 3.27Å; R732-N737 WeakPolarHBondContact CA-O 3.43Å; R732-S738 VanDerWaalsContact NH1-CB 3.27Å
733	D	93.8	Very high	93.4	Very high	23 Å²	23	55.6 Å²	55.6	12%	0.123	27%	0.272	C	S	.	.			trans	-79.1	178.1	167.5	72.1	9.6	0	0	0	112.3	W731 Q735 G736 N737 Y742	W731-D733 HydrophobicContact CH2-CB 3.7Å; W731-D733 HydrophobicContact CZ2-CB 4.27Å; W731-D733 HydrophobicContact CZ3-CB 4.27Å; D733-Q735 PolarHBondContact O-N 3.07Å; D733-Q735 VanDerWaalsContact OD1-C 3.3Å; D733-Q735 WeakPolarHBondContact OD1-CA 3.31Å; D733-Q735 WeakPolarHBondContact OD1-CB 3.23Å; D733-Q735 PolarHBondContact OD1-N 3.44Å; D733-Q735 PolarHBondContact OD2-OE1 3.35Å; D733-G736 PolarHBondContact O-N 2.97Å; D733-G736 PolarHBondContact OD1-N 2.97Å; D733-N737 PolarHBondContact N-O 3.3Å; D733-N737 PolarHBondContact OD1-N 3.33Å; D733-N737 PolarHBondContact OD1-ND2 2.92Å; D733-N737 WeakPolarHBondContact OD2-CB 3.43Å; D733-N737 PolarHBondContact OD2-ND2 3.15Å; D733-Y742 HydrophobicContact CB-CE2 4.28Å; D733-Y742 WeakPolarHBondContact OD2-CE2 3.46Å; D733-Y742 PolarHBondContact OD2-OH 3.4Å
734	E	91.7	Very high	93.4	Very high	189 Å²	189	55.3 Å²	55.3	88%	0.883	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-21.9	178.4	-63.9	-174.6	168.8	0	0	113.3
735	Q	92.4	Very high	93.4	Very high	137 Å²	137	58.2 Å²	58.2	64%	0.64	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-4.8	177.8	-65.5	74.5	35.8	0	0	112.5	D733	D733-Q735 PolarHBondContact O-N 3.07Å; D733-Q735 VanDerWaalsContact OD1-C 3.3Å; D733-Q735 WeakPolarHBondContact OD1-CA 3.31Å; D733-Q735 WeakPolarHBondContact OD1-CB 3.23Å; D733-Q735 PolarHBondContact OD1-N 3.44Å; D733-Q735 PolarHBondContact OD2-OE1 3.35Å
736	G	92.1	Very high	93.6	Very high	45 Å²	45	57 Å²	57	46%	0.464	28%	0.276	S	S	.	.			trans	85.1	10.3	-179.2	0	0	0	0	0	114.6	R732 D733	R732-G736 WeakPolarHBondContact CD-O 3.46Å; D733-G736 PolarHBondContact O-N 2.97Å; D733-G736 PolarHBondContact OD1-N 2.97Å
737	N	93.3	Very high	93.8	Very high	46 Å²	46	49.8 Å²	49.8	25%	0.246	24%	0.242	C	C	.	.			trans	-74.2	138	173.6	-53.6	-55.4	0	0	0	110	R732 D733 W741 Y742	R732-N737 CarbonylContact C-O 3.59Å; R732-N737 VanDerWaalsContact CA-O 3.27Å; R732-N737 WeakPolarHBondContact CA-O 3.43Å; D733-N737 PolarHBondContact N-O 3.3Å; D733-N737 PolarHBondContact OD1-N 3.33Å; D733-N737 PolarHBondContact OD1-ND2 2.92Å; D733-N737 WeakPolarHBondContact OD2-CB 3.43Å; D733-N737 PolarHBondContact OD2-ND2 3.15Å; N737-W741 HydrophobicContact CB-CB 4.26Å; N737-W741 HydrophobicContact CB-CD2 3.8Å; N737-W741 HydrophobicContact CB-CE3 3.72Å; N737-W741 HydrophobicContact CB-CG 4.05Å; N737-W741 HydrophobicContact CB-CZ3 4.36Å; N737-Y742 HydrophobicContact CB-CE2 4.29Å
738	S	93.1	Very high	93.8	Very high	26 Å²	26	50 Å²	50	18%	0.182	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-80.9	165.9	178.7	65.3	0	0	0	0	113	W731 R732 L740 W741 Y742	W731-S738 WeakPolarHBondContact O-CA 3.49Å; R732-S738 VanDerWaalsContact NH1-CB 3.27Å; S738-L740 VanDerWaalsContact C-N 3.28Å; S738-L740 PolarHBondContact O-N 3.39Å; S738-W741 VanDerWaalsContact O-CB 3.25Å; S738-W741 WeakPolarHBondContact O-CB 3.38Å; S738-W741 PolarHBondContact O-N 3.29Å; S738-W741 PolarHBondContact OG-N 2.87Å; S738-W741 VanDerWaalsContact OG-N 3.16Å; S738-Y742 PolarHBondContact O-N 3.45Å
739	G	93.1	Very high	93.8	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.8	-39	172.5	0	0	0	0	0	112	I728 W731 W741 Y742 V743	I728-G739 VanDerWaalsContact O-CA 3.26Å; I728-G739 WeakPolarHBondContact O-CA 3.38Å; I728-G739 PolarHBondContact O-N 3.5Å; W731-G739 PolarHBondContact O-N 3.03Å; G739-W741 PolarHBondContact O-N 3.24Å; G739-Y742 WeakPolarHBondContact O-CB 3.39Å; G739-Y742 PolarHBondContact O-N 2.89Å; G739-V743 PolarHBondContact O-N 3.28Å; G739-V743 VanDerWaalsContact O-N 3.08Å
740	L	91.6	Very high	94.1	Very high	26 Å²	26	51.1 Å²	51.1	14%	0.136	25%	0.247	C	C	.	.	H	α-helix	trans	-59.4	-33.4	172	-71.3	176.8	0	0	0	112.8	L725 A729 S738 Y742 V743 M744 L770	L725-L740 HydrophobicContact CD1-CD1 4.43Å; L725-L740 HydrophobicContact CD1-CD2 3.83Å; A729-L740 HydrophobicContact CB-CD1 3.84Å; A729-L740 HydrophobicContact CB-CG 4.28Å; S738-L740 VanDerWaalsContact C-N 3.28Å; S738-L740 PolarHBondContact O-N 3.39Å; L740-Y742 VanDerWaalsContact C-N 3.33Å; L740-Y742 PolarHBondContact O-N 3.42Å; L740-V743 PolarHBondContact O-N 2.85Å; L740-M744 VanDerWaalsContact O-CG 3.27Å; L740-M744 WeakPolarHBondContact O-CG 3.16Å; L740-M744 PolarHBondContact O-N 3.46Å; L740-L770 HydrophobicContact CD2-CD1 3.91Å
741	W	92.8	Very high	94.2	Very high	97 Å²	97	44.4 Å²	44.4	37%	0.367	22%	0.216	S	C	.	.	H	α-helix	trans	-61.7	-42.2	173.9	180	93.2	0	0	0	111.5	N737 S738 G739 M744 Q745	N737-W741 HydrophobicContact CB-CB 4.26Å; N737-W741 HydrophobicContact CB-CD2 3.8Å; N737-W741 HydrophobicContact CB-CE3 3.72Å; N737-W741 HydrophobicContact CB-CG 4.05Å; N737-W741 HydrophobicContact CB-CZ3 4.36Å; S738-W741 VanDerWaalsContact O-CB 3.25Å; S738-W741 WeakPolarHBondContact O-CB 3.38Å; S738-W741 PolarHBondContact O-N 3.29Å; S738-W741 PolarHBondContact OG-N 2.87Å; S738-W741 VanDerWaalsContact OG-N 3.16Å; G739-W741 PolarHBondContact O-N 3.24Å; W741-M744 WeakPolarHBondContact O-CB 3.42Å; W741-M744 PolarHBondContact O-N 2.87Å; W741-Q745 HydrophobicContact CD2-CG 3.98Å; W741-Q745 HydrophobicContact CE3-CG 3.9Å; W741-Q745 HydrophobicContact CH2-CG 3.6Å; W741-Q745 HydrophobicContact CZ2-CG 3.68Å; W741-Q745 HydrophobicContact CZ3-CG 3.71Å; W741-Q745 WeakPolarHBondContact O-CG 3.42Å; W741-Q745 PolarHBondContact O-N 3.23Å
742	Y	95.9	Very high	94.2	Very high	16 Å²	16	44 Å²	44	6%	0.063	22%	0.216	C	C	.	.	H	α-helix	trans	-65.1	-43.6	176.1	-82.3	-80.1	0	0	0	112.7	A698 Q699 L702 W731 D733 N737 S738 G739 L740 M744 Q745 V746	A698-Y742 HydrophobicContact CB-CD1 4.05Å; A698-Y742 HydrophobicContact CB-CG 4.26Å; Q699-Y742 HydrophobicContact CG-CE1 4.46Å; Q699-Y742 PolarHBondContact NE2-OH 2.99Å; L702-Y742 HydrophobicContact CD1-CD1 3.91Å; L702-Y742 HydrophobicContact CD1-CE1 4.3Å; W731-Y742 HydrophobicContact CH2-CD2 4.25Å; W731-Y742 AromaticContact CH2-CE2 3.88Å; W731-Y742 HydrophobicContact CH2-CE2 3.88Å; W731-Y742 AromaticContact CZ3-CD2 3.7Å; W731-Y742 HydrophobicContact CZ3-CD2 3.7Å; W731-Y742 AromaticContact CZ3-CE2 3.69Å; W731-Y742 HydrophobicContact CZ3-CE2 3.69Å; D733-Y742 HydrophobicContact CB-CE2 4.28Å; D733-Y742 WeakPolarHBondContact OD2-CE2 3.46Å; D733-Y742 PolarHBondContact OD2-OH 3.4Å; N737-Y742 HydrophobicContact CB-CE2 4.29Å; S738-Y742 PolarHBondContact O-N 3.45Å; G739-Y742 WeakPolarHBondContact O-CB 3.39Å; G739-Y742 PolarHBondContact O-N 2.89Å; L740-Y742 VanDerWaalsContact C-N 3.33Å; L740-Y742 PolarHBondContact O-N 3.42Å; Y742-M744 PolarHBondContact O-N 2.85Å; Y742-Q745 PolarHBondContact O-N 3.12Å; Y742-Q745 VanDerWaalsContact O-N 3.14Å; Y742-V746 PolarHBondContact O-N 2.89Å
743	V	95.3	Very high	94	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-56.5	-44	174.5	176.7	0	0	0	0	110.2	F694 L717 V721 G739 L740 Q745 V746 V747 L766 L770	F694-V743 HydrophobicContact CE2-CG2 4.37Å; F694-V743 HydrophobicContact CZ-CG2 4.29Å; L717-V743 HydrophobicContact CB-CG2 4.46Å; V721-V743 HydrophobicContact CG2-CG1 4.3Å; V721-V743 HydrophobicContact CG2-CG2 3.97Å; G739-V743 PolarHBondContact O-N 3.28Å; G739-V743 VanDerWaalsContact O-N 3.08Å; L740-V743 PolarHBondContact O-N 2.85Å; V743-Q745 PolarHBondContact O-N 3.12Å; V743-V746 PolarHBondContact O-N 2.97Å; V743-V747 HydrophobicContact CG1-CG2 4.46Å; V743-V747 WeakPolarHBondContact O-CG2 3.27Å; V743-V747 PolarHBondContact O-N 3.06Å; V743-L766 HydrophobicContact CG1-CD1 4.1Å; V743-L770 HydrophobicContact CG1-CD1 4.36Å; V743-L770 HydrophobicContact CG1-CD2 4.28Å
744	M	92.6	Very high	93.9	Very high	16 Å²	16	50 Å²	50	8%	0.079	25%	0.245	C	C	.	.	H	α-helix	trans	-64.3	-39	176.7	-72.2	-59.8	-52.6	0	0	113.5	L740 W741 Y742 V746 V747 N748 L770 L778 Q781 I785	L740-M744 VanDerWaalsContact O-CG 3.27Å; L740-M744 WeakPolarHBondContact O-CG 3.16Å; L740-M744 PolarHBondContact O-N 3.46Å; W741-M744 WeakPolarHBondContact O-CB 3.42Å; W741-M744 PolarHBondContact O-N 2.87Å; Y742-M744 PolarHBondContact O-N 2.85Å; M744-V746 VanDerWaalsContact C-N 3.33Å; M744-V747 PolarHBondContact O-N 2.94Å; M744-N748 WeakPolarHBondContact O-CB 3.38Å; M744-N748 PolarHBondContact O-N 3.16Å; M744-N748 PolarHBondContact O-ND2 3.22Å; M744-L770 HydrophobicContact SD-CD2 3.75Å; M744-L778 HydrophobicContact SD-CD2 4Å; M744-Q781 HydrophobicContact CE-CB 4.04Å; M744-I785 HydrophobicContact CE-CD1 3.56Å; M744-I785 HydrophobicContact CE-CG1 3.62Å; M744-I785 HydrophobicContact SD-CD1 3.78Å; M744-I785 HydrophobicContact SD-CG1 4.45Å
745	Q	95.3	Very high	93.9	Very high	67 Å²	67	42.9 Å²	42.9	31%	0.313	21%	0.214	S	C	.	.	H	α-helix	trans	-62.7	-41.8	174.7	-66.3	-50.7	-55.8	0	0	111.5	L702 W741 Y742 V743 N748 Q749	L702-Q745 HydrophobicContact CD1-CB 4.14Å; L702-Q745 HydrophobicContact CD2-CB 3.8Å; W741-Q745 HydrophobicContact CD2-CG 3.98Å; W741-Q745 HydrophobicContact CE3-CG 3.9Å; W741-Q745 HydrophobicContact CH2-CG 3.6Å; W741-Q745 HydrophobicContact CZ2-CG 3.68Å; W741-Q745 HydrophobicContact CZ3-CG 3.71Å; W741-Q745 WeakPolarHBondContact O-CG 3.42Å; W741-Q745 PolarHBondContact O-N 3.23Å; Y742-Q745 PolarHBondContact O-N 3.12Å; Y742-Q745 VanDerWaalsContact O-N 3.14Å; V743-Q745 PolarHBondContact O-N 3.12Å; Q745-N748 PolarHBondContact O-N 2.83Å; Q745-Q749 PolarHBondContact O-N 3.49Å
746	V	96.6	Very high	93.9	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.8	-47.6	176.6	170.2	0	0	0	0	110.6	T701 L702 L717 Y742 V743 M744 N748 Q749 L750	T701-V746 HydrophobicContact CG2-CG1 3.7Å; T701-V746 HydrophobicContact CG2-CG2 4.02Å; L702-V746 HydrophobicContact CD1-CG2 4.46Å; L702-V746 HydrophobicContact CD2-CG2 3.72Å; L702-V746 HydrophobicContact CG-CG2 3.77Å; L717-V746 HydrophobicContact CD1-CB 3.91Å; L717-V746 HydrophobicContact CD1-CG1 3.97Å; L717-V746 HydrophobicContact CD1-CG2 3.68Å; Y742-V746 PolarHBondContact O-N 2.89Å; V743-V746 PolarHBondContact O-N 2.97Å; M744-V746 VanDerWaalsContact C-N 3.33Å; V746-N748 PolarHBondContact O-N 2.95Å; V746-Q749 PolarHBondContact O-N 3.5Å; V746-L750 HydrophobicContact CG1-CD1 3.75Å; V746-L750 HydrophobicContact CG1-CG 3.97Å; V746-L750 VanDerWaalsContact O-CG 3.32Å; V746-L750 WeakPolarHBondContact O-CG 3.28Å; V746-L750 PolarHBondContact O-N 2.87Å
747	V	96.1	Very high	93.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-53.7	-43.8	175.2	169.1	0	0	0	0	111.2	V743 M744 Q749 L750 L751 L766 V767 I785	V743-V747 HydrophobicContact CG1-CG2 4.46Å; V743-V747 WeakPolarHBondContact O-CG2 3.27Å; V743-V747 PolarHBondContact O-N 3.06Å; M744-V747 PolarHBondContact O-N 2.94Å; V747-Q749 PolarHBondContact O-N 3.11Å; V747-L750 PolarHBondContact O-N 3.5Å; V747-L751 HydrophobicContact CG1-CD1 3.72Å; V747-L751 WeakPolarHBondContact O-CB 3.38Å; V747-L751 WeakPolarHBondContact O-CG 3.29Å; V747-L751 PolarHBondContact O-N 3.3Å; V747-L766 HydrophobicContact CG2-CD2 3.6Å; V747-L766 HydrophobicContact CG2-CG 4Å; V747-V767 HydrophobicContact CG1-CG2 3.88Å; V747-V767 HydrophobicContact CG2-CG2 4.41Å; V747-I785 HydrophobicContact CG1-CG1 4.17Å; V747-I785 HydrophobicContact CG1-CG2 4.21Å
748	N	95	Very high	93.7	Very high	41 Å²	41	38 Å²	38	22%	0.219	19%	0.186	C	C	.	.	H	α-helix	trans	-65	-36	177.6	-71.6	-27.7	0	0	0	113.2	M744 Q745 V746 D752	M744-N748 WeakPolarHBondContact O-CB 3.38Å; M744-N748 PolarHBondContact O-N 3.16Å; M744-N748 PolarHBondContact O-ND2 3.22Å; Q745-N748 PolarHBondContact O-N 2.83Å; V746-N748 PolarHBondContact O-N 2.95Å; N748-D752 PolarHBondContact O-N 3.11Å
749	Q	95.5	Very high	93.7	Very high	38 Å²	38	36.8 Å²	36.8	18%	0.178	18%	0.178	C	C	.	.	H	α-helix	trans	-72.1	-42.8	176.4	-173.8	-174.1	17.7	0	0	111.8	T701 L702 Q745 V746 V747 L751 D752	T701-Q749 PolarHBondContact O-OE1 2.95Å; L702-Q749 VanDerWaalsContact CA-OE1 3.28Å; L702-Q749 PolarHBondContact O-NE2 3.02Å; Q745-Q749 PolarHBondContact O-N 3.49Å; V746-Q749 PolarHBondContact O-N 3.5Å; V747-Q749 PolarHBondContact O-N 3.11Å; Q749-L751 VanDerWaalsContact C-N 3.26Å; Q749-L751 PolarHBondContact O-N 3.39Å; Q749-D752 VanDerWaalsContact O-CB 3.29Å; Q749-D752 WeakPolarHBondContact O-CB 3.3Å; Q749-D752 PolarHBondContact O-N 3.2Å; Q749-D752 VanDerWaalsContact O-N 3.16Å
750	L	96	Very high	93.7	Very high	3 Å²	3	36.8 Å²	36.8	2%	0.016	18%	0.178	C	C	.	.	H	α-helix	trans	-64	-33.9	177.9	-64.3	179.3	0	0	0	111.6	M710 V746 V747 T759 V763 L766	M710-L750 HydrophobicContact CB-CD2 3.75Å; V746-L750 HydrophobicContact CG1-CD1 3.75Å; V746-L750 HydrophobicContact CG1-CG 3.97Å; V746-L750 VanDerWaalsContact O-CG 3.32Å; V746-L750 WeakPolarHBondContact O-CG 3.28Å; V746-L750 PolarHBondContact O-N 2.87Å; V747-L750 PolarHBondContact O-N 3.5Å; L750-T759 WeakPolarHBondContact CD2-O 3.36Å; L750-T759 PolarHBondContact O-OG1 3.03Å; L750-V763 HydrophobicContact CB-CB 4.17Å; L750-V763 HydrophobicContact CB-CG2 3.81Å; L750-V763 HydrophobicContact CD1-CB 4.25Å; L750-V763 HydrophobicContact CD1-CG2 3.94Å; L750-L766 HydrophobicContact CD1-CD2 4.5Å
751	L	96.3	Very high	93.8	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.005	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	5.8	176.4	-66.4	173.2	0	0	0	114.1	V747 Q749 P753 V763 I785 A788 I789 K792 L805	V747-L751 HydrophobicContact CG1-CD1 3.72Å; V747-L751 WeakPolarHBondContact O-CB 3.38Å; V747-L751 WeakPolarHBondContact O-CG 3.29Å; V747-L751 PolarHBondContact O-N 3.3Å; Q749-L751 VanDerWaalsContact C-N 3.26Å; Q749-L751 PolarHBondContact O-N 3.39Å; L751-P753 VanDerWaalsContact O-CD 3.3Å; L751-P753 WeakPolarHBondContact O-CD 3.5Å; L751-V763 HydrophobicContact CD2-CG1 3.59Å; L751-V763 HydrophobicContact CD2-CG2 4.28Å; L751-V763 HydrophobicContact CG-CG1 4.28Å; L751-V763 HydrophobicContact CG-CG2 4.07Å; L751-I785 HydrophobicContact CD1-CG2 4.04Å; L751-A788 HydrophobicContact CB-CB 3.89Å; L751-A788 HydrophobicContact CD1-CB 3.95Å; L751-I789 HydrophobicContact CD1-CG1 3.73Å; L751-I789 HydrophobicContact CD2-CG1 3.83Å; L751-I789 HydrophobicContact CG-CG1 4.46Å; L751-K792 HydrophobicContact CD2-CB 4.23Å; L751-K792 HydrophobicContact CD2-CG 4.38Å; L751-L805 HydrophobicContact CD2-CD2 3.49Å; L751-L805 VanDerWaalsContact CD2-CD2 3.49Å
752	D	94.6	Very high	93.7	Very high	26 Å²	26	35.2 Å²	35.2	14%	0.139	17%	0.174	C	C	.	.			trans	-66.8	119.3	-179.6	-170.3	-15.7	0	0	0	110.1	N748 Q749 R754 T755 K792	N748-D752 PolarHBondContact O-N 3.11Å; Q749-D752 VanDerWaalsContact O-CB 3.29Å; Q749-D752 WeakPolarHBondContact O-CB 3.3Å; Q749-D752 PolarHBondContact O-N 3.2Å; Q749-D752 VanDerWaalsContact O-N 3.16Å; D752-R754 PolarHBondContact O-N 2.79Å; D752-R754 VanDerWaalsContact O-N 3.11Å; D752-R754 VanDerWaalsContact OD1-CB 3.26Å; D752-R754 WeakPolarHBondContact OD1-CB 3.27Å; D752-R754 WeakPolarHBondContact OD1-CG 3.42Å; D752-R754 IonicContact OD1-CZ 3.7Å; D752-R754 PolarHBondContact OD1-N 2.73Å; D752-R754 IonicContact OD1-NE 2.86Å; D752-R754 PolarHBondContact OD1-NE 2.62Å; D752-R754 IonicContact OD1-NH2 3.68Å; D752-R754 IonicContact OD2-CZ 3.22Å; D752-R754 VanDerWaalsContact OD2-CZ 3.22Å; D752-R754 IonicContact OD2-NE 3.02Å; D752-R754 PolarHBondContact OD2-NE 3.11Å; D752-R754 IonicContact OD2-NH2 2.67Å; D752-R754 PolarHBondContact OD2-NH2 3.07Å; D752-T755 HydrophobicContact CB-CG2 4.12Å; D752-T755 PolarHBondContact O-N 3.07Å; D752-T755 PolarHBondContact O-OG1 2.8Å; D752-K792 PolarHBondContact O-NZ 3.29Å
753	P	91.4	Very high	93.7	Very high	65 Å²	65	34.6 Å²	34.6	42%	0.422	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-5.9	178.9	29.6	-36.6	0	0	0	113.4	L751 Q795	L751-P753 VanDerWaalsContact O-CD 3.3Å; L751-P753 WeakPolarHBondContact O-CD 3.5Å; P753-Q795 PolarHBondContact O-OE1 3.45Å
754	R	91.4	Very high	93.6	Very high	212 Å²	212	34.8 Å²	34.8	80%	0.8	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-19.6	176.6	-59.4	171.6	-67.8	-179.4	2.8	112.9	D752	D752-R754 PolarHBondContact O-N 2.79Å; D752-R754 VanDerWaalsContact O-N 3.11Å; D752-R754 VanDerWaalsContact OD1-CB 3.26Å; D752-R754 WeakPolarHBondContact OD1-CB 3.27Å; D752-R754 WeakPolarHBondContact OD1-CG 3.42Å; D752-R754 IonicContact OD1-CZ 3.7Å; D752-R754 PolarHBondContact OD1-N 2.73Å; D752-R754 IonicContact OD1-NE 2.86Å; D752-R754 PolarHBondContact OD1-NE 2.62Å; D752-R754 IonicContact OD1-NH2 3.68Å; D752-R754 IonicContact OD2-CZ 3.22Å; D752-R754 VanDerWaalsContact OD2-CZ 3.22Å; D752-R754 IonicContact OD2-NE 3.02Å; D752-R754 PolarHBondContact OD2-NE 3.11Å; D752-R754 IonicContact OD2-NH2 2.67Å; D752-R754 PolarHBondContact OD2-NH2 3.07Å
755	T	91.1	Very high	93.7	Very high	38 Å²	38	36.7 Å²	36.7	23%	0.233	18%	0.18	C	C	.	.	S	Bend	trans	-91.6	171.7	177.9	60.7	0	0	0	0	110.5	D752 T759 K792 Q795	D752-T755 HydrophobicContact CB-CG2 4.12Å; D752-T755 PolarHBondContact O-N 3.07Å; D752-T755 PolarHBondContact O-OG1 2.8Å; T755-T759 PolarHBondContact OG1-OG1 3.27Å; T755-K792 PolarHBondContact O-NZ 2.8Å; T755-K792 PolarHBondContact OG1-NZ 2.74Å; T755-Q795 PolarHBondContact O-NE2 3.37Å; T755-Q795 PolarHBondContact O-OE1 3.21Å
756	S	92.1	Very high	93.6	Very high	43 Å²	43	33.5 Å²	33.5	30%	0.301	17%	0.165	S	C	.	.			trans	-51.9	146.2	174.8	-178.5	0	0	0	0	111.7	H707 S758 T759 K792	H707-S756 WeakPolarHBondContact CE1-CB 3.37Å; H707-S756 PolarHBondContact CE1-OG 3.12Å; H707-S756 VanDerWaalsContact NE2-CB 3.29Å; H707-S756 WeakPolarHBondContact NE2-CB 3.5Å; S756-S758 WeakPolarHBondContact CB-OG 3.39Å; S756-S758 PolarHBondContact O-N 3.06Å; S756-S758 PolarHBondContact OG-N 3.38Å; S756-S758 PolarHBondContact OG-OG 3.22Å; S756-T759 PolarHBondContact O-N 3.28Å; S756-T759 PolarHBondContact O-OG1 3.44Å; S756-K792 PolarHBondContact O-NZ 3.29Å
757	E	92.2	Very high	93.5	Very high	56 Å²	56	33.5 Å²	33.5	26%	0.262	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-59.7	-29.4	172.9	65.2	173.2	-174.7	0	0	112	T759 A760 A796 E797 A798 V801	E757-T759 PolarHBondContact O-N 3.19Å; E757-T759 VanDerWaalsContact O-N 3.08Å; E757-A760 PolarHBondContact O-N 3.37Å; E757-A796 HydrophobicContact CB-CB 4.35Å; E757-A796 VanDerWaalsContact OE2-CA 3.27Å; E757-A796 WeakPolarHBondContact OE2-CA 3.4Å; E757-E797 PolarHBondContact OE2-N 3Å; E757-A798 WeakPolarHBondContact OE1-CB 3.33Å; E757-A798 PolarHBondContact OE2-N 3.36Å; E757-V801 WeakPolarHBondContact O-CG2 3.47Å
758	S	90.8	Very high	93.3	Very high	27 Å²	27	34.3 Å²	34.3	19%	0.189	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-61	-21.5	-178	60.6	0	0	0	0	113.4	H707 Q711 S756 A760 V761	H707-S758 PolarHBondContact ND1-OG 2.92Å; Q711-S758 PolarHBondContact NE2-O 3.15Å; S756-S758 WeakPolarHBondContact CB-OG 3.39Å; S756-S758 PolarHBondContact O-N 3.06Å; S756-S758 PolarHBondContact OG-N 3.38Å; S756-S758 PolarHBondContact OG-OG 3.22Å; S758-A760 PolarHBondContact O-N 3.18Å; S758-A760 VanDerWaalsContact O-N 3.15Å; S758-V761 VanDerWaalsContact O-CG2 3.23Å; S758-V761 WeakPolarHBondContact O-CG2 3.47Å; S758-V761 PolarHBondContact O-N 3.17Å
759	T	92.9	Very high	93.2	Very high	1 Å²	1	33 Å²	33	1%	0.006	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-62.6	-21.8	175.3	63.2	0	0	0	0	112.5	M710 L750 T755 S756 E757 K792	M710-T759 HydrophobicContact SD-CG2 3.69Å; L750-T759 WeakPolarHBondContact CD2-O 3.36Å; L750-T759 PolarHBondContact O-OG1 3.03Å; T755-T759 PolarHBondContact OG1-OG1 3.27Å; S756-T759 PolarHBondContact O-N 3.28Å; S756-T759 PolarHBondContact O-OG1 3.44Å; E757-T759 PolarHBondContact O-N 3.19Å; E757-T759 VanDerWaalsContact O-N 3.08Å; T759-K792 PolarHBondContact OG1-NZ 3.5Å
760	A	93.3	Very high	93	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-100.6	11.7	-176.9	0	0	0	0	0	114.1	E757 S758 F762 V763 K792 V801 S804 L805	E757-A760 PolarHBondContact O-N 3.37Å; S758-A760 PolarHBondContact O-N 3.18Å; S758-A760 VanDerWaalsContact O-N 3.15Å; A760-F762 VanDerWaalsContact C-N 3.34Å; A760-F762 PolarHBondContact O-N 2.59Å; A760-V763 HydrophobicContact CB-CG1 3.75Å; A760-K792 HydrophobicContact CB-CD 4.44Å; A760-K792 HydrophobicContact CB-CG 3.82Å; A760-V801 HydrophobicContact CB-CG1 3.8Å; A760-S804 PolarHBondContact O-OG 3.31Å; A760-L805 HydrophobicContact CB-CD2 4.23Å
761	V	92.3	Very high	92.6	Very high	23 Å²	23	32.2 Å²	32.2	14%	0.139	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-43.3	-179.6	173.7	0	0	0	0	112	S758 V801 S804	S758-V761 VanDerWaalsContact O-CG2 3.23Å; S758-V761 WeakPolarHBondContact O-CG2 3.47Å; S758-V761 PolarHBondContact O-N 3.17Å; V761-V801 HydrophobicContact CG2-CG2 3.65Å; V761-S804 WeakPolarHBondContact O-CB 3.45Å; V761-S804 PolarHBondContact O-OG 3.25Å
762	F	92.1	Very high	92.1	Very high	67 Å²	67	37 Å²	37	29%	0.294	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-1.4	-177.4	-54.9	-63.4	0	0	0	114.7	Q711 E715 A760 G764 R765	Q711-F762 HydrophobicContact CB-CD2 3.95Å; Q711-F762 HydrophobicContact CB-CE2 4.3Å; Q711-F762 HydrophobicContact CG-CD2 4.1Å; Q711-F762 HydrophobicContact CG-CE2 4.42Å; E715-F762 HydrophobicContact CG-CB 4Å; E715-F762 HydrophobicContact CG-CG 4.36Å; A760-F762 VanDerWaalsContact C-N 3.34Å; A760-F762 PolarHBondContact O-N 2.59Å; F762-G764 PolarHBondContact O-N 2.98Å; F762-R765 PolarHBondContact O-N 2.91Å
763	V	95.2	Very high	91.7	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.018	21%	0.211	C	C	.	.	H	α-helix	trans	-60.8	-26.8	-173.7	73	0	0	0	0	112.9	L750 L751 A760 R765 L766 V767 L805	L750-V763 HydrophobicContact CB-CB 4.17Å; L750-V763 HydrophobicContact CB-CG2 3.81Å; L750-V763 HydrophobicContact CD1-CB 4.25Å; L750-V763 HydrophobicContact CD1-CG2 3.94Å; L751-V763 HydrophobicContact CD2-CG1 3.59Å; L751-V763 HydrophobicContact CD2-CG2 4.28Å; L751-V763 HydrophobicContact CG-CG1 4.28Å; L751-V763 HydrophobicContact CG-CG2 4.07Å; A760-V763 HydrophobicContact CB-CG1 3.75Å; V763-R765 VanDerWaalsContact C-N 3.3Å; V763-R765 PolarHBondContact O-N 3.48Å; V763-L766 PolarHBondContact O-N 3.41Å; V763-V767 HydrophobicContact CG2-CG2 4.22Å; V763-V767 WeakPolarHBondContact O-CG2 3.44Å; V763-V767 PolarHBondContact O-N 3.33Å; V763-L805 HydrophobicContact CG1-CD2 3.81Å
764	G	93.3	Very high	91.2	Very high	3 Å²	3	39.1 Å²	39.1	3%	0.031	19%	0.194	C	C	.	.	H	α-helix	trans	-57.9	-39.7	174.9	0	0	0	0	0	113.4	F762 S768 S804	F762-G764 PolarHBondContact O-N 2.98Å; G764-S768 VanDerWaalsContact O-CB 3.28Å; G764-S768 WeakPolarHBondContact O-CB 3.34Å; G764-S768 PolarHBondContact O-N 3.14Å; G764-S768 PolarHBondContact O-OG 2.96Å; G764-S804 VanDerWaalsContact CA-O 3.28Å; G764-S804 WeakPolarHBondContact CA-O 3.35Å; G764-S804 PolarHBondContact N-OG 3.43Å; G764-S804 VanDerWaalsContact N-OG 3.11Å
765	R	93.7	Very high	90.3	Very high	56 Å²	56	30.9 Å²	30.9	21%	0.211	17%	0.174	C	C	.	.	H	α-helix	trans	-65.6	-48.2	176.2	-65.3	-175.6	174.2	156.3	3.5	110.5	R718 F762 V763 V767 S768 T769 E855 E989	R718-R765 VanDerWaalsContact CD-C 3.48Å; F762-R765 PolarHBondContact O-N 2.91Å; V763-R765 VanDerWaalsContact C-N 3.3Å; V763-R765 PolarHBondContact O-N 3.48Å; R765-V767 PolarHBondContact O-N 3.01Å; R765-S768 PolarHBondContact O-N 2.96Å; R765-T769 WeakPolarHBondContact O-CB 3.45Å; R765-T769 PolarHBondContact O-N 2.9Å; R765-T769 PolarHBondContact O-OG1 3.37Å; R765-T769 VanDerWaalsContact O-OG1 3.05Å; R765-E855 IonicContact CZ-OE1 2.62Å; R765-E855 IonicContact NE-OE1 3.68Å; R765-E855 PolarHBondContact NE-OE1 3.4Å; R765-E855 IonicContact NH2-OE1 3.57Å; R765-E855 PolarHBondContact NH2-OE1 3.32Å; R765-E989 IonicContact CZ-OE1 3.11Å; R765-E989 VanDerWaalsContact NH2-CD 3.31Å; R765-E989 IonicContact NH2-OE1 3.19Å; R765-E989 PolarHBondContact NH2-OE1 3.36Å
766	L	94.8	Very high	89.2	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-57.7	-47.4	177	174.5	59.5	0	0	0	112.2	R718 V743 V747 L750 V763 T769 L770	R718-L766 HydrophobicContact CB-CB 4.27Å; R718-L766 HydrophobicContact CB-CD1 3.77Å; R718-L766 HydrophobicContact CG-CD1 4.42Å; V743-L766 HydrophobicContact CG1-CD1 4.1Å; V747-L766 HydrophobicContact CG2-CD2 3.6Å; V747-L766 HydrophobicContact CG2-CG 4Å; L750-L766 HydrophobicContact CD1-CD2 4.5Å; V763-L766 PolarHBondContact O-N 3.41Å; L766-T769 PolarHBondContact O-N 2.79Å; L766-L770 VanDerWaalsContact O-CB 3.28Å; L766-L770 WeakPolarHBondContact O-CB 3.31Å; L766-L770 PolarHBondContact O-N 3.2Å
767	V	94	Very high	88.1	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.5	-44.5	179.1	172.6	0	0	0	0	111	V747 V763 R765 T769 L770 I771 I785 I789 V808	V747-V767 HydrophobicContact CG1-CG2 3.88Å; V747-V767 HydrophobicContact CG2-CG2 4.41Å; V763-V767 HydrophobicContact CG2-CG2 4.22Å; V763-V767 WeakPolarHBondContact O-CG2 3.44Å; V763-V767 PolarHBondContact O-N 3.33Å; R765-V767 PolarHBondContact O-N 3.01Å; V767-T769 PolarHBondContact O-N 3.49Å; V767-L770 PolarHBondContact O-N 3.44Å; V767-I771 HydrophobicContact CG1-CD1 3.71Å; V767-I771 HydrophobicContact CG1-CG1 4.33Å; V767-I771 VanDerWaalsContact O-CG1 3.28Å; V767-I771 WeakPolarHBondContact O-CG1 3.22Å; V767-I771 PolarHBondContact O-N 3.19Å; V767-I785 HydrophobicContact CG1-CG2 3.75Å; V767-I785 HydrophobicContact CG2-CG2 3.88Å; V767-I789 HydrophobicContact CG1-CD1 4.21Å; V767-V808 HydrophobicContact CB-CG2 4.14Å; V767-V808 HydrophobicContact CG1-CG1 3.71Å; V767-V808 HydrophobicContact CG1-CG2 4.13Å
768	S	92.2	Very high	87.1	Confident	17 Å²	17	38.3 Å²	38.3	12%	0.119	21%	0.212	C	C	.	.	H	α-helix	trans	-62.5	-43.8	179.3	-58.2	0	0	0	0	111.6	G764 R765 I771 S772	G764-S768 VanDerWaalsContact O-CB 3.28Å; G764-S768 WeakPolarHBondContact O-CB 3.34Å; G764-S768 PolarHBondContact O-N 3.14Å; G764-S768 PolarHBondContact O-OG 2.96Å; R765-S768 PolarHBondContact O-N 2.96Å; S768-I771 PolarHBondContact O-N 3.38Å; S768-S772 WeakPolarHBondContact O-CB 3.24Å; S768-S772 PolarHBondContact O-N 3.35Å
769	T	92	Very high	86.3	Confident	15 Å²	15	39.2 Å²	39.2	9%	0.092	23%	0.226	C	C	.	.	H	α-helix	trans	-62.5	-42.4	173.6	-59.4	0	0	0	0	111.6	R718 V721 R765 L766 V767 S772 R773	R718-T769 HydrophobicContact CG-CG2 4.13Å; V721-T769 HydrophobicContact CG1-CG2 4.25Å; R765-T769 WeakPolarHBondContact O-CB 3.45Å; R765-T769 PolarHBondContact O-N 2.9Å; R765-T769 PolarHBondContact O-OG1 3.37Å; R765-T769 VanDerWaalsContact O-OG1 3.05Å; L766-T769 PolarHBondContact O-N 2.79Å; V767-T769 PolarHBondContact O-N 3.49Å; T769-S772 PolarHBondContact O-N 3.24Å; T769-R773 HydrophobicContact CG2-CG 4.09Å; T769-R773 WeakPolarHBondContact O-CB 3.45Å; T769-R773 VanDerWaalsContact O-CG 3.27Å; T769-R773 WeakPolarHBondContact O-CG 3.38Å; T769-R773 PolarHBondContact O-N 3.37Å
770	L	90.6	Very high	85.5	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.016	27%	0.265	C	S	.	.	H	α-helix	trans	-63.1	-44.2	179.3	-172.1	64.5	0	0	0	111.4	V721 L740 V743 M744 L766 V767 A774 L778	V721-L770 HydrophobicContact CG1-CD1 4.06Å; V721-L770 HydrophobicContact CG2-CD1 4.47Å; L740-L770 HydrophobicContact CD2-CD1 3.91Å; V743-L770 HydrophobicContact CG1-CD1 4.36Å; V743-L770 HydrophobicContact CG1-CD2 4.28Å; M744-L770 HydrophobicContact SD-CD2 3.75Å; L766-L770 VanDerWaalsContact O-CB 3.28Å; L766-L770 WeakPolarHBondContact O-CB 3.31Å; L766-L770 PolarHBondContact O-N 3.2Å; V767-L770 PolarHBondContact O-N 3.44Å; L770-A774 HydrophobicContact CD1-CB 4.15Å; L770-A774 VanDerWaalsContact O-CB 3.28Å; L770-A774 WeakPolarHBondContact O-CB 3.5Å; L770-A774 PolarHBondContact O-N 3.25Å; L770-L778 HydrophobicContact CD2-CD2 3.84Å; L770-L778 HydrophobicContact CG-CD1 4.2Å; L770-L778 HydrophobicContact CG-CD2 4Å
771	I	88.6	Confident	85	Confident	20 Å²	20	50.8 Å²	50.8	10%	0.103	29%	0.285	C	S	.	.	H	α-helix	trans	-61.5	-47.1	175.2	-68	168.1	0	0	0	110.6	V767 S768 R773 G775 L778 L782 V808 L812	V767-I771 HydrophobicContact CG1-CD1 3.71Å; V767-I771 HydrophobicContact CG1-CG1 4.33Å; V767-I771 VanDerWaalsContact O-CG1 3.28Å; V767-I771 WeakPolarHBondContact O-CG1 3.22Å; V767-I771 PolarHBondContact O-N 3.19Å; S768-I771 PolarHBondContact O-N 3.38Å; I771-R773 PolarHBondContact O-N 2.89Å; I771-G775 VanDerWaalsContact O-CA 3.29Å; I771-G775 WeakPolarHBondContact O-CA 3.47Å; I771-G775 PolarHBondContact O-N 3.37Å; I771-G775 VanDerWaalsContact O-N 3.1Å; I771-L778 HydrophobicContact CG1-CD1 4.49Å; I771-L782 HydrophobicContact CD1-CD1 3.61Å; I771-L782 HydrophobicContact CG1-CD1 3.73Å; I771-V808 HydrophobicContact CD1-CG1 4.14Å; I771-L812 HydrophobicContact CD1-CD1 4.39Å; I771-L812 HydrophobicContact CD1-CD2 4.28Å; I771-L812 HydrophobicContact CD1-CG 4.45Å; I771-L812 HydrophobicContact CG2-CD2 3.97Å
772	S	86.6	Confident	84.6	Confident	101 Å²	101	50.9 Å²	50.9	71%	0.706	29%	0.285	S	S	*	.	H	α-helix	trans	-63.5	-40.4	-178.6	-179.5	0	0	0	0	112.7	S768 T769	S768-S772 WeakPolarHBondContact O-CB 3.24Å; S768-S772 PolarHBondContact O-N 3.35Å; T769-S772 PolarHBondContact O-N 3.24Å
773	R	86.2	Confident	84.4	Confident	129 Å²	129	51 Å²	51	49%	0.487	29%	0.289	S	S	.	.	H	α-helix	trans	-91.6	-47.1	-173.5	-59.2	-72.1	-85.9	167.1	-5.4	113.2	V721 S722 L725 T769 I771	V721-R773 HydrophobicContact CG1-CB 4.35Å; S722-R773 VanDerWaalsContact O-CZ 3.3Å; S722-R773 PolarHBondContact O-NE 3.42Å; S722-R773 PolarHBondContact O-NH2 3.29Å; L725-R773 VanDerWaalsContact CD2-C 3.47Å; L725-R773 HydrophobicContact CD2-CB 3.86Å; L725-R773 WeakPolarHBondContact CD2-O 3.3Å; T769-R773 HydrophobicContact CG2-CG 4.09Å; T769-R773 WeakPolarHBondContact O-CB 3.45Å; T769-R773 VanDerWaalsContact O-CG 3.27Å; T769-R773 WeakPolarHBondContact O-CG 3.38Å; T769-R773 PolarHBondContact O-N 3.37Å; I771-R773 PolarHBondContact O-N 2.89Å
774	A	80.2	Confident	84.1	Confident	8 Å²	8	55.6 Å²	55.6	7%	0.066	31%	0.309	C	S	.	.	H	α-helix	trans	-86.5	-25.8	-176.3	0	0	0	0	0	112.9	L725 L770 T776 E777 L778	L725-A774 HydrophobicContact CD1-CB 4.43Å; L725-A774 HydrophobicContact CD2-CB 4.43Å; L770-A774 HydrophobicContact CD1-CB 4.15Å; L770-A774 VanDerWaalsContact O-CB 3.28Å; L770-A774 WeakPolarHBondContact O-CB 3.5Å; L770-A774 PolarHBondContact O-N 3.25Å; A774-T776 PolarHBondContact O-N 3.24Å; A774-T776 VanDerWaalsContact O-N 3.08Å; A774-E777 WeakPolarHBondContact O-CB 3.33Å; A774-E777 PolarHBondContact O-N 3.48Å; A774-L778 HydrophobicContact CB-CD1 4.04Å; A774-L778 HydrophobicContact CB-CG 4.25Å
775	G	71.9	Confident	84	Confident	38 Å²	38	55.5 Å²	55.5	39%	0.392	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	46.7	-113.6	171.8	0	0	0	0	0	113.9	I771 E777 L778	I771-G775 VanDerWaalsContact O-CA 3.29Å; I771-G775 WeakPolarHBondContact O-CA 3.47Å; I771-G775 PolarHBondContact O-N 3.37Å; I771-G775 VanDerWaalsContact O-N 3.1Å; G775-E777 PolarHBondContact O-N 2.84Å; G775-L778 WeakPolarHBondContact O-CB 3.48Å; G775-L778 PolarHBondContact O-N 3.28Å
776	T	67.4	Low	83.9	Confident	142 Å²	142	53 Å²	53	87%	0.871	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-65.7	-18.3	-177.7	51.1	0	0	0	0	115	A774 L778 G779	A774-T776 PolarHBondContact O-N 3.24Å; A774-T776 VanDerWaalsContact O-N 3.08Å; T776-L778 PolarHBondContact O-N 2.97Å; T776-G779 PolarHBondContact O-N 3.4Å
777	E	69.9	Low	83.8	Confident	133 Å²	133	58.8 Å²	58.8	62%	0.621	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-70.2	-19.3	177.4	-63.6	-167.2	165.2	0	0	112.7	A774 G775	A774-E777 WeakPolarHBondContact O-CB 3.33Å; A774-E777 PolarHBondContact O-N 3.48Å; G775-E777 PolarHBondContact O-N 2.84Å
778	L	71.6	Confident	83.8	Confident	18 Å²	18	59.6 Å²	59.6	9%	0.094	33%	0.328	C	S	.	.	S	Bend	trans	-72.2	-36.1	174.6	-75.6	146.5	0	0	0	112.1	M744 L770 I771 A774 G775 T776 D780 Q781 I785	M744-L778 HydrophobicContact SD-CD2 4Å; L770-L778 HydrophobicContact CD2-CD2 3.84Å; L770-L778 HydrophobicContact CG-CD1 4.2Å; L770-L778 HydrophobicContact CG-CD2 4Å; I771-L778 HydrophobicContact CG1-CD1 4.49Å; A774-L778 HydrophobicContact CB-CD1 4.04Å; A774-L778 HydrophobicContact CB-CG 4.25Å; G775-L778 WeakPolarHBondContact O-CB 3.48Å; G775-L778 PolarHBondContact O-N 3.28Å; T776-L778 PolarHBondContact O-N 2.97Å; L778-D780 PolarHBondContact O-N 3.35Å; L778-Q781 HydrophobicContact CD2-CB 4.45Å; L778-Q781 WeakPolarHBondContact O-CB 3.39Å; L778-Q781 WeakPolarHBondContact O-CG 3.46Å; L778-Q781 PolarHBondContact O-N 3.31Å; L778-I785 HydrophobicContact CD2-CD1 4.2Å
779	G	73.3	Confident	83.9	Confident	47 Å²	47	58.9 Å²	58.9	49%	0.485	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.1	-125	-178.9	0	0	0	0	0	112.9	T776 Q781 L782	T776-G779 PolarHBondContact O-N 3.4Å; G779-Q781 PolarHBondContact O-N 3.08Å; G779-Q781 VanDerWaalsContact O-N 3.13Å; G779-L782 PolarHBondContact O-N 3.03Å
780	D	76.8	Confident	84	Confident	152 Å²	152	59 Å²	59	81%	0.813	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-13.2	179.9	-59.5	-26	0	0	0	114.4	L778 L782	L778-D780 PolarHBondContact O-N 3.35Å; D780-L782 VanDerWaalsContact C-N 3.32Å
781	Q	81.6	Confident	84.2	Confident	91 Å²	91	61.4 Å²	61.4	43%	0.425	34%	0.34	S	S	.	.	H	α-helix	trans	-72.5	-25.3	179	-61.5	-67	-37.2	0	0	112.5	M744 L778 G779 H784 I785	M744-Q781 HydrophobicContact CE-CB 4.04Å; L778-Q781 HydrophobicContact CD2-CB 4.45Å; L778-Q781 WeakPolarHBondContact O-CB 3.39Å; L778-Q781 WeakPolarHBondContact O-CG 3.46Å; L778-Q781 PolarHBondContact O-N 3.31Å; G779-Q781 PolarHBondContact O-N 3.08Å; G779-Q781 VanDerWaalsContact O-N 3.13Å; Q781-H784 WeakPolarHBondContact O-CB 3.45Å; Q781-H784 PolarHBondContact O-N 2.96Å; Q781-I785 WeakPolarHBondContact O-CG1 3.48Å; Q781-I785 PolarHBondContact O-N 3.39Å
782	L	84.9	Confident	84.5	Confident	26 Å²	26	60.5 Å²	60.5	14%	0.136	34%	0.335	C	S	.	.	H	α-helix	trans	-60.4	-49.7	178.1	179.3	58.6	0	0	0	110.9	I771 G779 D780 H784 I785 L786	I771-L782 HydrophobicContact CD1-CD1 3.61Å; I771-L782 HydrophobicContact CG1-CD1 3.73Å; G779-L782 PolarHBondContact O-N 3.03Å; D780-L782 VanDerWaalsContact C-N 3.32Å; L782-H784 PolarHBondContact O-N 3.4Å; L782-I785 PolarHBondContact O-N 3.13Å; L782-I785 VanDerWaalsContact O-N 3.12Å; L782-L786 HydrophobicContact CD1-CD1 4.43Å; L782-L786 HydrophobicContact CD1-CG 4.28Å; L782-L786 HydrophobicContact CG-CD1 4.29Å; L782-L786 WeakPolarHBondContact O-CG 3.24Å; L782-L786 PolarHBondContact O-N 3.43Å
783	D	87.6	Confident	84.9	Confident	70 Å²	70	55.8 Å²	55.8	37%	0.374	30%	0.302	S	S	.	.	H	α-helix	trans	-58.1	-34.5	177	-77.4	21.5	0	0	0	112.3	R787 F823	D783-R787 VanDerWaalsContact O-CG 3.24Å; D783-R787 WeakPolarHBondContact O-CG 3.5Å; D783-R787 PolarHBondContact O-N 3.09Å; D783-F823 HydrophobicContact CB-CD2 4.49Å; D783-F823 HydrophobicContact CB-CE2 3.77Å
784	H	89	Confident	85.1	Confident	98 Å²	98	55.6 Å²	55.6	45%	0.454	31%	0.306	S	S	.	.	H	α-helix	trans	-68.7	-44.5	177.1	-166.3	61.1	0	0	0	111.7	Q781 L782 R787 A788	Q781-H784 WeakPolarHBondContact O-CB 3.45Å; Q781-H784 PolarHBondContact O-N 2.96Å; L782-H784 PolarHBondContact O-N 3.4Å; H784-R787 PolarHBondContact O-N 3.5Å; H784-A788 PolarHBondContact O-N 3.23Å
785	I	91.6	Very high	85.7	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-61.4	-47.4	176.2	-65.3	160.5	0	0	0	110.5	M744 V747 L751 V767 L778 Q781 L782 R787 A788 I789	M744-I785 HydrophobicContact CE-CD1 3.56Å; M744-I785 HydrophobicContact CE-CG1 3.62Å; M744-I785 HydrophobicContact SD-CD1 3.78Å; M744-I785 HydrophobicContact SD-CG1 4.45Å; V747-I785 HydrophobicContact CG1-CG1 4.17Å; V747-I785 HydrophobicContact CG1-CG2 4.21Å; L751-I785 HydrophobicContact CD1-CG2 4.04Å; V767-I785 HydrophobicContact CG1-CG2 3.75Å; V767-I785 HydrophobicContact CG2-CG2 3.88Å; L778-I785 HydrophobicContact CD2-CD1 4.2Å; Q781-I785 WeakPolarHBondContact O-CG1 3.48Å; Q781-I785 PolarHBondContact O-N 3.39Å; L782-I785 PolarHBondContact O-N 3.13Å; L782-I785 VanDerWaalsContact O-N 3.12Å; I785-R787 VanDerWaalsContact C-N 3.27Å; I785-R787 PolarHBondContact O-N 2.99Å; I785-A788 CarbonylContact O-C 3.54Å; I785-A788 WeakPolarHBondContact O-CA 3.32Å; I785-A788 WeakPolarHBondContact O-CB 3.45Å; I785-A788 PolarHBondContact O-N 3.38Å; I785-I789 HydrophobicContact CG2-CD1 3.89Å; I785-I789 HydrophobicContact CG2-CG1 4.29Å; I785-I789 WeakPolarHBondContact O-CG1 3.38Å; I785-I789 PolarHBondContact O-N 3.11Å
786	L	91.8	Very high	86.7	Confident	5 Å²	5	56.8 Å²	56.8	3%	0.026	30%	0.302	C	S	.	.	H	α-helix	trans	-62.4	-35.5	-178.6	-63.1	-178.9	0	0	0	111.9	L782 I789 L790 V808 F809 L812 F823	L782-L786 HydrophobicContact CD1-CD1 4.43Å; L782-L786 HydrophobicContact CD1-CG 4.28Å; L782-L786 HydrophobicContact CG-CD1 4.29Å; L782-L786 WeakPolarHBondContact O-CG 3.24Å; L782-L786 PolarHBondContact O-N 3.43Å; L786-I789 HydrophobicContact CD2-CD1 4.31Å; L786-I789 PolarHBondContact O-N 3.4Å; L786-L790 VanDerWaalsContact O-CG 3.29Å; L786-L790 WeakPolarHBondContact O-CG 3.28Å; L786-L790 PolarHBondContact O-N 3Å; L786-V808 HydrophobicContact CD2-CG1 4.14Å; L786-F809 HydrophobicContact CD2-CD1 4.42Å; L786-F809 HydrophobicContact CD2-CE1 3.87Å; L786-L812 HydrophobicContact CD1-CD1 4.18Å; L786-L812 HydrophobicContact CD2-CD1 3.82Å; L786-F823 HydrophobicContact CB-CD1 4.45Å; L786-F823 HydrophobicContact CB-CE1 3.45Å; L786-F823 VanDerWaalsContact CB-CE1 3.45Å; L786-F823 HydrophobicContact CB-CZ 3.53Å; L786-F823 HydrophobicContact CD1-CD1 3.83Å; L786-F823 HydrophobicContact CD1-CE1 3.63Å; L786-F823 HydrophobicContact CD1-CG 4.41Å; L786-F823 HydrophobicContact CD1-CZ 4.04Å; L786-F823 HydrophobicContact CG-CE1 4.2Å; L786-F823 HydrophobicContact CG-CZ 4.42Å
787	R	92	Very high	88	Confident	120 Å²	120	58 Å²	58	45%	0.453	30%	0.297	S	S	.	.	H	α-helix	trans	-66.6	-38	171.9	-71.1	170.8	-167	-134.9	8.2	112.7	D783 H784 I785 L790 S791 F823 L827	D783-R787 VanDerWaalsContact O-CG 3.24Å; D783-R787 WeakPolarHBondContact O-CG 3.5Å; D783-R787 PolarHBondContact O-N 3.09Å; H784-R787 PolarHBondContact O-N 3.5Å; I785-R787 VanDerWaalsContact C-N 3.27Å; I785-R787 PolarHBondContact O-N 2.99Å; R787-L790 PolarHBondContact O-N 3Å; R787-S791 PolarHBondContact O-N 2.88Å; R787-S791 PolarHBondContact O-OG 3.46Å; R787-F823 HydrophobicContact CG-CZ 4.25Å; R787-L827 HydrophobicContact CG-CD1 3.91Å; R787-L827 VanDerWaalsContact CZ-CD2 3.46Å
788	A	93.6	Very high	89.2	Confident	18 Å²	18	53.1 Å²	53.1	15%	0.149	28%	0.28	C	S	.	.	H	α-helix	trans	-65.8	-42.4	175.4	0	0	0	0	0	111.1	L751 H784 I785 L790 S791 K792	L751-A788 HydrophobicContact CB-CB 3.89Å; L751-A788 HydrophobicContact CD1-CB 3.95Å; H784-A788 PolarHBondContact O-N 3.23Å; I785-A788 CarbonylContact O-C 3.54Å; I785-A788 WeakPolarHBondContact O-CA 3.32Å; I785-A788 WeakPolarHBondContact O-CB 3.45Å; I785-A788 PolarHBondContact O-N 3.38Å; A788-L790 PolarHBondContact O-N 3.26Å; A788-S791 WeakPolarHBondContact O-CB 3.37Å; A788-S791 PolarHBondContact O-N 3.12Å; A788-K792 WeakPolarHBondContact O-CB 3.46Å; A788-K792 PolarHBondContact O-N 3.31Å
789	I	95.2	Very high	90.3	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-57.1	-50.6	172.8	-70.3	172.5	0	0	0	111	L751 V767 I785 L786 S791 K792 M793 L805 V808 F809	L751-I789 HydrophobicContact CD1-CG1 3.73Å; L751-I789 HydrophobicContact CD2-CG1 3.83Å; L751-I789 HydrophobicContact CG-CG1 4.46Å; V767-I789 HydrophobicContact CG1-CD1 4.21Å; I785-I789 HydrophobicContact CG2-CD1 3.89Å; I785-I789 HydrophobicContact CG2-CG1 4.29Å; I785-I789 WeakPolarHBondContact O-CG1 3.38Å; I785-I789 PolarHBondContact O-N 3.11Å; L786-I789 HydrophobicContact CD2-CD1 4.31Å; L786-I789 PolarHBondContact O-N 3.4Å; I789-S791 PolarHBondContact O-N 2.94Å; I789-K792 PolarHBondContact O-N 2.85Å; I789-K792 VanDerWaalsContact O-N 3.11Å; I789-M793 HydrophobicContact CG2-CG 4.28Å; I789-M793 HydrophobicContact CG2-SD 4Å; I789-M793 WeakPolarHBondContact O-CB 3.18Å; I789-M793 WeakPolarHBondContact O-CG 3.32Å; I789-M793 PolarHBondContact O-N 3.44Å; I789-L805 HydrophobicContact CG1-CD2 4.25Å; I789-L805 HydrophobicContact CG2-CB 4.07Å; I789-L805 HydrophobicContact CG2-CD2 4.14Å; I789-V808 HydrophobicContact CD1-CB 3.98Å; I789-V808 HydrophobicContact CD1-CG1 3.77Å; I789-V808 HydrophobicContact CD1-CG2 3.88Å; I789-F809 HydrophobicContact CB-CZ 4.45Å; I789-F809 HydrophobicContact CG2-CE2 3.6Å; I789-F809 HydrophobicContact CG2-CZ 3.75Å
790	L	94.5	Very high	91.3	Very high	18 Å²	18	54.4 Å²	54.4	9%	0.094	28%	0.278	C	S	.	.	H	α-helix	trans	-58.1	-39.4	177.6	-70.5	170	0	0	0	112.1	L786 R787 A788 Q794 F809 L824 A835 F838 V839	L786-L790 VanDerWaalsContact O-CG 3.29Å; L786-L790 WeakPolarHBondContact O-CG 3.28Å; L786-L790 PolarHBondContact O-N 3Å; R787-L790 PolarHBondContact O-N 3Å; A788-L790 PolarHBondContact O-N 3.26Å; L790-Q794 PolarHBondContact O-N 3.26Å; L790-F809 HydrophobicContact CD2-CE2 4.4Å; L790-F809 HydrophobicContact CD2-CZ 3.97Å; L790-F809 HydrophobicContact CG-CZ 4.17Å; L790-L824 HydrophobicContact CD1-CD2 4.26Å; L790-L824 HydrophobicContact CD2-CD2 4.36Å; L790-A835 HydrophobicContact CD1-CB 3.87Å; L790-A835 HydrophobicContact CD2-CB 4.37Å; L790-F838 HydrophobicContact CD2-CD1 4.05Å; L790-F838 HydrophobicContact CD2-CE1 4.41Å; L790-V839 HydrophobicContact CD2-CG2 3.4Å; L790-V839 VanDerWaalsContact CD2-CG2 3.4Å
791	S	93.5	Very high	92.2	Very high	54 Å²	54	47.2 Å²	47.2	38%	0.378	24%	0.24	S	C	.	.	H	α-helix	trans	-68	-38.9	177.3	-55.4	0	0	0	0	111.7	R787 A788 I789 Q794	R787-S791 PolarHBondContact O-N 2.88Å; R787-S791 PolarHBondContact O-OG 3.46Å; A788-S791 WeakPolarHBondContact O-CB 3.37Å; A788-S791 PolarHBondContact O-N 3.12Å; I789-S791 PolarHBondContact O-N 2.94Å; S791-Q794 WeakPolarHBondContact O-CB 3.28Å; S791-Q794 PolarHBondContact O-N 3.43Å
792	K	94.4	Very high	92.9	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-71.5	-39.2	178	-165.4	63.3	170	178	0	112.1	L751 D752 T755 S756 T759 A760 A788 I789 Q794 Q795 A796 L805	L751-K792 HydrophobicContact CD2-CB 4.23Å; L751-K792 HydrophobicContact CD2-CG 4.38Å; D752-K792 PolarHBondContact O-NZ 3.29Å; T755-K792 PolarHBondContact O-NZ 2.8Å; T755-K792 PolarHBondContact OG1-NZ 2.74Å; S756-K792 PolarHBondContact O-NZ 3.29Å; T759-K792 PolarHBondContact OG1-NZ 3.5Å; A760-K792 HydrophobicContact CB-CD 4.44Å; A760-K792 HydrophobicContact CB-CG 3.82Å; A788-K792 WeakPolarHBondContact O-CB 3.46Å; A788-K792 PolarHBondContact O-N 3.31Å; I789-K792 PolarHBondContact O-N 2.85Å; I789-K792 VanDerWaalsContact O-N 3.11Å; K792-Q794 PolarHBondContact O-N 3.14Å; K792-Q795 WeakPolarHBondContact O-CB 3.34Å; K792-Q795 PolarHBondContact O-N 2.93Å; K792-A796 PolarHBondContact O-N 3.39Å; K792-L805 HydrophobicContact CB-CD1 4.01Å; K792-L805 HydrophobicContact CG-CD1 3.92Å
793	M	95	Very high	93.5	Very high	2 Å²	2	42 Å²	42	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-59.9	-30.6	173.2	-74.9	177.8	66.9	0	0	112.7	I789 Q795 M802 L805 I806 F809 F838 E842	I789-M793 HydrophobicContact CG2-CG 4.28Å; I789-M793 HydrophobicContact CG2-SD 4Å; I789-M793 WeakPolarHBondContact O-CB 3.18Å; I789-M793 WeakPolarHBondContact O-CG 3.32Å; I789-M793 PolarHBondContact O-N 3.44Å; M793-Q795 VanDerWaalsContact C-N 3.27Å; M793-Q795 PolarHBondContact O-N 2.92Å; M793-M802 HydrophobicContact CB-CE 4.28Å; M793-M802 HydrophobicContact CB-SD 4.09Å; M793-M802 HydrophobicContact CE-CE 3.92Å; M793-M802 HydrophobicContact CG-CE 4.45Å; M793-M802 HydrophobicContact CG-SD 4.17Å; M793-L805 HydrophobicContact CB-CD1 4.4Å; M793-L805 HydrophobicContact CG-CB 3.65Å; M793-L805 HydrophobicContact CG-CD1 3.64Å; M793-L805 HydrophobicContact CG-CG 4.27Å; M793-L805 HydrophobicContact SD-CB 4.28Å; M793-I806 HydrophobicContact CE-CD1 4.2Å; M793-I806 HydrophobicContact CE-CG1 3.59Å; M793-I806 HydrophobicContact SD-CG1 4.4Å; M793-F809 HydrophobicContact SD-CD2 4.42Å; M793-F809 HydrophobicContact SD-CE2 3.68Å; M793-F838 HydrophobicContact CB-CE1 3.82Å; M793-F838 HydrophobicContact CB-CZ 3.97Å; M793-F838 HydrophobicContact CE-CE1 4.23Å; M793-E842 HydrophobicContact CE-CB 4.07Å; M793-E842 HydrophobicContact CE-CG 4.43Å
794	Q	91.9	Very high	93.9	Very high	125 Å²	125	39.3 Å²	39.3	58%	0.584	20%	0.202	S	C	*	.	H	α-helix	trans	-67.6	-30.6	175.4	-175.4	-178.3	5.1	0	0	112.2	L790 S791 K792 P830 F838	L790-Q794 PolarHBondContact O-N 3.26Å; S791-Q794 WeakPolarHBondContact O-CB 3.28Å; S791-Q794 PolarHBondContact O-N 3.43Å; K792-Q794 PolarHBondContact O-N 3.14Å; Q794-P830 HydrophobicContact CB-CB 4.48Å; Q794-P830 HydrophobicContact CG-CB 3.86Å; Q794-P830 HydrophobicContact CG-CG 4.29Å; Q794-P830 VanDerWaalsContact NE2-CB 3.31Å; Q794-F838 HydrophobicContact CB-CZ 4.45Å
795	Q	91.7	Very high	94.3	Very high	67 Å²	67	34.7 Å²	34.7	31%	0.313	18%	0.18	S	C	.	.	H	α-helix	trans	-82.8	-36.7	178	-174	-160.4	2	0	0	111.8	P753 T755 K792 M793	P753-Q795 PolarHBondContact O-OE1 3.45Å; T755-Q795 PolarHBondContact O-NE2 3.37Å; T755-Q795 PolarHBondContact O-OE1 3.21Å; K792-Q795 WeakPolarHBondContact O-CB 3.34Å; K792-Q795 PolarHBondContact O-N 2.93Å; M793-Q795 VanDerWaalsContact C-N 3.27Å; M793-Q795 PolarHBondContact O-N 2.92Å
796	A	94.4	Very high	94.6	Very high	5 Å²	5	34.6 Å²	34.6	4%	0.041	18%	0.18	C	C	.	.			trans	-75.5	132.1	-167.8	0	0	0	0	0	113.1	E757 K792 V801 M802	E757-A796 HydrophobicContact CB-CB 4.35Å; E757-A796 VanDerWaalsContact OE2-CA 3.27Å; E757-A796 WeakPolarHBondContact OE2-CA 3.4Å; K792-A796 PolarHBondContact O-N 3.39Å; A796-V801 HydrophobicContact CB-CB 4.2Å; A796-V801 HydrophobicContact CB-CG1 3.62Å; A796-M802 HydrophobicContact CB-CG 4.09Å; A796-M802 HydrophobicContact CB-SD 3.73Å
797	E	94.1	Very high	94.8	Very high	167 Å²	167	34.7 Å²	34.7	78%	0.78	18%	0.18	S	C	*	.			trans	-111.8	-33.4	175.5	-64.7	-175	178.2	0	0	111.1	E757	E757-E797 PolarHBondContact OE2-N 3Å
798	A	94.6	Very high	95	Very high	31 Å²	31	29 Å²	29	26%	0.256	16%	0.159	S	C	.	.	S	Bend	trans	-62.7	135.4	179.1	0	0	0	0	0	112.5	E757 S800 V801 M802	E757-A798 WeakPolarHBondContact OE1-CB 3.33Å; E757-A798 PolarHBondContact OE2-N 3.36Å; A798-S800 PolarHBondContact O-N 2.89Å; A798-V801 HydrophobicContact CB-CB 4.48Å; A798-V801 HydrophobicContact CB-CG2 4.16Å; A798-V801 PolarHBondContact O-N 2.93Å; A798-M802 WeakPolarHBondContact O-CG 3.45Å; A798-M802 PolarHBondContact O-N 3Å
799	L	95.6	Very high	95.1	Very high	53 Å²	53	28.3 Å²	28.3	28%	0.277	15%	0.152	S	C	.	.	H	α-helix	trans	-59.8	-46.1	-179.2	175.6	63.6	0	0	0	112.4	V801 M802 Q803 R846 L849 F850	L799-V801 VanDerWaalsContact C-N 3.33Å; L799-V801 PolarHBondContact O-N 2.93Å; L799-M802 PolarHBondContact O-N 2.99Å; L799-Q803 VanDerWaalsContact O-CB 3.3Å; L799-Q803 WeakPolarHBondContact O-CB 3.39Å; L799-Q803 PolarHBondContact O-N 2.85Å; L799-R846 HydrophobicContact CD1-CB 4.1Å; L799-R846 HydrophobicContact CD1-CG 4.34Å; L799-L849 HydrophobicContact CD1-CB 3.88Å; L799-L849 HydrophobicContact CD1-CD1 4.44Å; L799-L849 HydrophobicContact CD2-CB 3.62Å; L799-L849 HydrophobicContact CD2-CD1 4.48Å; L799-L849 WeakPolarHBondContact CD2-O 3.4Å; L799-L849 HydrophobicContact CG-CB 4.41Å; L799-F850 HydrophobicContact CD1-CD1 4.19Å; L799-F850 HydrophobicContact CD1-CE1 4.35Å
800	S	93.3	Very high	95.2	Very high	38 Å²	38	28.2 Å²	28.2	27%	0.266	15%	0.152	S	C	.	.	H	α-helix	trans	-58.5	-43.9	-178.9	53.9	0	0	0	0	112.3	A798 S804 Y851	A798-S800 PolarHBondContact O-N 2.89Å; S800-S804 WeakPolarHBondContact O-CB 3.46Å; S800-S804 PolarHBondContact O-N 3.26Å; S800-Y851 VanDerWaalsContact CB-OH 3.29Å; S800-Y851 WeakPolarHBondContact CB-OH 3.34Å
801	V	95.5	Very high	95.2	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.012	16%	0.156	C	C	.	.	H	α-helix	trans	-65.4	-47.5	175.7	-178.4	0	0	0	0	110.6	E757 A760 V761 A796 A798 L799 Q803 S804 L805	E757-V801 WeakPolarHBondContact O-CG2 3.47Å; A760-V801 HydrophobicContact CB-CG1 3.8Å; V761-V801 HydrophobicContact CG2-CG2 3.65Å; A796-V801 HydrophobicContact CB-CB 4.2Å; A796-V801 HydrophobicContact CB-CG1 3.62Å; A798-V801 HydrophobicContact CB-CB 4.48Å; A798-V801 HydrophobicContact CB-CG2 4.16Å; A798-V801 PolarHBondContact O-N 2.93Å; L799-V801 VanDerWaalsContact C-N 3.33Å; L799-V801 PolarHBondContact O-N 2.93Å; V801-Q803 PolarHBondContact O-N 2.75Å; V801-S804 WeakPolarHBondContact O-CB 3.48Å; V801-S804 PolarHBondContact O-N 3.48Å; V801-L805 HydrophobicContact CG1-CD1 3.97Å; V801-L805 HydrophobicContact CG1-CG 4.46Å; V801-L805 VanDerWaalsContact O-CG 3.28Å; V801-L805 WeakPolarHBondContact O-CG 3.31Å; V801-L805 PolarHBondContact O-N 3.26Å
802	M	97.1	Very high	95.2	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63.6	-42.4	-179.8	-75	-62.3	-76.4	0	0	112.3	M793 A796 A798 L799 L805 I806 E842	M793-M802 HydrophobicContact CB-CE 4.28Å; M793-M802 HydrophobicContact CB-SD 4.09Å; M793-M802 HydrophobicContact CE-CE 3.92Å; M793-M802 HydrophobicContact CG-CE 4.45Å; M793-M802 HydrophobicContact CG-SD 4.17Å; A796-M802 HydrophobicContact CB-CG 4.09Å; A796-M802 HydrophobicContact CB-SD 3.73Å; A798-M802 WeakPolarHBondContact O-CG 3.45Å; A798-M802 PolarHBondContact O-N 3Å; L799-M802 PolarHBondContact O-N 2.99Å; M802-L805 PolarHBondContact O-N 3.01Å; M802-I806 HydrophobicContact CB-CD1 4.42Å; M802-I806 HydrophobicContact CE-CD1 4.28Å; M802-I806 VanDerWaalsContact O-CB 3.29Å; M802-I806 WeakPolarHBondContact O-CB 3.36Å; M802-I806 WeakPolarHBondContact O-CD1 3.24Å; M802-I806 WeakPolarHBondContact O-CG1 3.44Å; M802-I806 PolarHBondContact O-N 3.1Å; M802-E842 HydrophobicContact CE-CB 3.72Å; M802-E842 HydrophobicContact CE-CG 3.88Å; M802-E842 WeakPolarHBondContact CE-OE2 3.5Å
803	Q	96.4	Very high	95.3	Very high	7 Å²	7	27.2 Å²	27.2	3%	0.033	14%	0.141	C	C	.	.	H	α-helix	trans	-58.2	-53.6	174.2	178.9	174.2	-27.9	0	0	109.9	L799 V801 L805 I806 M807 F850 Y851	L799-Q803 VanDerWaalsContact O-CB 3.3Å; L799-Q803 WeakPolarHBondContact O-CB 3.39Å; L799-Q803 PolarHBondContact O-N 2.85Å; V801-Q803 PolarHBondContact O-N 2.75Å; Q803-L805 VanDerWaalsContact C-N 3.29Å; Q803-L805 PolarHBondContact O-N 3.12Å; Q803-I806 PolarHBondContact O-N 3.42Å; Q803-I806 VanDerWaalsContact O-N 3.17Å; Q803-M807 HydrophobicContact CG-CG 4.08Å; Q803-M807 WeakPolarHBondContact O-CB 3.18Å; Q803-M807 WeakPolarHBondContact O-CG 3.25Å; Q803-M807 PolarHBondContact O-N 2.98Å; Q803-F850 HydrophobicContact CB-CD1 3.85Å; Q803-F850 HydrophobicContact CB-CE1 3.74Å; Q803-F850 HydrophobicContact CB-CZ 4.36Å; Q803-F850 HydrophobicContact CG-CD1 3.75Å; Q803-F850 HydrophobicContact CG-CD2 4.37Å; Q803-F850 HydrophobicContact CG-CE1 3.96Å; Q803-F850 HydrophobicContact CG-CG 3.98Å; Q803-F850 HydrophobicContact CG-CZ 4.35Å; Q803-Y851 PolarHBondContact NE2-O 2.96Å
804	S	96.3	Very high	95.3	Very high	14 Å²	14	29.1 Å²	29.1	10%	0.098	15%	0.15	C	C	.	.	H	α-helix	trans	-50.9	-47.3	177.6	-168.4	0	0	0	0	112.9	A760 V761 G764 S800 V801	A760-S804 PolarHBondContact O-OG 3.31Å; V761-S804 WeakPolarHBondContact O-CB 3.45Å; V761-S804 PolarHBondContact O-OG 3.25Å; G764-S804 VanDerWaalsContact CA-O 3.28Å; G764-S804 WeakPolarHBondContact CA-O 3.35Å; G764-S804 PolarHBondContact N-OG 3.43Å; G764-S804 VanDerWaalsContact N-OG 3.11Å; S800-S804 WeakPolarHBondContact O-CB 3.46Å; S800-S804 PolarHBondContact O-N 3.26Å; V801-S804 WeakPolarHBondContact O-CB 3.48Å; V801-S804 PolarHBondContact O-N 3.48Å
805	L	97.1	Very high	95.2	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-69.4	-43.3	179.6	-65.5	176	0	0	0	112.9	L751 A760 V763 I789 K792 M793 V801 M802 Q803 M807 V808	L751-L805 HydrophobicContact CD2-CD2 3.49Å; L751-L805 VanDerWaalsContact CD2-CD2 3.49Å; A760-L805 HydrophobicContact CB-CD2 4.23Å; V763-L805 HydrophobicContact CG1-CD2 3.81Å; I789-L805 HydrophobicContact CG1-CD2 4.25Å; I789-L805 HydrophobicContact CG2-CB 4.07Å; I789-L805 HydrophobicContact CG2-CD2 4.14Å; K792-L805 HydrophobicContact CB-CD1 4.01Å; K792-L805 HydrophobicContact CG-CD1 3.92Å; M793-L805 HydrophobicContact CB-CD1 4.4Å; M793-L805 HydrophobicContact CG-CB 3.65Å; M793-L805 HydrophobicContact CG-CD1 3.64Å; M793-L805 HydrophobicContact CG-CG 4.27Å; M793-L805 HydrophobicContact SD-CB 4.28Å; V801-L805 HydrophobicContact CG1-CD1 3.97Å; V801-L805 HydrophobicContact CG1-CG 4.46Å; V801-L805 VanDerWaalsContact O-CG 3.28Å; V801-L805 WeakPolarHBondContact O-CG 3.31Å; V801-L805 PolarHBondContact O-N 3.26Å; M802-L805 PolarHBondContact O-N 3.01Å; Q803-L805 VanDerWaalsContact C-N 3.29Å; Q803-L805 PolarHBondContact O-N 3.12Å; L805-M807 VanDerWaalsContact C-N 3.32Å; L805-M807 PolarHBondContact O-N 3.28Å; L805-V808 PolarHBondContact O-N 3.04Å
806	I	97.7	Very high	95.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-66.3	-36.8	178.9	-71	163.8	0	0	0	110.9	M793 M802 Q803 V808 F809 A810 E842 W843 F850	M793-I806 HydrophobicContact CE-CD1 4.2Å; M793-I806 HydrophobicContact CE-CG1 3.59Å; M793-I806 HydrophobicContact SD-CG1 4.4Å; M802-I806 HydrophobicContact CB-CD1 4.42Å; M802-I806 HydrophobicContact CE-CD1 4.28Å; M802-I806 VanDerWaalsContact O-CB 3.29Å; M802-I806 WeakPolarHBondContact O-CB 3.36Å; M802-I806 WeakPolarHBondContact O-CD1 3.24Å; M802-I806 WeakPolarHBondContact O-CG1 3.44Å; M802-I806 PolarHBondContact O-N 3.1Å; Q803-I806 PolarHBondContact O-N 3.42Å; Q803-I806 VanDerWaalsContact O-N 3.17Å; I806-V808 PolarHBondContact O-N 3.34Å; I806-V808 VanDerWaalsContact O-N 3.15Å; I806-F809 WeakPolarHBondContact O-CA 3.47Å; I806-F809 WeakPolarHBondContact O-CB 3.12Å; I806-F809 PolarHBondContact O-N 3.34Å; I806-A810 PolarHBondContact O-N 3.34Å; I806-E842 HydrophobicContact CD1-CB 4.45Å; I806-W843 HydrophobicContact CD1-CB 4.3Å; I806-W843 HydrophobicContact CG2-CB 3.89Å; I806-W843 HydrophobicContact CG2-CD2 3.59Å; I806-W843 HydrophobicContact CG2-CE3 4.08Å; I806-W843 HydrophobicContact CG2-CG 3.49Å; I806-W843 VanDerWaalsContact CG2-CG 3.49Å; I806-F850 HydrophobicContact CB-CZ 4.1Å; I806-F850 HydrophobicContact CD1-CZ 4.06Å; I806-F850 HydrophobicContact CG2-CE2 4.11Å; I806-F850 HydrophobicContact CG2-CZ 3.85Å
807	M	96.4	Very high	95.1	Very high	7 Å²	7	29 Å²	29	3%	0.034	16%	0.159	C	C	.	.	H	α-helix	trans	-59.4	-27.6	179.8	-75.7	-51.1	-64.6	0	0	112.5	Q803 L805 F809 A810 H811 F850 E855 V858	Q803-M807 HydrophobicContact CG-CG 4.08Å; Q803-M807 WeakPolarHBondContact O-CB 3.18Å; Q803-M807 WeakPolarHBondContact O-CG 3.25Å; Q803-M807 PolarHBondContact O-N 2.98Å; L805-M807 VanDerWaalsContact C-N 3.32Å; L805-M807 PolarHBondContact O-N 3.28Å; M807-F809 VanDerWaalsContact C-N 3.32Å; M807-F809 PolarHBondContact O-N 3.5Å; M807-A810 HydrophobicContact CE-CB 4.19Å; M807-A810 PolarHBondContact O-N 3.31Å; M807-A810 HydrophobicContact SD-CB 4.11Å; M807-H811 PolarHBondContact O-N 3.45Å; M807-H811 PolarHBondContact O-ND1 2.99Å; M807-F850 HydrophobicContact SD-CD2 4.49Å; M807-F850 HydrophobicContact SD-CE2 4.37Å; M807-E855 HydrophobicContact CE-CB 4.07Å; M807-E855 HydrophobicContact CE-CG 4.21Å; M807-E855 WeakPolarHBondContact CE-O 3.47Å; M807-E855 HydrophobicContact CG-CG 4.37Å; M807-E855 HydrophobicContact SD-CB 4.39Å; M807-V858 HydrophobicContact CE-CB 3.71Å; M807-V858 HydrophobicContact CE-CG1 3.57Å
808	V	96.4	Very high	95.1	Very high	1 Å²	1	25 Å²	25	1%	0.006	14%	0.14	C	C	.	.	H	α-helix	trans	-60.1	-43.8	172.5	-179.9	0	0	0	0	111	V767 I771 L786 I789 L805 I806 L812	V767-V808 HydrophobicContact CB-CG2 4.14Å; V767-V808 HydrophobicContact CG1-CG1 3.71Å; V767-V808 HydrophobicContact CG1-CG2 4.13Å; I771-V808 HydrophobicContact CD1-CG1 4.14Å; L786-V808 HydrophobicContact CD2-CG1 4.14Å; I789-V808 HydrophobicContact CD1-CB 3.98Å; I789-V808 HydrophobicContact CD1-CG1 3.77Å; I789-V808 HydrophobicContact CD1-CG2 3.88Å; L805-V808 PolarHBondContact O-N 3.04Å; I806-V808 PolarHBondContact O-N 3.34Å; I806-V808 VanDerWaalsContact O-N 3.15Å; V808-L812 HydrophobicContact CG1-CD1 4.41Å; V808-L812 WeakPolarHBondContact O-CG 3.37Å; V808-L812 PolarHBondContact O-N 2.85Å; V808-L812 VanDerWaalsContact O-N 3.12Å
809	F	96.6	Very high	95	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.009	15%	0.151	C	C	.	.	H	α-helix	trans	-69.8	-38.9	176.3	-58.5	-63.8	0	0	0	111.6	L786 I789 L790 M793 I806 M807 H811 L812 V813 L820 L824 V839	L786-F809 HydrophobicContact CD2-CD1 4.42Å; L786-F809 HydrophobicContact CD2-CE1 3.87Å; I789-F809 HydrophobicContact CB-CZ 4.45Å; I789-F809 HydrophobicContact CG2-CE2 3.6Å; I789-F809 HydrophobicContact CG2-CZ 3.75Å; L790-F809 HydrophobicContact CD2-CE2 4.4Å; L790-F809 HydrophobicContact CD2-CZ 3.97Å; L790-F809 HydrophobicContact CG-CZ 4.17Å; M793-F809 HydrophobicContact SD-CD2 4.42Å; M793-F809 HydrophobicContact SD-CE2 3.68Å; I806-F809 WeakPolarHBondContact O-CA 3.47Å; I806-F809 WeakPolarHBondContact O-CB 3.12Å; I806-F809 PolarHBondContact O-N 3.34Å; M807-F809 VanDerWaalsContact C-N 3.32Å; M807-F809 PolarHBondContact O-N 3.5Å; F809-H811 PolarHBondContact O-N 2.96Å; F809-L812 PolarHBondContact O-N 2.8Å; F809-V813 WeakPolarHBondContact O-CG2 3.25Å; F809-V813 PolarHBondContact O-N 2.98Å; F809-L820 HydrophobicContact CD1-CD1 3.8Å; F809-L820 HydrophobicContact CE1-CD1 4.42Å; F809-L824 HydrophobicContact CE1-CD2 4.08Å; F809-V839 HydrophobicContact CB-CG1 4.34Å; F809-V839 HydrophobicContact CD2-CG1 3.78Å; F809-V839 HydrophobicContact CD2-CG2 4.23Å; F809-V839 HydrophobicContact CE2-CG1 4.32Å; F809-V839 HydrophobicContact CE2-CG2 3.93Å; F809-V839 HydrophobicContact CG-CG1 4.1Å; F809-V839 HydrophobicContact CZ-CG2 4.18Å
810	A	96.8	Very high	94.9	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-56.9	-49.5	174.9	0	0	0	0	0	111.2	I806 M807 L812 V813 H814 W843 V858 A862	I806-A810 PolarHBondContact O-N 3.34Å; M807-A810 HydrophobicContact CE-CB 4.19Å; M807-A810 PolarHBondContact O-N 3.31Å; M807-A810 HydrophobicContact SD-CB 4.11Å; A810-L812 VanDerWaalsContact C-N 3.33Å; A810-L812 PolarHBondContact O-N 3.47Å; A810-V813 WeakPolarHBondContact O-CB 3.45Å; A810-V813 PolarHBondContact O-N 3Å; A810-V813 VanDerWaalsContact O-N 3.14Å; A810-H814 PolarHBondContact O-CD2 2.9Å; A810-W843 HydrophobicContact CB-CH2 3.65Å; A810-W843 HydrophobicContact CB-CZ2 3.78Å; A810-V858 HydrophobicContact CB-CG1 4.22Å; A810-A862 HydrophobicContact CB-CB 4.28Å
811	H	94.3	Very high	95	Very high	40 Å²	40	23.4 Å²	23.4	19%	0.185	13%	0.129	C	C	.	.	H	α-helix	trans	-59.6	-40.4	175.3	-72.9	92.2	0	0	0	112.6	M807 F809 V813 H814 S815 Y854	M807-H811 PolarHBondContact O-N 3.45Å; M807-H811 PolarHBondContact O-ND1 2.99Å; F809-H811 PolarHBondContact O-N 2.96Å; H811-V813 VanDerWaalsContact C-N 3.3Å; H811-V813 PolarHBondContact O-N 3.27Å; H811-H814 PolarHBondContact O-N 3.17Å; H811-H814 VanDerWaalsContact O-N 3.13Å; H811-S815 PolarHBondContact O-OG 3.08Å; H811-Y854 AromaticContact NE2-CE1 3.69Å; H811-Y854 AromaticContact NE2-CZ 3.76Å; H811-Y854 PolarHBondContact NE2-OH 3.35Å; H811-Y854 VanDerWaalsContact NE2-OH 3.1Å
812	L	94.1	Very high	95	Very high	5 Å²	5	29.6 Å²	29.6	3%	0.026	16%	0.157	C	C	.	.	H	α-helix	trans	-66.1	-27.3	177.4	-76.5	173.7	0	0	0	113.5	I771 L786 V808 F809 A810 H814 S815 Q816 L817 L820	I771-L812 HydrophobicContact CD1-CD1 4.39Å; I771-L812 HydrophobicContact CD1-CD2 4.28Å; I771-L812 HydrophobicContact CD1-CG 4.45Å; I771-L812 HydrophobicContact CG2-CD2 3.97Å; L786-L812 HydrophobicContact CD1-CD1 4.18Å; L786-L812 HydrophobicContact CD2-CD1 3.82Å; V808-L812 HydrophobicContact CG1-CD1 4.41Å; V808-L812 WeakPolarHBondContact O-CG 3.37Å; V808-L812 PolarHBondContact O-N 2.85Å; V808-L812 VanDerWaalsContact O-N 3.12Å; F809-L812 PolarHBondContact O-N 2.8Å; A810-L812 VanDerWaalsContact C-N 3.33Å; A810-L812 PolarHBondContact O-N 3.47Å; L812-H814 PolarHBondContact O-N 3.31Å; L812-S815 PolarHBondContact O-N 2.93Å; L812-Q816 HydrophobicContact CD2-CB 4.43Å; L812-Q816 CarbonylContact O-C 3.58Å; L812-Q816 VanDerWaalsContact O-C 3.28Å; L812-Q816 WeakPolarHBondContact O-CA 3.22Å; L812-Q816 PolarHBondContact O-N 2.97Å; L812-L817 PolarHBondContact O-N 3.24Å; L812-L820 HydrophobicContact CB-CD1 4.46Å; L812-L820 HydrophobicContact CB-CD2 3.91Å; L812-L820 HydrophobicContact CD1-CD1 4.25Å
813	V	96.6	Very high	94.7	Very high	6 Å²	6	30.4 Å²	30.4	4%	0.036	16%	0.161	C	C	.	.	H	α-helix	trans	-60.4	-34.3	172.1	167.5	0	0	0	0	111.2	F809 A810 H811 L817 L820 A862 K865 L866	F809-V813 WeakPolarHBondContact O-CG2 3.25Å; F809-V813 PolarHBondContact O-N 2.98Å; A810-V813 WeakPolarHBondContact O-CB 3.45Å; A810-V813 PolarHBondContact O-N 3Å; A810-V813 VanDerWaalsContact O-N 3.14Å; H811-V813 VanDerWaalsContact C-N 3.3Å; H811-V813 PolarHBondContact O-N 3.27Å; V813-L817 HydrophobicContact CB-CD1 4.39Å; V813-L817 HydrophobicContact CG1-CD1 3.93Å; V813-L817 HydrophobicContact CG2-CD1 4.26Å; V813-L820 HydrophobicContact CG2-CD2 3.83Å; V813-A862 HydrophobicContact CB-CB 3.97Å; V813-A862 HydrophobicContact CG1-CB 3.9Å; V813-A862 HydrophobicContact CG2-CB 4.46Å; V813-K865 HydrophobicContact CG1-CB 3.99Å; V813-K865 HydrophobicContact CG1-CD 4.39Å; V813-L866 HydrophobicContact CG1-CG 4.21Å; V813-L866 HydrophobicContact CG2-CD1 4.15Å; V813-L866 HydrophobicContact CG2-CD2 4.27Å; V813-L866 HydrophobicContact CG2-CG 4.2Å
814	H	93.9	Very high	94.7	Very high	42 Å²	42	30.2 Å²	30.2	19%	0.194	16%	0.16	C	C	.	.	H	α-helix	trans	-74.5	-30.5	-179.3	-59.3	-92.4	0	0	0	113.5	A810 H811 L812 V858 A862 K865 I1000	A810-H814 PolarHBondContact O-CD2 2.9Å; H811-H814 PolarHBondContact O-N 3.17Å; H811-H814 VanDerWaalsContact O-N 3.13Å; L812-H814 PolarHBondContact O-N 3.31Å; H814-V858 PolarHBondContact NE2-O 2.91Å; H814-A862 PolarHBondContact CE1-N 2.97Å; H814-A862 WeakPolarHBondContact NE2-CB 3.38Å; H814-K865 PolarHBondContact ND1-NZ 2.92Å; H814-K865 VanDerWaalsContact ND1-NZ 3.2Å; H814-I1000 HydrophobicContact CB-CD1 4.43Å; H814-I1000 WeakPolarHBondContact ND1-CD1 3.37Å
815	S	90.4	Very high	94.6	Very high	83 Å²	83	31.7 Å²	31.7	58%	0.58	17%	0.17	S	C	*	.	H	α-helix	trans	-107.6	-35.1	-171.1	55.8	0	0	0	0	114	H811 L812	H811-S815 PolarHBondContact O-OG 3.08Å; L812-S815 PolarHBondContact O-N 2.93Å
816	Q	90.8	Very high	94.4	Very high	79 Å²	79	35.6 Å²	35.6	37%	0.369	20%	0.197	S	C	.	.	H	α-helix	trans	-142.6	46.7	-169.8	-62.3	-174.7	-18.3	0	0	112.6	L812 E818 P819 L820	L812-Q816 HydrophobicContact CD2-CB 4.43Å; L812-Q816 CarbonylContact O-C 3.58Å; L812-Q816 VanDerWaalsContact O-C 3.28Å; L812-Q816 WeakPolarHBondContact O-CA 3.22Å; L812-Q816 PolarHBondContact O-N 2.97Å; Q816-E818 PolarHBondContact O-N 3.02Å; Q816-P819 HydrophobicContact CB-CB 4.46Å; Q816-P819 HydrophobicContact CB-CG 4.4Å; Q816-P819 WeakPolarHBondContact O-CD 3.25Å; Q816-L820 VanDerWaalsContact O-CB 3.22Å; Q816-L820 WeakPolarHBondContact O-CB 3.43Å; Q816-L820 PolarHBondContact O-N 3.05Å
817	L	93.9	Very high	94	Very high	32 Å²	32	36.7 Å²	36.7	17%	0.168	20%	0.203	C	C	.	.	H	α-helix	trans	-51.4	-57.5	-176.2	179.8	58.1	0	0	0	114.3	L812 V813 L820 L821 L866 H869	L812-L817 PolarHBondContact O-N 3.24Å; V813-L817 HydrophobicContact CB-CD1 4.39Å; V813-L817 HydrophobicContact CG1-CD1 3.93Å; V813-L817 HydrophobicContact CG2-CD1 4.26Å; L817-L820 WeakPolarHBondContact O-CB 3.39Å; L817-L820 PolarHBondContact O-N 3.38Å; L817-L821 HydrophobicContact CD1-CD1 4.14Å; L817-L821 HydrophobicContact CD1-CG 4.29Å; L817-L821 HydrophobicContact CG-CD1 4.38Å; L817-L821 WeakPolarHBondContact O-CG 3.35Å; L817-L821 PolarHBondContact O-N 2.85Å; L817-L821 VanDerWaalsContact O-N 3.08Å; L817-L866 HydrophobicContact CD1-CD2 3.77Å; L817-H869 HydrophobicContact CD2-CB 3.82Å
818	E	93.9	Very high	93.7	Very high	84 Å²	84	41.2 Å²	41.2	39%	0.393	23%	0.233	S	C	.	.	H	α-helix	trans	-67.1	-46.1	-175.2	-172.3	62.9	-146.1	0	0	112.7	Q816 L820 L821 E822 H869 R877	Q816-E818 PolarHBondContact O-N 3.02Å; E818-L820 VanDerWaalsContact C-N 3.28Å; E818-L820 PolarHBondContact O-N 3.11Å; E818-L821 PolarHBondContact O-N 2.98Å; E818-E822 PolarHBondContact O-N 3.36Å; E818-H869 IonicContact OE2-CE1 3.85Å; E818-H869 PolarHBondContact OE2-CE1 2.82Å; E818-H869 IonicContact OE2-NE2 3.67Å; E818-H869 PolarHBondContact OE2-NE2 3.38Å; E818-R877 VanDerWaalsContact CD-NH2 3.3Å; E818-R877 IonicContact OE1-CZ 3.68Å; E818-R877 VanDerWaalsContact OE1-CZ 3.29Å; E818-R877 IonicContact OE1-NH1 2.98Å; E818-R877 PolarHBondContact OE1-NH1 3.43Å; E818-R877 IonicContact OE1-NH2 2.66Å; E818-R877 PolarHBondContact OE1-NH2 3.07Å; E818-R877 IonicContact OE2-NH2 3.33Å; E818-R877 PolarHBondContact OE2-NH2 3.19Å
819	P	92.6	Very high	92.8	Very high	75 Å²	75	41.8 Å²	41.8	49%	0.487	24%	0.239	S	C	.	.	H	α-helix	trans	-56.6	-38.5	171.6	-26.5	34.4	0	0	0	113.8	Q816 E822 F823	Q816-P819 HydrophobicContact CB-CB 4.46Å; Q816-P819 HydrophobicContact CB-CG 4.4Å; Q816-P819 WeakPolarHBondContact O-CD 3.25Å; P819-E822 PolarHBondContact O-N 3.4Å; P819-F823 VanDerWaalsContact O-CB 3.29Å; P819-F823 WeakPolarHBondContact O-CB 3.37Å; P819-F823 PolarHBondContact O-N 3.33Å
820	L	93.8	Very high	91.9	Very high	11 Å²	11	44.2 Å²	44.2	6%	0.058	26%	0.255	C	S	.	.	H	α-helix	trans	-62.9	-46.3	177.3	173.4	64.8	0	0	0	111.5	F809 L812 V813 Q816 L817 E818 F823 L824	F809-L820 HydrophobicContact CD1-CD1 3.8Å; F809-L820 HydrophobicContact CE1-CD1 4.42Å; L812-L820 HydrophobicContact CB-CD1 4.46Å; L812-L820 HydrophobicContact CB-CD2 3.91Å; L812-L820 HydrophobicContact CD1-CD1 4.25Å; V813-L820 HydrophobicContact CG2-CD2 3.83Å; Q816-L820 VanDerWaalsContact O-CB 3.22Å; Q816-L820 WeakPolarHBondContact O-CB 3.43Å; Q816-L820 PolarHBondContact O-N 3.05Å; L817-L820 WeakPolarHBondContact O-CB 3.39Å; L817-L820 PolarHBondContact O-N 3.38Å; E818-L820 VanDerWaalsContact C-N 3.28Å; E818-L820 PolarHBondContact O-N 3.11Å; L820-F823 PolarHBondContact O-N 3.17Å; L820-L824 HydrophobicContact CD1-CD1 3.77Å; L820-L824 HydrophobicContact CD1-CG 3.97Å; L820-L824 HydrophobicContact CG-CD1 4.05Å; L820-L824 WeakPolarHBondContact O-CB 3.34Å; L820-L824 WeakPolarHBondContact O-CG 3.37Å; L820-L824 PolarHBondContact O-N 3.45Å
821	L	95	Very high	90.7	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-64.4	-40.3	178.6	-66	177	0	0	0	111.7	L817 E818 C825 L836 L866 L878	L817-L821 HydrophobicContact CD1-CD1 4.14Å; L817-L821 HydrophobicContact CD1-CG 4.29Å; L817-L821 HydrophobicContact CG-CD1 4.38Å; L817-L821 WeakPolarHBondContact O-CG 3.35Å; L817-L821 PolarHBondContact O-N 2.85Å; L817-L821 VanDerWaalsContact O-N 3.08Å; E818-L821 PolarHBondContact O-N 2.98Å; L821-C825 WeakPolarHBondContact O-CB 3.45Å; L821-C825 PolarHBondContact O-N 2.87Å; L821-C825 VanDerWaalsContact O-N 3.11Å; L821-C825 PolarHBondContact O-SG 3.07Å; L821-L836 HydrophobicContact CD2-CD1 3.78Å; L821-L836 HydrophobicContact CD2-CD2 4.17Å; L821-L866 HydrophobicContact CD2-CD2 4.37Å; L821-L878 HydrophobicContact CD1-CD1 4.25Å; L821-L878 HydrophobicContact CD2-CD1 4.48Å; L821-L878 HydrophobicContact CD2-CD2 4.03Å; L821-L878 HydrophobicContact CD2-CG 4.4Å
822	E	94.1	Very high	90	Very high	131 Å²	131	50.1 Å²	50.1	61%	0.612	31%	0.307	S	S	*	.	H	α-helix	trans	-63.2	-47.2	175.1	-173.1	170.2	-162.6	0	0	111.4	E818 P819 C825 S826	E818-E822 PolarHBondContact O-N 3.36Å; P819-E822 PolarHBondContact O-N 3.4Å; E822-C825 PolarHBondContact O-N 3.5Å; E822-S826 WeakPolarHBondContact O-CB 3.5Å; E822-S826 PolarHBondContact O-N 3.5Å
823	F	92.8	Very high	89.7	Confident	18 Å²	18	54.9 Å²	54.9	8%	0.079	33%	0.327	C	S	.	.	H	α-helix	trans	-58.3	-52.5	177.1	172	-96.3	0	0	0	111.9	D783 L786 R787 P819 L820 C825 S826 L827	D783-F823 HydrophobicContact CB-CD2 4.49Å; D783-F823 HydrophobicContact CB-CE2 3.77Å; L786-F823 HydrophobicContact CB-CD1 4.45Å; L786-F823 HydrophobicContact CB-CE1 3.45Å; L786-F823 VanDerWaalsContact CB-CE1 3.45Å; L786-F823 HydrophobicContact CB-CZ 3.53Å; L786-F823 HydrophobicContact CD1-CD1 3.83Å; L786-F823 HydrophobicContact CD1-CE1 3.63Å; L786-F823 HydrophobicContact CD1-CG 4.41Å; L786-F823 HydrophobicContact CD1-CZ 4.04Å; L786-F823 HydrophobicContact CG-CE1 4.2Å; L786-F823 HydrophobicContact CG-CZ 4.42Å; R787-F823 HydrophobicContact CG-CZ 4.25Å; P819-F823 VanDerWaalsContact O-CB 3.29Å; P819-F823 WeakPolarHBondContact O-CB 3.37Å; P819-F823 PolarHBondContact O-N 3.33Å; L820-F823 PolarHBondContact O-N 3.17Å; F823-C825 PolarHBondContact O-N 3.14Å; F823-S826 WeakPolarHBondContact O-CB 3.27Å; F823-S826 PolarHBondContact O-N 3.02Å; F823-S826 PolarHBondContact O-OG 3.14Å; F823-L827 HydrophobicContact CD1-CD1 4.46Å; F823-L827 HydrophobicContact CD2-CD1 4.22Å; F823-L827 HydrophobicContact CE1-CD1 3.82Å; F823-L827 HydrophobicContact CE2-CD1 3.55Å; F823-L827 HydrophobicContact CZ-CD1 3.32Å
824	L	94.8	Very high	89.6	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.016	35%	0.345	C	S	.	.	H	α-helix	trans	-66.7	-23.8	-178	-71.9	177.8	0	0	0	113.2	L790 F809 L820 A835 L836 V839	L790-L824 HydrophobicContact CD1-CD2 4.26Å; L790-L824 HydrophobicContact CD2-CD2 4.36Å; F809-L824 HydrophobicContact CE1-CD2 4.08Å; L820-L824 HydrophobicContact CD1-CD1 3.77Å; L820-L824 HydrophobicContact CD1-CG 3.97Å; L820-L824 HydrophobicContact CG-CD1 4.05Å; L820-L824 WeakPolarHBondContact O-CB 3.34Å; L820-L824 WeakPolarHBondContact O-CG 3.37Å; L820-L824 PolarHBondContact O-N 3.45Å; L824-A835 HydrophobicContact CD2-CB 4.21Å; L824-A835 WeakPolarHBondContact O-CB 3.32Å; L824-A835 PolarHBondContact O-N 3.3Å; L824-A835 VanDerWaalsContact O-N 3.12Å; L824-L836 HydrophobicContact CB-CB 3.85Å; L824-L836 HydrophobicContact CB-CD1 4.29Å; L824-L836 HydrophobicContact CD1-CD1 3.89Å; L824-L836 PolarHBondContact O-N 3.47Å; L824-L836 VanDerWaalsContact O-N 3.13Å; L824-V839 HydrophobicContact CD1-CG2 4.38Å; L824-V839 HydrophobicContact CD2-CG2 4.08Å
825	C	94.5	Very high	89.7	Confident	45 Å²	45	55.6 Å²	55.6	30%	0.304	34%	0.336	S	S	.	.	H	α-helix	trans	-82.5	-24.9	172.8	-69.6	0	0	0	0	113.2	L821 E822 F823 L827	L821-C825 WeakPolarHBondContact O-CB 3.45Å; L821-C825 PolarHBondContact O-N 2.87Å; L821-C825 VanDerWaalsContact O-N 3.11Å; L821-C825 PolarHBondContact O-SG 3.07Å; E822-C825 PolarHBondContact O-N 3.5Å; F823-C825 PolarHBondContact O-N 3.14Å; C825-L827 PolarHBondContact O-N 2.85Å
826	S	92.4	Very high	89.9	Confident	82 Å²	82	51.8 Å²	51.8	57%	0.573	31%	0.309	S	S	*	.	H	α-helix	trans	-74.1	-12.9	-179.3	77.2	0	0	0	0	113.9	E822 F823	E822-S826 WeakPolarHBondContact O-CB 3.5Å; E822-S826 PolarHBondContact O-N 3.5Å; F823-S826 WeakPolarHBondContact O-CB 3.27Å; F823-S826 PolarHBondContact O-N 3.02Å; F823-S826 PolarHBondContact O-OG 3.14Å
827	L	91	Very high	90.2	Very high	22 Å²	22	49.6 Å²	49.6	12%	0.115	30%	0.299	C	S	.	.	S	Bend	trans	-119.2	141.4	-174.3	-63.2	168.3	0	0	0	112	R787 F823 C825 A835	R787-L827 HydrophobicContact CG-CD1 3.91Å; R787-L827 VanDerWaalsContact CZ-CD2 3.46Å; F823-L827 HydrophobicContact CD1-CD1 4.46Å; F823-L827 HydrophobicContact CD2-CD1 4.22Å; F823-L827 HydrophobicContact CE1-CD1 3.82Å; F823-L827 HydrophobicContact CE2-CD1 3.55Å; F823-L827 HydrophobicContact CZ-CD1 3.32Å; C825-L827 PolarHBondContact O-N 2.85Å; L827-A835 HydrophobicContact CB-CB 4.36Å; L827-A835 PolarHBondContact O-N 3.25Å
828	P	89.8	Confident	90.2	Very high	102 Å²	102	49 Å²	49	66%	0.662	29%	0.294	S	S	*	.	B	Isolated β-bridge	trans	-75.1	134.2	168.5	31.6	-32.3	0	0	0	110.2	K833	P828-K833 CarbonylContact C-O 3.6Å
829	G	77.9	Confident	90.4	Very high	13 Å²	13	45 Å²	45	13%	0.134	28%	0.276	C	S	.	.			trans	-77.2	179	165.8	0	0	0	0	0	112.3	T831 G832 K833	G829-T831 PolarHBondContact O-N 3.33Å; G829-T831 VanDerWaalsContact O-N 3.1Å; G829-G832 PolarHBondContact O-N 3.37Å; G829-K833 PolarHBondContact N-O 3.2Å
830	P	77.3	Confident	90.6	Very high	53 Å²	53	41.7 Å²	41.7	34%	0.344	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-18.5	-175	26.6	-35.3	0	0	0	114.1	Q794 F838	Q794-P830 HydrophobicContact CB-CB 4.48Å; Q794-P830 HydrophobicContact CG-CB 3.86Å; Q794-P830 HydrophobicContact CG-CG 4.29Å; Q794-P830 VanDerWaalsContact NE2-CB 3.31Å; P830-F838 HydrophobicContact CG-CD1 4.16Å; P830-F838 HydrophobicContact CG-CD2 3.52Å; P830-F838 HydrophobicContact CG-CE1 4.23Å; P830-F838 HydrophobicContact CG-CE2 3.62Å; P830-F838 HydrophobicContact CG-CG 3.81Å; P830-F838 HydrophobicContact CG-CZ 3.98Å
831	T	70.8	Confident	90.6	Very high	99 Å²	99	43.1 Å²	43.1	61%	0.607	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	1.7	179.2	59	0	0	0	0	113.4	G829 K833	G829-T831 PolarHBondContact O-N 3.33Å; G829-T831 VanDerWaalsContact O-N 3.1Å; T831-K833 PolarHBondContact O-N 3.31Å
832	G	79.5	Confident	90.7	Very high	65 Å²	65	45 Å²	45	67%	0.67	27%	0.272	S	S	*	.	S	Bend	trans	79.1	-0.7	-176.2	0	0	0	0	0	114.8	G829	G829-G832 PolarHBondContact O-N 3.37Å
833	K	89	Confident	90.8	Very high	106 Å²	106	38.9 Å²	38.9	46%	0.461	24%	0.243	S	C	.	.	S	Bend	trans	-90.8	170.8	170.5	-60.7	-163	-172.8	-179.3	0	110.8	P828 G829 T831 E837	P828-K833 CarbonylContact C-O 3.6Å; G829-K833 PolarHBondContact N-O 3.2Å; T831-K833 PolarHBondContact O-N 3.31Å; K833-E837 WeakPolarHBondContact CD-OE1 3.44Å; K833-E837 WeakPolarHBondContact CD-OE2 3.48Å; K833-E837 WeakPolarHBondContact CE-OE1 3.4Å; K833-E837 IonicContact NZ-OE1 2.63Å; K833-E837 PolarHBondContact NZ-OE1 2.88Å; K833-E837 IonicContact NZ-OE2 3.56Å
834	P	93.9	Very high	91	Very high	62 Å²	62	38.1 Å²	38.1	40%	0.403	24%	0.24	S	C	.	.	B	Isolated β-bridge	trans	-54.4	142.3	176.6	-25.5	35.6	0	0	0	112	L836 E837	P834-L836 PolarHBondContact O-N 3.08Å; P834-L836 VanDerWaalsContact O-N 3.15Å; P834-E837 WeakPolarHBondContact O-CB 3.41Å; P834-E837 PolarHBondContact O-N 2.82Å
835	A	94.9	Very high	91.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.5	-26.8	178.9	0	0	0	0	0	112.4	L790 L824 L827 E837 F838 V839	L790-A835 HydrophobicContact CD1-CB 3.87Å; L790-A835 HydrophobicContact CD2-CB 4.37Å; L824-A835 HydrophobicContact CD2-CB 4.21Å; L824-A835 WeakPolarHBondContact O-CB 3.32Å; L824-A835 PolarHBondContact O-N 3.3Å; L824-A835 VanDerWaalsContact O-N 3.12Å; L827-A835 HydrophobicContact CB-CB 4.36Å; L827-A835 PolarHBondContact O-N 3.25Å; A835-E837 VanDerWaalsContact C-N 3.29Å; A835-E837 PolarHBondContact O-N 3.34Å; A835-F838 WeakPolarHBondContact O-CB 3.21Å; A835-F838 PolarHBondContact O-N 2.68Å; A835-F838 VanDerWaalsContact O-N 3.14Å; A835-V839 PolarHBondContact O-N 2.97Å
836	L	96.1	Very high	91.2	Very high	4 Å²	4	40.2 Å²	40.2	2%	0.021	25%	0.249	C	C	.	.	H	α-helix	trans	-54.5	-43.6	171.5	-177.1	61.9	0	0	0	112.3	L821 L824 P834 F838 V839 M840 R877 L878 I881	L821-L836 HydrophobicContact CD2-CD1 3.78Å; L821-L836 HydrophobicContact CD2-CD2 4.17Å; L824-L836 HydrophobicContact CB-CB 3.85Å; L824-L836 HydrophobicContact CB-CD1 4.29Å; L824-L836 HydrophobicContact CD1-CD1 3.89Å; L824-L836 PolarHBondContact O-N 3.47Å; L824-L836 VanDerWaalsContact O-N 3.13Å; P834-L836 PolarHBondContact O-N 3.08Å; P834-L836 VanDerWaalsContact O-N 3.15Å; L836-F838 VanDerWaalsContact C-N 3.33Å; L836-F838 PolarHBondContact O-N 2.78Å; L836-V839 PolarHBondContact O-N 3.3Å; L836-M840 HydrophobicContact CD1-CG 4.02Å; L836-M840 HydrophobicContact CG-CG 4.41Å; L836-M840 WeakPolarHBondContact O-CB 3.42Å; L836-M840 VanDerWaalsContact O-CG 3.24Å; L836-M840 WeakPolarHBondContact O-CG 3.34Å; L836-M840 PolarHBondContact O-N 2.94Å; L836-R877 HydrophobicContact CD2-CB 3.99Å; L836-L878 HydrophobicContact CD1-CD2 4.32Å; L836-L878 HydrophobicContact CD2-CD2 4.07Å; L836-I881 HydrophobicContact CD2-CD1 4.02Å; L836-I881 HydrophobicContact CG-CD1 3.85Å
837	E	95.4	Very high	91.4	Very high	33 Å²	33	36.3 Å²	36.3	15%	0.154	22%	0.222	C	C	.	.	H	α-helix	trans	-66	-37.7	178.6	178.8	171.2	167.2	0	0	111.7	K833 P834 A835 T841 I881	K833-E837 WeakPolarHBondContact CD-OE1 3.44Å; K833-E837 WeakPolarHBondContact CD-OE2 3.48Å; K833-E837 WeakPolarHBondContact CE-OE1 3.4Å; K833-E837 IonicContact NZ-OE1 2.63Å; K833-E837 PolarHBondContact NZ-OE1 2.88Å; K833-E837 IonicContact NZ-OE2 3.56Å; P834-E837 WeakPolarHBondContact O-CB 3.41Å; P834-E837 PolarHBondContact O-N 2.82Å; A835-E837 VanDerWaalsContact C-N 3.29Å; A835-E837 PolarHBondContact O-N 3.34Å; E837-T841 VanDerWaalsContact O-CB 3.22Å; E837-T841 WeakPolarHBondContact O-CB 3.47Å; E837-T841 PolarHBondContact O-N 2.73Å; E837-T841 PolarHBondContact O-OG1 3.14Å; E837-I881 HydrophobicContact CB-CD1 4.39Å; E837-I881 HydrophobicContact CB-CG1 4.44Å; E837-I881 HydrophobicContact CG-CG2 4.07Å
838	F	95.4	Very high	91.5	Very high	18 Å²	18	40 Å²	40	8%	0.079	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-52.9	176.1	173.1	-112.7	0	0	0	111.5	L790 M793 Q794 P830 A835 L836 M840 T841 E842	L790-F838 HydrophobicContact CD2-CD1 4.05Å; L790-F838 HydrophobicContact CD2-CE1 4.41Å; M793-F838 HydrophobicContact CB-CE1 3.82Å; M793-F838 HydrophobicContact CB-CZ 3.97Å; M793-F838 HydrophobicContact CE-CE1 4.23Å; Q794-F838 HydrophobicContact CB-CZ 4.45Å; P830-F838 HydrophobicContact CG-CD1 4.16Å; P830-F838 HydrophobicContact CG-CD2 3.52Å; P830-F838 HydrophobicContact CG-CE1 4.23Å; P830-F838 HydrophobicContact CG-CE2 3.62Å; P830-F838 HydrophobicContact CG-CG 3.81Å; P830-F838 HydrophobicContact CG-CZ 3.98Å; A835-F838 WeakPolarHBondContact O-CB 3.21Å; A835-F838 PolarHBondContact O-N 2.68Å; A835-F838 VanDerWaalsContact O-N 3.14Å; L836-F838 VanDerWaalsContact C-N 3.33Å; L836-F838 PolarHBondContact O-N 2.78Å; F838-M840 VanDerWaalsContact C-N 3.34Å; F838-M840 PolarHBondContact O-N 3.27Å; F838-T841 PolarHBondContact O-N 2.88Å; F838-E842 HydrophobicContact CD2-CG 3.97Å; F838-E842 HydrophobicContact CE2-CG 3.56Å; F838-E842 HydrophobicContact CZ-CG 3.92Å; F838-E842 WeakPolarHBondContact O-CG 3.31Å; F838-E842 PolarHBondContact O-N 3.08Å
839	V	96.6	Very high	91.7	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.012	23%	0.228	C	C	.	.	H	α-helix	trans	-57.3	-48	179.2	174.2	0	0	0	0	110.9	L790 F809 L824 A835 L836 T841 E842 W843	L790-V839 HydrophobicContact CD2-CG2 3.4Å; L790-V839 VanDerWaalsContact CD2-CG2 3.4Å; F809-V839 HydrophobicContact CB-CG1 4.34Å; F809-V839 HydrophobicContact CD2-CG1 3.78Å; F809-V839 HydrophobicContact CD2-CG2 4.23Å; F809-V839 HydrophobicContact CE2-CG1 4.32Å; F809-V839 HydrophobicContact CE2-CG2 3.93Å; F809-V839 HydrophobicContact CG-CG1 4.1Å; F809-V839 HydrophobicContact CZ-CG2 4.18Å; L824-V839 HydrophobicContact CD1-CG2 4.38Å; L824-V839 HydrophobicContact CD2-CG2 4.08Å; A835-V839 PolarHBondContact O-N 2.97Å; L836-V839 PolarHBondContact O-N 3.3Å; V839-T841 PolarHBondContact O-N 2.68Å; V839-E842 PolarHBondContact O-N 3.04Å; V839-W843 WeakPolarHBondContact O-CB 3.45Å; V839-W843 PolarHBondContact O-N 3.25Å
840	M	96.9	Very high	92.5	Very high	4 Å²	4	39.8 Å²	39.8	2%	0.02	23%	0.227	C	C	.	.	H	α-helix	trans	-67.7	-36.9	-179.3	-64.6	-50.7	-59.7	0	0	112.2	L836 F838 W843 M844 L866 L913 I917	L836-M840 HydrophobicContact CD1-CG 4.02Å; L836-M840 HydrophobicContact CG-CG 4.41Å; L836-M840 WeakPolarHBondContact O-CB 3.42Å; L836-M840 VanDerWaalsContact O-CG 3.24Å; L836-M840 WeakPolarHBondContact O-CG 3.34Å; L836-M840 PolarHBondContact O-N 2.94Å; F838-M840 VanDerWaalsContact C-N 3.34Å; F838-M840 PolarHBondContact O-N 3.27Å; M840-W843 HydrophobicContact CE-CE3 4.42Å; M840-W843 HydrophobicContact SD-CE3 4.09Å; M840-M844 HydrophobicContact CE-CE 3.65Å; M840-M844 HydrophobicContact CE-SD 4.31Å; M840-M844 VanDerWaalsContact O-CB 3.26Å; M840-M844 WeakPolarHBondContact O-CB 3.37Å; M840-M844 WeakPolarHBondContact O-CG 3.38Å; M840-M844 PolarHBondContact O-N 3.35Å; M840-L866 HydrophobicContact CE-CD1 3.95Å; M840-L866 HydrophobicContact SD-CD1 4.23Å; M840-L913 HydrophobicContact CB-CD1 3.89Å; M840-L913 HydrophobicContact CB-CD2 3.9Å; M840-L913 HydrophobicContact CE-CD1 3.81Å; M840-L913 HydrophobicContact CE-CD2 4.04Å; M840-L913 HydrophobicContact CE-CG 4.35Å; M840-L913 HydrophobicContact CG-CD1 4.46Å; M840-L913 HydrophobicContact CG-CD2 3.77Å; M840-I917 HydrophobicContact CE-CD1 3.9Å; M840-I917 HydrophobicContact CE-CG1 4.46Å
841	T	95.2	Very high	93.2	Very high	42 Å²	42	42.5 Å²	42.5	26%	0.258	23%	0.231	S	C	.	.	H	α-helix	trans	-63.3	-48.4	176.6	-61.4	0	0	0	0	111.2	E837 F838 V839 S845	E837-T841 VanDerWaalsContact O-CB 3.22Å; E837-T841 WeakPolarHBondContact O-CB 3.47Å; E837-T841 PolarHBondContact O-N 2.73Å; E837-T841 PolarHBondContact O-OG1 3.14Å; F838-T841 PolarHBondContact O-N 2.88Å; V839-T841 PolarHBondContact O-N 2.68Å; T841-S845 WeakPolarHBondContact O-CB 3.24Å; T841-S845 PolarHBondContact O-N 3.49Å; T841-S845 PolarHBondContact O-OG 3.09Å
842	E	95.9	Very high	94.1	Very high	41 Å²	41	39 Å²	39	19%	0.192	21%	0.214	C	C	.	.	H	α-helix	trans	-65.4	-43.4	-179.9	-65.8	-55.5	114.7	0	0	111.2	M793 M802 I806 F838 V839 S845 R846	M793-E842 HydrophobicContact CE-CB 4.07Å; M793-E842 HydrophobicContact CE-CG 4.43Å; M802-E842 HydrophobicContact CE-CB 3.72Å; M802-E842 HydrophobicContact CE-CG 3.88Å; M802-E842 WeakPolarHBondContact CE-OE2 3.5Å; I806-E842 HydrophobicContact CD1-CB 4.45Å; F838-E842 HydrophobicContact CD2-CG 3.97Å; F838-E842 HydrophobicContact CE2-CG 3.56Å; F838-E842 HydrophobicContact CZ-CG 3.92Å; F838-E842 WeakPolarHBondContact O-CG 3.31Å; F838-E842 PolarHBondContact O-N 3.08Å; V839-E842 PolarHBondContact O-N 3.04Å; E842-S845 PolarHBondContact O-N 3.08Å; E842-S845 PolarHBondContact O-OG 3.06Å; E842-R846 PolarHBondContact O-N 2.82Å; E842-R846 PolarHBondContact O-NH1 3.38Å; E842-R846 IonicContact OE2-CZ 3.07Å; E842-R846 IonicContact OE2-NH1 2.6Å; E842-R846 PolarHBondContact OE2-NH1 3.18Å; E842-R846 IonicContact OE2-NH2 3.03Å; E842-R846 PolarHBondContact OE2-NH2 3.47Å
843	W	97.5	Very high	94.5	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-63.7	-51.4	177.5	-171.2	0	0	0	0	112.3	I806 A810 V839 M840 S845 R846 Q847 F850 S859 A862 L863 L866	I806-W843 HydrophobicContact CD1-CB 4.3Å; I806-W843 HydrophobicContact CG2-CB 3.89Å; I806-W843 HydrophobicContact CG2-CD2 3.59Å; I806-W843 HydrophobicContact CG2-CE3 4.08Å; I806-W843 HydrophobicContact CG2-CG 3.49Å; I806-W843 VanDerWaalsContact CG2-CG 3.49Å; A810-W843 HydrophobicContact CB-CH2 3.65Å; A810-W843 HydrophobicContact CB-CZ2 3.78Å; V839-W843 WeakPolarHBondContact O-CB 3.45Å; V839-W843 PolarHBondContact O-N 3.25Å; M840-W843 HydrophobicContact CE-CE3 4.42Å; M840-W843 HydrophobicContact SD-CE3 4.09Å; W843-S845 PolarHBondContact O-N 2.94Å; W843-S845 VanDerWaalsContact O-N 3.14Å; W843-R846 PolarHBondContact O-N 3.04Å; W843-Q847 PolarHBondContact O-N 2.95Å; W843-F850 AromaticContact CD1-CE2 3.72Å; W843-F850 AromaticContact CD1-CZ 3.92Å; W843-F850 AromaticContact NE1-CE2 3.57Å; W843-S859 VanDerWaalsContact CZ2-OG 3.32Å; W843-S859 WeakPolarHBondContact CZ2-OG 3.43Å; W843-S859 PolarHBondContact NE1-OG 3.08Å; W843-S859 VanDerWaalsContact NE1-OG 3.07Å; W843-A862 HydrophobicContact CH2-CB 3.84Å; W843-A862 HydrophobicContact CZ2-CB 4.26Å; W843-L863 HydrophobicContact CD2-CD2 4.37Å; W843-L863 HydrophobicContact CH2-CD2 4.28Å; W843-L863 HydrophobicContact CZ2-CD2 3.88Å; W843-L863 HydrophobicContact CZ2-CG 4.05Å; W843-L866 HydrophobicContact CH2-CD1 4.28Å; W843-L866 HydrophobicContact CZ3-CD1 4.01Å
844	M	97.1	Very high	94.6	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-62.8	-27.5	-177.7	-69.5	-45.6	87.4	0	0	113	M840 R846 L863 V883 L913 K916 I917 L920	M840-M844 HydrophobicContact CE-CE 3.65Å; M840-M844 HydrophobicContact CE-SD 4.31Å; M840-M844 VanDerWaalsContact O-CB 3.26Å; M840-M844 WeakPolarHBondContact O-CB 3.37Å; M840-M844 WeakPolarHBondContact O-CG 3.38Å; M840-M844 PolarHBondContact O-N 3.35Å; M844-R846 VanDerWaalsContact C-N 3.34Å; M844-L863 HydrophobicContact CE-CD2 3.38Å; M844-L863 HydrophobicContact SD-CD2 4.3Å; M844-V883 HydrophobicContact CB-CG2 4.44Å; M844-V883 HydrophobicContact CG-CG2 4.37Å; M844-L913 HydrophobicContact CG-CD1 3.46Å; M844-L913 VanDerWaalsContact CG-CD1 3.46Å; M844-L913 HydrophobicContact SD-CD1 4.01Å; M844-K916 HydrophobicContact CB-CG 3.83Å; M844-K916 HydrophobicContact CG-CG 4Å; M844-K916 WeakPolarHBondContact O-CE 3.39Å; M844-K916 HydrophobicContact SD-CG 4.31Å; M844-I917 HydrophobicContact CE-CG1 4.3Å; M844-I917 HydrophobicContact SD-CB 4.41Å; M844-I917 HydrophobicContact SD-CD1 4.44Å; M844-I917 HydrophobicContact SD-CG1 3.41Å; M844-I917 WeakPolarHBondContact SD-CG1 3.29Å; M844-L920 HydrophobicContact CB-CD1 4.26Å; M844-L920 HydrophobicContact CE-CD1 4.24Å; M844-L920 HydrophobicContact CG-CD1 4.43Å; M844-L920 HydrophobicContact SD-CD1 3.45Å; M844-L920 WeakPolarHBondContact SD-CD1 3.1Å
845	S	95.2	Very high	94.6	Very high	49 Å²	49	33.5 Å²	33.5	34%	0.343	17%	0.167	S	C	.	.	H	α-helix	trans	-78.3	-15.8	177.4	70.8	0	0	0	0	114	T841 E842 W843 H848	T841-S845 WeakPolarHBondContact O-CB 3.24Å; T841-S845 PolarHBondContact O-N 3.49Å; T841-S845 PolarHBondContact O-OG 3.09Å; E842-S845 PolarHBondContact O-N 3.08Å; E842-S845 PolarHBondContact O-OG 3.06Å; W843-S845 PolarHBondContact O-N 2.94Å; W843-S845 VanDerWaalsContact O-N 3.14Å; S845-H848 PolarHBondContact O-CE1 3.05Å
846	R	96.4	Very high	94.5	Very high	43 Å²	43	34 Å²	34	16%	0.162	17%	0.172	C	C	.	.	H	α-helix	trans	-124.6	-10.2	-174.2	-69.1	179.4	-172.7	78.9	-13.7	114.9	L799 E842 W843 M844 H848 L849 F850	L799-R846 HydrophobicContact CD1-CB 4.1Å; L799-R846 HydrophobicContact CD1-CG 4.34Å; E842-R846 PolarHBondContact O-N 2.82Å; E842-R846 PolarHBondContact O-NH1 3.38Å; E842-R846 IonicContact OE2-CZ 3.07Å; E842-R846 IonicContact OE2-NH1 2.6Å; E842-R846 PolarHBondContact OE2-NH1 3.18Å; E842-R846 IonicContact OE2-NH2 3.03Å; E842-R846 PolarHBondContact OE2-NH2 3.47Å; W843-R846 PolarHBondContact O-N 3.04Å; M844-R846 VanDerWaalsContact C-N 3.34Å; R846-H848 VanDerWaalsContact C-N 3.26Å; R846-H848 PolarHBondContact O-N 3.11Å; R846-L849 WeakPolarHBondContact O-CA 3.21Å; R846-L849 WeakPolarHBondContact O-CB 3.39Å; R846-L849 PolarHBondContact O-N 3.21Å; R846-F850 HydrophobicContact CB-CE1 4Å; R846-F850 WeakPolarHBondContact O-CD1 3.46Å; R846-F850 PolarHBondContact O-N 3.21Å
847	Q	96.6	Very high	94.5	Very high	1 Å²	1	35 Å²	35	1%	0.005	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-48.1	-47.9	-179.6	172.4	58.9	32.9	0	0	112.9	W843 L849 F850 S859 L863 L920 E924	W843-Q847 PolarHBondContact O-N 2.95Å; Q847-L849 PolarHBondContact O-N 2.79Å; Q847-F850 PolarHBondContact O-N 3.41Å; Q847-S859 PolarHBondContact OE1-OG 3.47Å; Q847-L863 HydrophobicContact CG-CD1 3.7Å; Q847-L920 HydrophobicContact CB-CD1 3.8Å; Q847-L920 HydrophobicContact CB-CD2 3.97Å; Q847-L920 HydrophobicContact CB-CG 4.38Å; Q847-L920 HydrophobicContact CG-CB 4.2Å; Q847-L920 HydrophobicContact CG-CD1 4.07Å; Q847-L920 HydrophobicContact CG-CD2 4.07Å; Q847-L920 HydrophobicContact CG-CG 4.34Å; Q847-E924 PolarHBondContact NE2-OE1 2.83Å
848	H	94	Very high	94.5	Very high	98 Å²	98	33.4 Å²	33.4	45%	0.454	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-64.2	-5.6	179.8	69.9	-70.6	0	0	0	115.1	S845 R846 L920	S845-H848 PolarHBondContact O-CE1 3.05Å; R846-H848 VanDerWaalsContact C-N 3.26Å; R846-H848 PolarHBondContact O-N 3.11Å; H848-L920 HydrophobicContact CB-CD2 4.34Å
849	L	95	Very high	94.6	Very high	85 Å²	85	32.5 Å²	32.5	45%	0.445	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-110.9	-5.9	178.3	-53.2	174.6	0	0	0	112	L799 R846 Q847 Y851	L799-L849 HydrophobicContact CD1-CB 3.88Å; L799-L849 HydrophobicContact CD1-CD1 4.44Å; L799-L849 HydrophobicContact CD2-CB 3.62Å; L799-L849 HydrophobicContact CD2-CD1 4.48Å; L799-L849 WeakPolarHBondContact CD2-O 3.4Å; L799-L849 HydrophobicContact CG-CB 4.41Å; R846-L849 WeakPolarHBondContact O-CA 3.21Å; R846-L849 WeakPolarHBondContact O-CB 3.39Å; R846-L849 PolarHBondContact O-N 3.21Å; Q847-L849 PolarHBondContact O-N 2.79Å; L849-Y851 PolarHBondContact O-N 3.31Å
850	F	94.4	Very high	94.6	Very high	26 Å²	26	32.4 Å²	32.4	11%	0.114	16%	0.164	C	C	.	.			trans	-64.7	136.2	179.9	-72.6	-4.4	0	0	0	110.5	L799 Q803 I806 M807 W843 R846 Q847	L799-F850 HydrophobicContact CD1-CD1 4.19Å; L799-F850 HydrophobicContact CD1-CE1 4.35Å; Q803-F850 HydrophobicContact CB-CD1 3.85Å; Q803-F850 HydrophobicContact CB-CE1 3.74Å; Q803-F850 HydrophobicContact CB-CZ 4.36Å; Q803-F850 HydrophobicContact CG-CD1 3.75Å; Q803-F850 HydrophobicContact CG-CD2 4.37Å; Q803-F850 HydrophobicContact CG-CE1 3.96Å; Q803-F850 HydrophobicContact CG-CG 3.98Å; Q803-F850 HydrophobicContact CG-CZ 4.35Å; I806-F850 HydrophobicContact CB-CZ 4.1Å; I806-F850 HydrophobicContact CD1-CZ 4.06Å; I806-F850 HydrophobicContact CG2-CE2 4.11Å; I806-F850 HydrophobicContact CG2-CZ 3.85Å; M807-F850 HydrophobicContact SD-CD2 4.49Å; M807-F850 HydrophobicContact SD-CE2 4.37Å; W843-F850 AromaticContact CD1-CE2 3.72Å; W843-F850 AromaticContact CD1-CZ 3.92Å; W843-F850 AromaticContact NE1-CE2 3.57Å; R846-F850 HydrophobicContact CB-CE1 4Å; R846-F850 WeakPolarHBondContact O-CD1 3.46Å; R846-F850 PolarHBondContact O-N 3.21Å; Q847-F850 PolarHBondContact O-N 3.41Å
851	Y	92.1	Very high	94.7	Very high	111 Å²	111	32.4 Å²	32.4	44%	0.435	16%	0.164	S	C	.	.			trans	-113.6	166.9	177.9	59.7	-93.2	0	0	0	111	S800 Q803 L849	S800-Y851 VanDerWaalsContact CB-OH 3.29Å; S800-Y851 WeakPolarHBondContact CB-OH 3.34Å; Q803-Y851 PolarHBondContact NE2-O 2.96Å; L849-Y851 PolarHBondContact O-N 3.31Å
852	G	88.5	Confident	94.8	Very high	25 Å²	25	30.4 Å²	30.4	26%	0.258	15%	0.152	S	C	.	.			trans	94.3	127.6	-176.5	0	0	0	0	0	112.8	Y854 G856 E989	G852-Y854 PolarHBondContact O-N 2.99Å; G852-G856 PolarHBondContact O-N 3.28Å; G852-E989 WeakPolarHBondContact CA-OE2 3.43Å
853	Q	88.2	Confident	94.9	Very high	75 Å²	75	28.5 Å²	28.5	35%	0.35	14%	0.143	S	C	.	.	H	α-helix	trans	-62.7	-43.3	-176.2	-170.2	-169	69.7	0	0	111.8	K857	Q853-K857 WeakPolarHBondContact O-CG 3.37Å; Q853-K857 PolarHBondContact O-N 3.39Å
854	Y	91.7	Very high	94.9	Very high	23 Å²	23	28.4 Å²	28.4	9%	0.09	14%	0.143	C	C	.	.	H	α-helix	trans	-71.3	-49.2	-179.5	171.6	-109.8	0	0	0	111.6	H811 G852 G856 K857 V858 A995 D998 Y1001	H811-Y854 AromaticContact NE2-CE1 3.69Å; H811-Y854 AromaticContact NE2-CZ 3.76Å; H811-Y854 PolarHBondContact NE2-OH 3.35Å; H811-Y854 VanDerWaalsContact NE2-OH 3.1Å; G852-Y854 PolarHBondContact O-N 2.99Å; Y854-G856 VanDerWaalsContact C-N 3.28Å; Y854-G856 PolarHBondContact O-N 3.15Å; Y854-K857 PolarHBondContact O-N 3.43Å; Y854-K857 VanDerWaalsContact O-N 3.12Å; Y854-V858 HydrophobicContact CD1-CG2 4.47Å; Y854-V858 HydrophobicContact CD2-CG2 4.05Å; Y854-V858 HydrophobicContact CE1-CG2 3.97Å; Y854-V858 HydrophobicContact CE2-CG2 3.51Å; Y854-V858 VanDerWaalsContact CZ-CG2 3.46Å; Y854-V858 WeakPolarHBondContact O-CG2 3.42Å; Y854-V858 PolarHBondContact O-N 2.95Å; Y854-A995 HydrophobicContact CD1-CB 3.6Å; Y854-A995 HydrophobicContact CD2-CB 4.01Å; Y854-A995 HydrophobicContact CE1-CB 3.95Å; Y854-A995 HydrophobicContact CE2-CB 4.32Å; Y854-A995 HydrophobicContact CG-CB 3.63Å; Y854-D998 HydrophobicContact CE2-CB 3.75Å; Y854-D998 PolarHBondContact OH-OD2 2.95Å; Y854-Y1001 AromaticContact CD2-CD2 3.78Å; Y854-Y1001 HydrophobicContact CD2-CD2 3.78Å; Y854-Y1001 HydrophobicContact CG-CD2 4.21Å
855	E	93.3	Very high	94.9	Very high	19 Å²	19	31.4 Å²	31.4	9%	0.089	16%	0.156	C	C	.	.	H	α-helix	trans	-57	-43.1	177.5	-76.7	78	175.8	0	0	111	R765 M807 V858 S859	R765-E855 IonicContact CZ-OE1 2.62Å; R765-E855 IonicContact NE-OE1 3.68Å; R765-E855 PolarHBondContact NE-OE1 3.4Å; R765-E855 IonicContact NH2-OE1 3.57Å; R765-E855 PolarHBondContact NH2-OE1 3.32Å; M807-E855 HydrophobicContact CE-CB 4.07Å; M807-E855 HydrophobicContact CE-CG 4.21Å; M807-E855 WeakPolarHBondContact CE-O 3.47Å; M807-E855 HydrophobicContact CG-CG 4.37Å; M807-E855 HydrophobicContact SD-CB 4.39Å; E855-V858 PolarHBondContact O-N 3.33Å; E855-S859 VanDerWaalsContact O-CB 3.29Å; E855-S859 WeakPolarHBondContact O-CB 3.23Å; E855-S859 PolarHBondContact O-N 3.09Å
856	G	93.1	Very high	95.1	Very high	11 Å²	11	29.2 Å²	29.2	11%	0.113	14%	0.14	C	C	.	.	H	α-helix	trans	-57.8	-49.8	173.1	0	0	0	0	0	112.4	G852 Y854 V858 S859 T860	G852-G856 PolarHBondContact O-N 3.28Å; Y854-G856 VanDerWaalsContact C-N 3.28Å; Y854-G856 PolarHBondContact O-N 3.15Å; G856-V858 PolarHBondContact O-N 3.36Å; G856-S859 PolarHBondContact O-N 2.91Å; G856-T860 WeakPolarHBondContact O-CB 3.48Å; G856-T860 PolarHBondContact O-N 3.34Å; G856-T860 PolarHBondContact O-OG1 2.89Å
857	K	95.3	Very high	95.1	Very high	24 Å²	24	27.1 Å²	27.1	10%	0.104	13%	0.132	C	C	.	.	H	α-helix	trans	-60.2	-48	176.9	-72.6	-179.9	-168.6	-169.1	0	112.4	Q853 Y854 V861 I1000 Y1001 I1003 L1005	Q853-K857 WeakPolarHBondContact O-CG 3.37Å; Q853-K857 PolarHBondContact O-N 3.39Å; Y854-K857 PolarHBondContact O-N 3.43Å; Y854-K857 VanDerWaalsContact O-N 3.12Å; K857-V861 WeakPolarHBondContact O-CB 3.5Å; K857-V861 VanDerWaalsContact O-CG2 3.23Å; K857-V861 WeakPolarHBondContact O-CG2 3.46Å; K857-V861 PolarHBondContact O-N 3.49Å; K857-I1000 HydrophobicContact CB-CG2 3.88Å; K857-Y1001 PolarHBondContact NZ-O 3.02Å; K857-I1003 WeakPolarHBondContact CE-O 3.48Å; K857-I1003 PolarHBondContact NZ-O 3.42Å; K857-L1005 HydrophobicContact CG-CB 4.22Å; K857-L1005 HydrophobicContact CG-CD1 4.47Å; K857-L1005 HydrophobicContact CG-CD2 4.02Å; K857-L1005 HydrophobicContact CG-CG 4.47Å
858	V	96.3	Very high	95.1	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.5	-51.5	179.8	170.9	0	0	0	0	110.1	M807 A810 H814 Y854 E855 G856 T860 A862 I1000	M807-V858 HydrophobicContact CE-CB 3.71Å; M807-V858 HydrophobicContact CE-CG1 3.57Å; A810-V858 HydrophobicContact CB-CG1 4.22Å; H814-V858 PolarHBondContact NE2-O 2.91Å; Y854-V858 HydrophobicContact CD1-CG2 4.47Å; Y854-V858 HydrophobicContact CD2-CG2 4.05Å; Y854-V858 HydrophobicContact CE1-CG2 3.97Å; Y854-V858 HydrophobicContact CE2-CG2 3.51Å; Y854-V858 VanDerWaalsContact CZ-CG2 3.46Å; Y854-V858 WeakPolarHBondContact O-CG2 3.42Å; Y854-V858 PolarHBondContact O-N 2.95Å; E855-V858 PolarHBondContact O-N 3.33Å; G856-V858 PolarHBondContact O-N 3.36Å; V858-T860 PolarHBondContact O-N 2.95Å; V858-A862 VanDerWaalsContact O-CB 3.3Å; V858-A862 WeakPolarHBondContact O-CB 3.5Å; V858-A862 PolarHBondContact O-N 2.98Å; V858-I1000 HydrophobicContact CG2-CB 4.4Å; V858-I1000 HydrophobicContact CG2-CD1 4.23Å; V858-I1000 HydrophobicContact CG2-CG2 3.86Å
859	S	97.4	Very high	95.2	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.6	-48.8	-179.3	-168.6	0	0	0	0	111.9	W843 Q847 E855 G856 V861 A862 L863	W843-S859 VanDerWaalsContact CZ2-OG 3.32Å; W843-S859 WeakPolarHBondContact CZ2-OG 3.43Å; W843-S859 PolarHBondContact NE1-OG 3.08Å; W843-S859 VanDerWaalsContact NE1-OG 3.07Å; Q847-S859 PolarHBondContact OE1-OG 3.47Å; E855-S859 VanDerWaalsContact O-CB 3.29Å; E855-S859 WeakPolarHBondContact O-CB 3.23Å; E855-S859 PolarHBondContact O-N 3.09Å; G856-S859 PolarHBondContact O-N 2.91Å; S859-V861 PolarHBondContact O-N 2.96Å; S859-A862 WeakPolarHBondContact O-CB 3.23Å; S859-A862 PolarHBondContact O-N 3.34Å; S859-L863 WeakPolarHBondContact O-CG 3.3Å; S859-L863 PolarHBondContact O-N 2.89Å
860	T	97.3	Very high	95.2	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-66.6	-42	-175.7	-63.9	0	0	0	0	112.2	G856 V858 A862 L863 C864 E924 L1005 L1009	G856-T860 WeakPolarHBondContact O-CB 3.48Å; G856-T860 PolarHBondContact O-N 3.34Å; G856-T860 PolarHBondContact O-OG1 2.89Å; V858-T860 PolarHBondContact O-N 2.95Å; T860-A862 VanDerWaalsContact C-N 3.33Å; T860-A862 PolarHBondContact O-N 3.37Å; T860-L863 WeakPolarHBondContact O-CB 3.14Å; T860-L863 PolarHBondContact O-N 3.02Å; T860-C864 PolarHBondContact O-N 3.2Å; T860-C864 PolarHBondContact O-SG 3.02Å; T860-C864 VanDerWaalsContact O-SG 3.39Å; T860-E924 HydrophobicContact CG2-CB 3.8Å; T860-E924 HydrophobicContact CG2-CG 3.88Å; T860-E924 VanDerWaalsContact OG1-CD 3.3Å; T860-E924 WeakPolarHBondContact OG1-CG 3.3Å; T860-E924 PolarHBondContact OG1-OE2 3.43Å; T860-L1005 HydrophobicContact CG2-CD1 3.99Å; T860-L1009 HydrophobicContact CG2-CD1 3.94Å; T860-L1009 HydrophobicContact CG2-CD2 3.44Å; T860-L1009 VanDerWaalsContact CG2-CD2 3.44Å; T860-L1009 HydrophobicContact CG2-CG 4.18Å
861	V	97.4	Very high	95.2	Very high	4 Å²	4	24.3 Å²	24.3	2%	0.024	12%	0.118	C	C	.	.	H	α-helix	trans	-68.5	-33.6	175	176.2	0	0	0	0	111.1	K857 S859 L863 C864 K865 L1005 Y1008	K857-V861 WeakPolarHBondContact O-CB 3.5Å; K857-V861 VanDerWaalsContact O-CG2 3.23Å; K857-V861 WeakPolarHBondContact O-CG2 3.46Å; K857-V861 PolarHBondContact O-N 3.49Å; S859-V861 PolarHBondContact O-N 2.96Å; V861-L863 VanDerWaalsContact C-N 3.34Å; V861-C864 PolarHBondContact O-N 3.46Å; V861-K865 WeakPolarHBondContact O-CG 3.4Å; V861-K865 PolarHBondContact O-N 3.37Å; V861-L1005 HydrophobicContact CG2-CD1 4.32Å; V861-Y1008 HydrophobicContact CB-CE1 4.32Å; V861-Y1008 HydrophobicContact CG1-CE1 4.1Å; V861-Y1008 HydrophobicContact CG2-CD1 3.95Å; V861-Y1008 HydrophobicContact CG2-CE1 3.8Å
862	A	98	Very high	95.2	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.7	-42.5	172.9	0	0	0	0	0	111.7	A810 V813 H814 W843 V858 S859 T860 K865 L866	A810-A862 HydrophobicContact CB-CB 4.28Å; V813-A862 HydrophobicContact CB-CB 3.97Å; V813-A862 HydrophobicContact CG1-CB 3.9Å; V813-A862 HydrophobicContact CG2-CB 4.46Å; H814-A862 PolarHBondContact CE1-N 2.97Å; H814-A862 WeakPolarHBondContact NE2-CB 3.38Å; W843-A862 HydrophobicContact CH2-CB 3.84Å; W843-A862 HydrophobicContact CZ2-CB 4.26Å; V858-A862 VanDerWaalsContact O-CB 3.3Å; V858-A862 WeakPolarHBondContact O-CB 3.5Å; V858-A862 PolarHBondContact O-N 2.98Å; S859-A862 WeakPolarHBondContact O-CB 3.23Å; S859-A862 PolarHBondContact O-N 3.34Å; T860-A862 VanDerWaalsContact C-N 3.33Å; T860-A862 PolarHBondContact O-N 3.37Å; A862-K865 PolarHBondContact O-N 3.01Å; A862-L866 WeakPolarHBondContact O-CG 3.36Å; A862-L866 PolarHBondContact O-N 3.26Å
863	L	98.4	Very high	95.5	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62.1	-42.9	175.2	-69.8	-179	0	0	0	112.2	W843 M844 Q847 S859 T860 V861 K865 L866 L867 I917 L920 I921	W843-L863 HydrophobicContact CD2-CD2 4.37Å; W843-L863 HydrophobicContact CH2-CD2 4.28Å; W843-L863 HydrophobicContact CZ2-CD2 3.88Å; W843-L863 HydrophobicContact CZ2-CG 4.05Å; M844-L863 HydrophobicContact CE-CD2 3.38Å; M844-L863 HydrophobicContact SD-CD2 4.3Å; Q847-L863 HydrophobicContact CG-CD1 3.7Å; S859-L863 WeakPolarHBondContact O-CG 3.3Å; S859-L863 PolarHBondContact O-N 2.89Å; T860-L863 WeakPolarHBondContact O-CB 3.14Å; T860-L863 PolarHBondContact O-N 3.02Å; V861-L863 VanDerWaalsContact C-N 3.34Å; L863-K865 VanDerWaalsContact C-N 3.33Å; L863-K865 PolarHBondContact O-N 3.49Å; L863-L866 HydrophobicContact CD2-CD1 4.44Å; L863-L866 PolarHBondContact O-N 2.96Å; L863-L867 WeakPolarHBondContact O-CB 3.39Å; L863-L867 PolarHBondContact O-N 3.46Å; L863-I917 HydrophobicContact CB-CG2 3.96Å; L863-I917 HydrophobicContact CD2-CG1 4.29Å; L863-I917 HydrophobicContact CD2-CG2 4.38Å; L863-I917 WeakPolarHBondContact O-CG2 3.5Å; L863-L920 HydrophobicContact CD1-CB 4.48Å; L863-I921 HydrophobicContact CB-CD1 4.46Å; L863-I921 HydrophobicContact CB-CG1 4.28Å
864	C	98.1	Very high	95.7	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-57.9	-44.5	173	-69.2	0	0	0	0	111.9	T860 V861 L867 Q868 I921 Y1008 F1012	T860-C864 PolarHBondContact O-N 3.2Å; T860-C864 PolarHBondContact O-SG 3.02Å; T860-C864 VanDerWaalsContact O-SG 3.39Å; V861-C864 PolarHBondContact O-N 3.46Å; C864-L867 PolarHBondContact O-N 2.93Å; C864-Q868 WeakPolarHBondContact O-CB 3.43Å; C864-Q868 PolarHBondContact O-N 3.5Å; C864-I921 HydrophobicContact CB-CD1 4.46Å; C864-Y1008 HydrophobicContact CB-CE1 4.03Å; C864-F1012 HydrophobicContact CB-CD1 4.36Å; C864-F1012 HydrophobicContact CB-CD2 3.81Å; C864-F1012 HydrophobicContact CB-CE1 4.23Å; C864-F1012 HydrophobicContact CB-CE2 3.64Å; C864-F1012 HydrophobicContact CB-CG 4.17Å; C864-F1012 HydrophobicContact CB-CZ 3.87Å; C864-F1012 WeakPolarHBondContact O-CE2 3.13Å; C864-F1012 WeakPolarHBondContact O-CZ 3.4Å
865	K	97.4	Very high	95.8	Very high	65 Å²	65	25.9 Å²	25.9	28%	0.283	14%	0.141	S	C	.	.	H	α-helix	trans	-64.9	-42.6	177	-73.2	-179.3	177.4	-176.7	0	112.7	V813 H814 V861 A862 L863 Q868 H869	V813-K865 HydrophobicContact CG1-CB 3.99Å; V813-K865 HydrophobicContact CG1-CD 4.39Å; H814-K865 PolarHBondContact ND1-NZ 2.92Å; H814-K865 VanDerWaalsContact ND1-NZ 3.2Å; V861-K865 WeakPolarHBondContact O-CG 3.4Å; V861-K865 PolarHBondContact O-N 3.37Å; A862-K865 PolarHBondContact O-N 3.01Å; L863-K865 VanDerWaalsContact C-N 3.33Å; L863-K865 PolarHBondContact O-N 3.49Å; K865-Q868 PolarHBondContact O-N 2.92Å; K865-H869 VanDerWaalsContact O-CB 3.27Å; K865-H869 WeakPolarHBondContact O-CB 3.42Å; K865-H869 PolarHBondContact O-N 3.31Å
866	L	98	Very high	95.9	Very high	3 Å²	3	29.6 Å²	29.6	2%	0.016	16%	0.156	C	C	.	.	H	α-helix	trans	-61.5	-43.9	176.2	-77.3	167.6	0	0	0	111.6	V813 L817 L821 M840 W843 A862 L863 G870 L878 I917	V813-L866 HydrophobicContact CG1-CG 4.21Å; V813-L866 HydrophobicContact CG2-CD1 4.15Å; V813-L866 HydrophobicContact CG2-CD2 4.27Å; V813-L866 HydrophobicContact CG2-CG 4.2Å; L817-L866 HydrophobicContact CD1-CD2 3.77Å; L821-L866 HydrophobicContact CD2-CD2 4.37Å; M840-L866 HydrophobicContact CE-CD1 3.95Å; M840-L866 HydrophobicContact SD-CD1 4.23Å; W843-L866 HydrophobicContact CH2-CD1 4.28Å; W843-L866 HydrophobicContact CZ3-CD1 4.01Å; A862-L866 WeakPolarHBondContact O-CG 3.36Å; A862-L866 PolarHBondContact O-N 3.26Å; L863-L866 HydrophobicContact CD2-CD1 4.44Å; L863-L866 PolarHBondContact O-N 2.96Å; L866-G870 PolarHBondContact O-N 2.64Å; L866-L878 HydrophobicContact CD2-CD1 4.19Å; L866-L878 HydrophobicContact CD2-CD2 4.42Å; L866-I917 HydrophobicContact CB-CD1 4.29Å
867	L	97.5	Very high	96	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.5	-47.5	177.1	180	58.4	0	0	0	111.5	L863 C864 G870 I871 L914 I917 F918 I921 F1012 F1016 F1025	L863-L867 WeakPolarHBondContact O-CB 3.39Å; L863-L867 PolarHBondContact O-N 3.46Å; C864-L867 PolarHBondContact O-N 2.93Å; L867-G870 PolarHBondContact O-N 3.5Å; L867-I871 HydrophobicContact CD1-CD1 3.72Å; L867-I871 HydrophobicContact CG-CD1 4.3Å; L867-I871 PolarHBondContact O-N 2.94Å; L867-L914 HydrophobicContact CD1-CB 3.83Å; L867-L914 HydrophobicContact CD1-CD2 4.21Å; L867-L914 HydrophobicContact CD1-CG 4.43Å; L867-I917 HydrophobicContact CB-CG2 3.91Å; L867-I917 HydrophobicContact CD2-CG2 4.46Å; L867-F918 HydrophobicContact CD2-CB 4.03Å; L867-F918 HydrophobicContact CD2-CD2 4.07Å; L867-I921 HydrophobicContact CB-CD1 4.47Å; L867-I921 HydrophobicContact CD2-CD1 3.83Å; L867-F1012 HydrophobicContact CB-CZ 4.3Å; L867-F1012 HydrophobicContact CD2-CE1 3.95Å; L867-F1012 HydrophobicContact CD2-CZ 4.02Å; L867-F1012 HydrophobicContact CG-CZ 4.34Å; L867-F1016 HydrophobicContact CD1-CE2 4.04Å; L867-F1016 HydrophobicContact CD1-CZ 4.13Å; L867-F1016 HydrophobicContact CD2-CD2 4.22Å; L867-F1016 HydrophobicContact CD2-CE2 3.77Å; L867-F1016 HydrophobicContact CD2-CZ 4.01Å; L867-F1016 HydrophobicContact CG-CD2 4.44Å; L867-F1016 HydrophobicContact CG-CE2 3.75Å; L867-F1016 HydrophobicContact CG-CZ 4.22Å; L867-F1025 HydrophobicContact CD1-CE1 3.97Å; L867-F1025 HydrophobicContact CD1-CZ 4.31Å
868	Q	95.7	Very high	96	Very high	78 Å²	78	31.3 Å²	31.3	36%	0.364	16%	0.159	S	C	.	.	H	α-helix	trans	-62.5	-44.1	178.9	-173.1	177.3	14.7	0	0	112.1	C864 K865 N872 F1012	C864-Q868 WeakPolarHBondContact O-CB 3.43Å; C864-Q868 PolarHBondContact O-N 3.5Å; K865-Q868 PolarHBondContact O-N 2.92Å; Q868-N872 WeakPolarHBondContact CG-ND2 3.48Å; Q868-N872 VanDerWaalsContact O-CB 3.24Å; Q868-N872 WeakPolarHBondContact O-CB 3.39Å; Q868-N872 VanDerWaalsContact O-CG 3.24Å; Q868-N872 PolarHBondContact O-N 3.48Å; Q868-F1012 HydrophobicContact CB-CE2 4.2Å
869	H	96.1	Very high	95.8	Very high	39 Å²	39	33.7 Å²	33.7	18%	0.181	17%	0.17	C	C	.	.	H	α-helix	trans	-64.9	-47.9	177.6	-179.5	77.5	0	0	0	111.8	L817 E818 K865 I871 N872 A873 D875	L817-H869 HydrophobicContact CD2-CB 3.82Å; E818-H869 IonicContact OE2-CE1 3.85Å; E818-H869 PolarHBondContact OE2-CE1 2.82Å; E818-H869 IonicContact OE2-NE2 3.67Å; E818-H869 PolarHBondContact OE2-NE2 3.38Å; K865-H869 VanDerWaalsContact O-CB 3.27Å; K865-H869 WeakPolarHBondContact O-CB 3.42Å; K865-H869 PolarHBondContact O-N 3.31Å; H869-I871 PolarHBondContact O-N 2.68Å; H869-I871 VanDerWaalsContact O-N 3.14Å; H869-N872 PolarHBondContact O-N 2.72Å; H869-A873 WeakPolarHBondContact O-CB 3.34Å; H869-A873 PolarHBondContact O-N 3.03Å; H869-D875 IonicContact CD2-OD2 3.42Å; H869-D875 IonicContact NE2-OD2 3.18Å; H869-D875 PolarHBondContact NE2-OD2 3.47Å
870	G	95.1	Very high	95.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57.7	-29.9	-179.5	0	0	0	0	0	113.8	L866 L867 D875 Q879	L866-G870 PolarHBondContact O-N 2.64Å; L867-G870 PolarHBondContact O-N 3.5Å; G870-D875 PolarHBondContact O-N 3.05Å; G870-Q879 PolarHBondContact O-NE2 3.48Å
871	I	94.1	Very high	95.6	Very high	33 Å²	33	40 Å²	40	17%	0.169	20%	0.204	C	C	.	.	H	α-helix	trans	-89.8	-50	176.9	-72	159.6	0	0	0	111.9	L867 H869 A873 D874 L914 F1016 F1025	L867-I871 HydrophobicContact CD1-CD1 3.72Å; L867-I871 HydrophobicContact CG-CD1 4.3Å; L867-I871 PolarHBondContact O-N 2.94Å; H869-I871 PolarHBondContact O-N 2.68Å; H869-I871 VanDerWaalsContact O-N 3.14Å; I871-A873 PolarHBondContact O-N 2.94Å; I871-D874 PolarHBondContact O-N 3.02Å; I871-L914 HydrophobicContact CG1-CD1 4.11Å; I871-F1016 HydrophobicContact CD1-CE2 3.32Å; I871-F1016 HydrophobicContact CD1-CZ 3.63Å; I871-F1025 HydrophobicContact CD1-CE2 4.24Å; I871-F1025 HydrophobicContact CD1-CZ 3.9Å
872	N	93.6	Very high	95.5	Very high	105 Å²	105	43.6 Å²	43.6	56%	0.561	22%	0.221	S	C	*	.	H	α-helix	trans	-67.1	-35.9	-174.1	-72.2	-8.9	0	0	0	112.9	Q868 H869	Q868-N872 WeakPolarHBondContact CG-ND2 3.48Å; Q868-N872 VanDerWaalsContact O-CB 3.24Å; Q868-N872 WeakPolarHBondContact O-CB 3.39Å; Q868-N872 VanDerWaalsContact O-CG 3.24Å; Q868-N872 PolarHBondContact O-N 3.48Å; H869-N872 PolarHBondContact O-N 2.72Å
873	A	92.9	Very high	95.3	Very high	60 Å²	60	43.8 Å²	43.8	50%	0.496	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-1	179.9	0	0	0	0	0	113.5	H869 I871 D875	H869-A873 WeakPolarHBondContact O-CB 3.34Å; H869-A873 PolarHBondContact O-N 3.03Å; I871-A873 PolarHBondContact O-N 2.94Å; A873-D875 PolarHBondContact O-N 3.15Å
874	D	92.8	Very high	95.1	Very high	89 Å²	89	50 Å²	50	48%	0.476	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	44.1	-170.2	-163.5	38.1	0	0	0	113.3	I871 K876 Q879	I871-D874 PolarHBondContact O-N 3.02Å; D874-K876 PolarHBondContact O-N 3.22Å; D874-K876 IonicContact OD1-NZ 2.8Å; D874-K876 PolarHBondContact OD1-NZ 2.81Å; D874-K876 WeakPolarHBondContact OD2-CE 3.45Å; D874-K876 IonicContact OD2-NZ 3.01Å; D874-K876 PolarHBondContact OD2-NZ 3.43Å; D874-Q879 PolarHBondContact OD1-NE2 3.1Å; D874-Q879 PolarHBondContact OD1-OE1 3.01Å
875	D	95.2	Very high	94.8	Very high	14 Å²	14	50 Å²	50	8%	0.075	25%	0.249	C	C	.	.			trans	-74.8	99.8	-172.7	-168.1	-13.8	0	0	0	112.2	H869 G870 A873 R877 L878 Q879	H869-D875 IonicContact CD2-OD2 3.42Å; H869-D875 IonicContact NE2-OD2 3.18Å; H869-D875 PolarHBondContact NE2-OD2 3.47Å; G870-D875 PolarHBondContact O-N 3.05Å; A873-D875 PolarHBondContact O-N 3.15Å; D875-R877 PolarHBondContact O-N 3.2Å; D875-R877 WeakPolarHBondContact OD1-CB 3.45Å; D875-R877 WeakPolarHBondContact OD1-CG 3.47Å; D875-R877 IonicContact OD1-CZ 2.8Å; D875-R877 PolarHBondContact OD1-N 3.05Å; D875-R877 IonicContact OD1-NE 2.91Å; D875-R877 PolarHBondContact OD1-NE 2.96Å; D875-R877 IonicContact OD1-NH2 3.82Å; D875-R877 IonicContact OD2-CZ 2.73Å; D875-R877 IonicContact OD2-NE 3.18Å; D875-R877 PolarHBondContact OD2-NE 3.41Å; D875-R877 IonicContact OD2-NH2 2.67Å; D875-R877 PolarHBondContact OD2-NH2 3.01Å; D875-L878 PolarHBondContact O-N 3.41Å; D875-L878 VanDerWaalsContact O-N 3.11Å; D875-Q879 PolarHBondContact O-N 3.22Å; D875-Q879 VanDerWaalsContact O-N 3.15Å
876	K	94.2	Very high	94.3	Very high	96 Å²	96	49.6 Å²	49.6	42%	0.417	25%	0.248	S	C	.	.	H	α-helix	trans	-61.2	-24.3	179.4	-58.8	-58.1	172	-154.3	0	113.7	D874 L878 Q879 D880	D874-K876 PolarHBondContact O-N 3.22Å; D874-K876 IonicContact OD1-NZ 2.8Å; D874-K876 PolarHBondContact OD1-NZ 2.81Å; D874-K876 WeakPolarHBondContact OD2-CE 3.45Å; D874-K876 IonicContact OD2-NZ 3.01Å; D874-K876 PolarHBondContact OD2-NZ 3.43Å; K876-L878 PolarHBondContact O-N 3.26Å; K876-Q879 PolarHBondContact O-N 3.38Å; K876-D880 WeakPolarHBondContact O-CB 3.49Å; K876-D880 PolarHBondContact O-N 3.24Å; K876-D880 VanDerWaalsContact O-N 3.13Å
877	R	94.8	Very high	93.6	Very high	72 Å²	72	51.9 Å²	51.9	27%	0.272	26%	0.259	S	S	.	.	H	α-helix	trans	-60.3	-31.2	176.7	-58.7	172.6	-66.3	-170.7	-1.1	111.4	E818 L836 D875 I881	E818-R877 VanDerWaalsContact CD-NH2 3.3Å; E818-R877 IonicContact OE1-CZ 3.68Å; E818-R877 VanDerWaalsContact OE1-CZ 3.29Å; E818-R877 IonicContact OE1-NH1 2.98Å; E818-R877 PolarHBondContact OE1-NH1 3.43Å; E818-R877 IonicContact OE1-NH2 2.66Å; E818-R877 PolarHBondContact OE1-NH2 3.07Å; E818-R877 IonicContact OE2-NH2 3.33Å; E818-R877 PolarHBondContact OE2-NH2 3.19Å; L836-R877 HydrophobicContact CD2-CB 3.99Å; D875-R877 PolarHBondContact O-N 3.2Å; D875-R877 WeakPolarHBondContact OD1-CB 3.45Å; D875-R877 WeakPolarHBondContact OD1-CG 3.47Å; D875-R877 IonicContact OD1-CZ 2.8Å; D875-R877 PolarHBondContact OD1-N 3.05Å; D875-R877 IonicContact OD1-NE 2.91Å; D875-R877 PolarHBondContact OD1-NE 2.96Å; D875-R877 IonicContact OD1-NH2 3.82Å; D875-R877 IonicContact OD2-CZ 2.73Å; D875-R877 IonicContact OD2-NE 3.18Å; D875-R877 PolarHBondContact OD2-NE 3.41Å; D875-R877 IonicContact OD2-NH2 2.67Å; D875-R877 PolarHBondContact OD2-NH2 3.01Å; R877-I881 WeakPolarHBondContact O-CD1 3.43Å; R877-I881 WeakPolarHBondContact O-CG1 3.47Å
878	L	95	Very high	92.9	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-95.9	-40	177.8	-66.2	172.8	0	0	0	112.6	L821 L836 L866 D875 K876 D880 I881 L913 L914	L821-L878 HydrophobicContact CD1-CD1 4.25Å; L821-L878 HydrophobicContact CD2-CD1 4.48Å; L821-L878 HydrophobicContact CD2-CD2 4.03Å; L821-L878 HydrophobicContact CD2-CG 4.4Å; L836-L878 HydrophobicContact CD1-CD2 4.32Å; L836-L878 HydrophobicContact CD2-CD2 4.07Å; L866-L878 HydrophobicContact CD2-CD1 4.19Å; L866-L878 HydrophobicContact CD2-CD2 4.42Å; D875-L878 PolarHBondContact O-N 3.41Å; D875-L878 VanDerWaalsContact O-N 3.11Å; K876-L878 PolarHBondContact O-N 3.26Å; L878-D880 VanDerWaalsContact C-N 3.35Å; L878-D880 PolarHBondContact O-N 2.95Å; L878-I881 PolarHBondContact O-N 2.84Å; L878-L913 HydrophobicContact CD2-CD2 4.07Å; L878-L914 HydrophobicContact CB-CD2 4.26Å
879	Q	93.7	Very high	92.1	Very high	50 Å²	50	60.1 Å²	60.1	23%	0.234	29%	0.294	C	S	.	.	H	α-helix	trans	-66.4	-33.7	-176.2	-67.5	178.2	8.8	0	0	113.5	G870 D874 D875 K876 I881 L914	G870-Q879 PolarHBondContact O-NE2 3.48Å; D874-Q879 PolarHBondContact OD1-NE2 3.1Å; D874-Q879 PolarHBondContact OD1-OE1 3.01Å; D875-Q879 PolarHBondContact O-N 3.22Å; D875-Q879 VanDerWaalsContact O-N 3.15Å; K876-Q879 PolarHBondContact O-N 3.38Å; Q879-I881 VanDerWaalsContact C-N 3.29Å; Q879-I881 PolarHBondContact O-N 3.37Å; Q879-L914 HydrophobicContact CG-CD1 3.77Å
880	D	94.4	Very high	91.1	Very high	122 Å²	122	62.3 Å²	62.3	65%	0.652	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-7	-174.4	-67.3	-14.6	0	0	0	113.2	K876 L878	K876-D880 WeakPolarHBondContact O-CB 3.49Å; K876-D880 PolarHBondContact O-N 3.24Å; K876-D880 VanDerWaalsContact O-N 3.13Å; L878-D880 VanDerWaalsContact C-N 3.35Å; L878-D880 PolarHBondContact O-N 2.95Å
881	I	95.7	Very high	90.1	Very high	11 Å²	11	69.7 Å²	69.7	6%	0.056	35%	0.346	C	S	.	.			trans	-78.5	134.9	179.6	-63.7	172.1	0	0	0	110.2	L836 E837 R877 L878 Q879 V883 L913	L836-I881 HydrophobicContact CD2-CD1 4.02Å; L836-I881 HydrophobicContact CG-CD1 3.85Å; E837-I881 HydrophobicContact CB-CD1 4.39Å; E837-I881 HydrophobicContact CB-CG1 4.44Å; E837-I881 HydrophobicContact CG-CG2 4.07Å; R877-I881 WeakPolarHBondContact O-CD1 3.43Å; R877-I881 WeakPolarHBondContact O-CG1 3.47Å; L878-I881 PolarHBondContact O-N 2.84Å; Q879-I881 VanDerWaalsContact C-N 3.29Å; Q879-I881 PolarHBondContact O-N 3.37Å; I881-V883 HydrophobicContact CG2-CG1 4.01Å; I881-L913 HydrophobicContact CB-CB 3.89Å; I881-L913 HydrophobicContact CB-CD2 3.97Å; I881-L913 HydrophobicContact CD1-CD2 3.92Å; I881-L913 HydrophobicContact CG2-CB 3.98Å; I881-L913 HydrophobicContact CG2-CD2 4.09Å; I881-L913 HydrophobicContact CG2-CG 4.5Å; I881-L913 WeakPolarHBondContact O-CB 3.49Å; I881-L913 PolarHBondContact O-N 3.1Å
882	M	95	Very high	89.3	Confident	78 Å²	78	76.3 Å²	76.3	38%	0.384	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	132.7	175.8	-63.5	-66.4	-64.8	0	0	110.1	I911 P912	M882-I911 WeakPolarHBondContact CA-O 3.36Å; M882-I911 VanDerWaalsContact CE-C 3.44Å; M882-P912 HydrophobicContact SD-CB 4.26Å; M882-P912 HydrophobicContact SD-CG 4.05Å
883	V	94.8	Very high	88.5	Confident	5 Å²	5	76 Å²	76	3%	0.03	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	164.5	-177.7	-62.1	0	0	0	0	111.7	M844 I881 G885 N910 I911 L913 K916	M844-V883 HydrophobicContact CB-CG2 4.44Å; M844-V883 HydrophobicContact CG-CG2 4.37Å; I881-V883 HydrophobicContact CG2-CG1 4.01Å; V883-G885 PolarHBondContact O-N 3.42Å; V883-N910 PolarHBondContact O-OD1 3.3Å; V883-N910 VanDerWaalsContact O-OD1 3.07Å; V883-I911 PolarHBondContact N-O 3.32Å; V883-I911 PolarHBondContact O-N 2.71Å; V883-L913 HydrophobicContact CG1-CD1 4.16Å; V883-L913 HydrophobicContact CG2-CD1 4.39Å; V883-K916 HydrophobicContact CG2-CB 3.53Å; V883-K916 HydrophobicContact CG2-CG 3.79Å
884	K	92.9	Very high	88.1	Confident	131 Å²	131	76 Å²	76	57%	0.57	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.1	131.1	172.2	-66.6	179.9	-178.1	175.9	0	110.2
885	G	91.6	Very high	87.8	Confident	0 Å²	0	78.8 Å²	78.8	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-99.4	177.8	0	0	0	0	0	111.8	V883 T909 K916	V883-G885 PolarHBondContact O-N 3.42Å; G885-T909 WeakPolarHBondContact CA-OG1 3.34Å; G885-T909 PolarHBondContact N-O 3.02Å; G885-K916 PolarHBondContact O-NZ 2.89Å
886	E	87.1	Confident	87.1	Confident	56 Å²	56	82.4 Å²	82.4	26%	0.262	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	152.3	-176.8	-66.9	170.1	-177	0	0	110.9	W908 T909 K919 N1030	E886-W908 VanDerWaalsContact C-CE3 3.41Å; E886-W908 WeakPolarHBondContact O-CA 3.21Å; E886-T909 PolarHBondContact N-OG1 2.61Å; E886-T909 PolarHBondContact O-N 3.17Å; E886-T909 PolarHBondContact O-OG1 3.23Å; E886-K919 IonicContact OE1-NZ 2.79Å; E886-K919 PolarHBondContact OE1-NZ 3.31Å; E886-N1030 PolarHBondContact OE1-ND2 2.81Å
887	E	84.4	Confident	86.8	Confident	51 Å²	51	80.9 Å²	80.9	24%	0.238	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	136.8	170	-159.5	-170.6	171.7	0	0	110.7	R896 E906 W908	E887-R896 IonicContact OE1-CZ 3.68Å; E887-R896 IonicContact OE1-NH1 2.72Å; E887-R896 PolarHBondContact OE1-NH1 3.35Å; E887-R896 IonicContact OE1-NH2 3.29Å; E887-E906 HydrophobicContact CG-CB 4.28Å; E887-E906 WeakPolarHBondContact OE1-CB 3.37Å; E887-E906 WeakPolarHBondContact OE1-CG 3.46Å; E887-W908 HydrophobicContact CB-CD2 4.14Å; E887-W908 HydrophobicContact CB-CE3 4.22Å; E887-W908 HydrophobicContact CB-CH2 3.96Å; E887-W908 HydrophobicContact CB-CZ2 3.87Å; E887-W908 HydrophobicContact CB-CZ3 4.14Å; E887-W908 HydrophobicContact CG-CD2 4.41Å; E887-W908 HydrophobicContact CG-CZ2 4.15Å
888	I	81.5	Confident	86.3	Confident	100 Å²	100	88.3 Å²	88.3	51%	0.513	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	108.1	175.5	-53.9	172.2	0	0	0	108.1	R907 T909	I888-R907 HydrophobicContact CB-CB 4.38Å; I888-R907 HydrophobicContact CD1-CB 4.41Å; I888-R907 PolarHBondContact N-O 3.27Å; I888-T909 HydrophobicContact CD1-CG2 3.86Å; I888-T909 HydrophobicContact CG1-CG2 3.94Å
889	Y	78.4	Confident	85.9	Confident	151 Å²	151	92.4 Å²	92.4	59%	0.592	46%	0.462	S	S	*	.			trans	-124.7	156.7	174.5	58.1	-92.4	0	0	0	112	L891	Y889-L891 HydrophobicContact CE2-CD2 3.95Å
890	N	76.4	Confident	85.5	Confident	84 Å²	84	94.6 Å²	94.6	45%	0.449	47%	0.47	S	S	.	.			trans	-94.3	124.9	175.2	-174.2	6.2	0	0	0	109.5	E892 D893	N890-E892 PolarHBondContact O-N 2.78Å; N890-E892 PolarHBondContact OD1-N 3.31Å; N890-D893 PolarHBondContact O-N 3.23Å
891	L	73.4	Confident	85	Confident	156 Å²	156	90.1 Å²	90.1	82%	0.817	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-18.1	179.7	-70.6	162.3	0	0	0	112.8	Y889	Y889-L891 HydrophobicContact CE2-CD2 3.95Å
892	E	77.5	Confident	84.5	Confident	172 Å²	172	93.4 Å²	93.4	80%	0.804	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-12.7	-179.1	-61	-177.5	169.5	0	0	114.4	N890 G894	N890-E892 PolarHBondContact O-N 2.78Å; N890-E892 PolarHBondContact OD1-N 3.31Å; E892-G894 VanDerWaalsContact C-N 3.25Å; E892-G894 PolarHBondContact O-N 3.36Å
893	D	77	Confident	84	Confident	97 Å²	97	98.1 Å²	98.1	52%	0.519	50%	0.496	S	S	.	.	S	Bend	trans	-80.6	4.1	-168.1	-81.9	-16.3	0	0	0	115.3	N890 K900	N890-D893 PolarHBondContact O-N 3.23Å; D893-K900 PolarHBondContact O-NZ 3.38Å
894	G	85.1	Confident	83.4	Confident	61 Å²	61	103 Å²	103	63%	0.629	52%	0.522	S	S	*	.			trans	57.6	-154	-177.2	0	0	0	0	0	112.9	E892 R896	E892-G894 VanDerWaalsContact C-N 3.25Å; E892-G894 PolarHBondContact O-N 3.36Å; G894-R896 PolarHBondContact O-N 3.29Å
895	I	86.1	Confident	82.7	Confident	147 Å²	147	101.3 Å²	101.3	75%	0.754	52%	0.524	S	S	*	.	S	Bend	trans	-59.9	122.6	179.4	-58	174.7	0	0	0	110.2	T897 K900	I895-T897 HydrophobicContact CG2-CG2 4.41Å; I895-K900 WeakPolarHBondContact O-CD 3.4Å; I895-K900 PolarHBondContact O-NZ 2.87Å
896	R	79.6	Confident	82	Confident	91 Å²	91	106.1 Å²	106.1	34%	0.343	55%	0.547	S	S	.	.			trans	-94	98.5	179.1	-169.1	176.3	-178.9	-170.8	-7.2	111.2	E887 G894 K900 N904	E887-R896 IonicContact OE1-CZ 3.68Å; E887-R896 IonicContact OE1-NH1 2.72Å; E887-R896 PolarHBondContact OE1-NH1 3.35Å; E887-R896 IonicContact OE1-NH2 3.29Å; G894-R896 PolarHBondContact O-N 3.29Å; R896-K900 HydrophobicContact CG-CB 4.22Å; R896-N904 PolarHBondContact NH2-O 2.85Å
897	T	87.5	Confident	81.8	Confident	63 Å²	63	112.5 Å²	112.5	39%	0.387	57%	0.568	S	S	.	*			trans	-79.9	163.4	177.7	62.3	0	0	0	0	112.5	I895 S899 K900 S901	I895-T897 HydrophobicContact CG2-CG2 4.41Å; T897-S899 PolarHBondContact O-N 3.48Å; T897-S899 VanDerWaalsContact O-N 3.14Å; T897-S899 PolarHBondContact OG1-OG 2.84Å; T897-S899 VanDerWaalsContact OG1-OG 3.05Å; T897-K900 WeakPolarHBondContact O-CA 3.47Å; T897-K900 WeakPolarHBondContact O-CB 3.45Å; T897-K900 PolarHBondContact O-N 3.02Å; T897-S901 PolarHBondContact O-N 3.12Å
898	R	84.8	Confident	81.9	Confident	229 Å²	229	115.5 Å²	115.5	86%	0.864	58%	0.578	S	S	*	*	H	α-helix	trans	-52.5	-33.5	174	-69.8	-177.8	-76.8	180	-4.5	113.5	S901 A902	R898-S901 WeakPolarHBondContact CA-OG 3.18Å; R898-S901 PolarHBondContact O-OG 2.76Å; R898-S901 VanDerWaalsContact O-OG 3.08Å; R898-A902 VanDerWaalsContact O-CB 3.29Å; R898-A902 WeakPolarHBondContact O-CB 3.25Å; R898-A902 PolarHBondContact O-N 3.4Å
899	S	86.3	Confident	82.4	Confident	86 Å²	86	113.1 Å²	113.1	60%	0.601	57%	0.568	S	S	*	*	H	α-helix	trans	-72.8	-36.2	176.2	61.1	0	0	0	0	112.7	T897 K903	T897-S899 PolarHBondContact O-N 3.48Å; T897-S899 VanDerWaalsContact O-N 3.14Å; T897-S899 PolarHBondContact OG1-OG 2.84Å; T897-S899 VanDerWaalsContact OG1-OG 3.05Å; S899-K903 WeakPolarHBondContact O-CB 3.44Å; S899-K903 PolarHBondContact O-N 3.46Å; S899-K903 VanDerWaalsContact O-N 3.14Å
900	K	85.4	Confident	83.1	Confident	95 Å²	95	111 Å²	111	41%	0.413	57%	0.567	S	S	.	*	H	α-helix	trans	-67	-43.2	172.8	-72.4	-178.2	177.1	179.9	0	111.3	D893 I895 R896 T897 K903 N904	D893-K900 PolarHBondContact O-NZ 3.38Å; I895-K900 WeakPolarHBondContact O-CD 3.4Å; I895-K900 PolarHBondContact O-NZ 2.87Å; R896-K900 HydrophobicContact CG-CB 4.22Å; T897-K900 WeakPolarHBondContact O-CA 3.47Å; T897-K900 WeakPolarHBondContact O-CB 3.45Å; T897-K900 PolarHBondContact O-N 3.02Å; K900-K903 PolarHBondContact O-N 3.41Å; K900-N904 PolarHBondContact O-N 2.79Å
901	S	83.6	Confident	84	Confident	29 Å²	29	107.6 Å²	107.6	20%	0.203	55%	0.548	C	S	.	.	H	α-helix	trans	-69.2	-34.9	177.2	65.2	0	0	0	0	112.9	T897 R898 K903 N904 P905	T897-S901 PolarHBondContact O-N 3.12Å; R898-S901 WeakPolarHBondContact CA-OG 3.18Å; R898-S901 PolarHBondContact O-OG 2.76Å; R898-S901 VanDerWaalsContact O-OG 3.08Å; S901-K903 VanDerWaalsContact C-N 3.31Å; S901-K903 PolarHBondContact O-N 3.23Å; S901-N904 CarbonylContact O-C 3.57Å; S901-N904 PolarHBondContact O-N 2.82Å; S901-P905 VanDerWaalsContact O-CA 3.3Å; S901-P905 WeakPolarHBondContact O-CA 3.29Å
902	A	85.5	Confident	85.1	Confident	79 Å²	79	102.1 Å²	102.1	65%	0.653	52%	0.522	S	S	*	.	H	α-helix	trans	-64.1	-36.8	172.2	0	0	0	0	0	112.4	R898	R898-A902 VanDerWaalsContact O-CB 3.29Å; R898-A902 WeakPolarHBondContact O-CB 3.25Å; R898-A902 PolarHBondContact O-N 3.4Å
903	K	85.6	Confident	86.1	Confident	177 Å²	177	93.9 Å²	93.9	77%	0.77	48%	0.484	S	S	*	.	H	α-helix	trans	-75.8	-36.8	178.6	-169.4	176.3	179.8	-177.9	0	112.6	S899 K900 S901	S899-K903 WeakPolarHBondContact O-CB 3.44Å; S899-K903 PolarHBondContact O-N 3.46Å; S899-K903 VanDerWaalsContact O-N 3.14Å; K900-K903 PolarHBondContact O-N 3.41Å; S901-K903 VanDerWaalsContact C-N 3.31Å; S901-K903 PolarHBondContact O-N 3.23Å
904	N	81.2	Confident	87	Confident	108 Å²	108	89.7 Å²	89.7	58%	0.578	46%	0.461	S	S	*	.	S	Bend	trans	-123.5	90.1	174.6	-75.5	-27.2	0	0	0	109	R896 K900 S901	R896-N904 PolarHBondContact NH2-O 2.85Å; K900-N904 PolarHBondContact O-N 2.79Å; S901-N904 CarbonylContact O-C 3.57Å; S901-N904 PolarHBondContact O-N 2.82Å
905	P	79.3	Confident	87.6	Confident	96 Å²	96	87.2 Å²	87.2	62%	0.623	43%	0.434	S	S	*	.			trans	-55.9	142.9	-177.4	-24.8	33	0	0	0	111.8	S901 R907	S901-P905 VanDerWaalsContact O-CA 3.3Å; S901-P905 WeakPolarHBondContact O-CA 3.29Å; P905-R907 PolarHBondContact O-N 2.99Å
906	E	76.8	Confident	88.1	Confident	100 Å²	100	81.4 Å²	81.4	47%	0.467	40%	0.403	S	S	.	.			trans	-55.7	130	178	-54.3	-179.3	-179.2	0	0	110.9	E887 W908	E887-E906 HydrophobicContact CG-CB 4.28Å; E887-E906 WeakPolarHBondContact OE1-CB 3.37Å; E887-E906 WeakPolarHBondContact OE1-CG 3.46Å; E906-W908 PolarHBondContact OE2-NE1 3Å
907	R	82.7	Confident	89	Confident	190 Å²	190	77 Å²	77	72%	0.717	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.7	122.2	175.7	-66.2	-176	-176.6	178.7	2.5	107.5	I888 P905	I888-R907 HydrophobicContact CB-CB 4.38Å; I888-R907 HydrophobicContact CD1-CB 4.41Å; I888-R907 PolarHBondContact N-O 3.27Å; P905-R907 PolarHBondContact O-N 2.99Å
908	W	85.9	Confident	89.5	Confident	115 Å²	115	74.1 Å²	74.1	44%	0.436	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	140.8	178.5	-69.5	79.5	0	0	0	109.6	E886 E887 E906	E886-W908 VanDerWaalsContact C-CE3 3.41Å; E886-W908 WeakPolarHBondContact O-CA 3.21Å; E887-W908 HydrophobicContact CB-CD2 4.14Å; E887-W908 HydrophobicContact CB-CE3 4.22Å; E887-W908 HydrophobicContact CB-CH2 3.96Å; E887-W908 HydrophobicContact CB-CZ2 3.87Å; E887-W908 HydrophobicContact CB-CZ3 4.14Å; E887-W908 HydrophobicContact CG-CD2 4.41Å; E887-W908 HydrophobicContact CG-CZ2 4.15Å; E906-W908 PolarHBondContact OE2-NE1 3Å
909	T	91.8	Very high	90.1	Very high	49 Å²	49	63.7 Å²	63.7	30%	0.301	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	153.7	167.1	53.2	0	0	0	0	110	G885 E886 I888	G885-T909 WeakPolarHBondContact CA-OG1 3.34Å; G885-T909 PolarHBondContact N-O 3.02Å; E886-T909 PolarHBondContact N-OG1 2.61Å; E886-T909 PolarHBondContact O-N 3.17Å; E886-T909 PolarHBondContact O-OG1 3.23Å; I888-T909 HydrophobicContact CD1-CG2 3.86Å; I888-T909 HydrophobicContact CG1-CG2 3.94Å
910	N	93.6	Very high	90.6	Very high	107 Å²	107	59.8 Å²	59.8	57%	0.572	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.6	117.9	173.5	-172	29.3	0	0	0	108.2	V883	V883-N910 PolarHBondContact O-OD1 3.3Å; V883-N910 VanDerWaalsContact O-OD1 3.07Å
911	I	95.7	Very high	91.2	Very high	12 Å²	12	55.3 Å²	55.3	6%	0.062	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	159.4	-168.4	61.5	174.2	0	0	0	111.4	M882 V883 V915 K916 K919	M882-I911 WeakPolarHBondContact CA-O 3.36Å; M882-I911 VanDerWaalsContact CE-C 3.44Å; V883-I911 PolarHBondContact N-O 3.32Å; V883-I911 PolarHBondContact O-N 2.71Å; I911-V915 HydrophobicContact CD1-CG1 4.11Å; I911-K916 HydrophobicContact CD1-CB 3.89Å; I911-K916 HydrophobicContact CD1-CD 4.31Å; I911-K916 HydrophobicContact CG1-CB 4.2Å; I911-K919 HydrophobicContact CD1-CD 3.95Å
912	P	97	Very high	91.8	Very high	41 Å²	41	54 Å²	54	27%	0.266	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	144.2	174.9	-22.7	33.7	0	0	0	111.9	M882 L914 V915 K916	M882-P912 HydrophobicContact SD-CB 4.26Å; M882-P912 HydrophobicContact SD-CG 4.05Å; P912-L914 VanDerWaalsContact C-N 3.34Å; P912-L914 PolarHBondContact O-N 2.92Å; P912-V915 HydrophobicContact CB-CB 4.48Å; P912-V915 HydrophobicContact CB-CG2 4.07Å; P912-V915 HydrophobicContact CG-CG2 4.16Å; P912-V915 WeakPolarHBondContact O-CB 3.34Å; P912-V915 PolarHBondContact O-N 3.19Å; P912-K916 PolarHBondContact O-N 3.43Å; P912-K916 VanDerWaalsContact O-N 3.1Å
913	L	97.1	Very high	92.3	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-52.3	-49.9	-178.7	172.7	60.5	0	0	0	112.3	M840 M844 L878 I881 V883 V915 K916 I917	M840-L913 HydrophobicContact CB-CD1 3.89Å; M840-L913 HydrophobicContact CB-CD2 3.9Å; M840-L913 HydrophobicContact CE-CD1 3.81Å; M840-L913 HydrophobicContact CE-CD2 4.04Å; M840-L913 HydrophobicContact CE-CG 4.35Å; M840-L913 HydrophobicContact CG-CD1 4.46Å; M840-L913 HydrophobicContact CG-CD2 3.77Å; M844-L913 HydrophobicContact CG-CD1 3.46Å; M844-L913 VanDerWaalsContact CG-CD1 3.46Å; M844-L913 HydrophobicContact SD-CD1 4.01Å; L878-L913 HydrophobicContact CD2-CD2 4.07Å; I881-L913 HydrophobicContact CB-CB 3.89Å; I881-L913 HydrophobicContact CB-CD2 3.97Å; I881-L913 HydrophobicContact CD1-CD2 3.92Å; I881-L913 HydrophobicContact CG2-CB 3.98Å; I881-L913 HydrophobicContact CG2-CD2 4.09Å; I881-L913 HydrophobicContact CG2-CG 4.5Å; I881-L913 WeakPolarHBondContact O-CB 3.49Å; I881-L913 PolarHBondContact O-N 3.1Å; V883-L913 HydrophobicContact CG1-CD1 4.16Å; V883-L913 HydrophobicContact CG2-CD1 4.39Å; L913-V915 PolarHBondContact O-N 3.28Å; L913-K916 WeakPolarHBondContact O-CB 3.35Å; L913-K916 PolarHBondContact O-N 3.02Å; L913-I917 HydrophobicContact CD1-CD1 4.08Å; L913-I917 HydrophobicContact CD1-CG1 4.1Å; L913-I917 HydrophobicContact CG-CD1 3.95Å; L913-I917 HydrophobicContact CG-CG1 4.37Å; L913-I917 WeakPolarHBondContact O-CG1 3.03Å; L913-I917 PolarHBondContact O-N 2.83Å
914	L	97.3	Very high	92.8	Very high	9 Å²	9	46 Å²	46	5%	0.047	23%	0.227	C	C	.	.	H	α-helix	trans	-60.9	-33.4	-178.4	-60.9	-172.3	0	0	0	112.1	L867 I871 L878 Q879 P912 I917 F918 F1025	L867-L914 HydrophobicContact CD1-CB 3.83Å; L867-L914 HydrophobicContact CD1-CD2 4.21Å; L867-L914 HydrophobicContact CD1-CG 4.43Å; I871-L914 HydrophobicContact CG1-CD1 4.11Å; L878-L914 HydrophobicContact CB-CD2 4.26Å; Q879-L914 HydrophobicContact CG-CD1 3.77Å; P912-L914 VanDerWaalsContact C-N 3.34Å; P912-L914 PolarHBondContact O-N 2.92Å; L914-I917 HydrophobicContact CD2-CD1 4.18Å; L914-I917 PolarHBondContact O-N 3.11Å; L914-F918 WeakPolarHBondContact O-CB 3.27Å; L914-F918 PolarHBondContact O-N 2.83Å; L914-F1025 HydrophobicContact CB-CE1 3.91Å; L914-F1025 HydrophobicContact CB-CZ 3.88Å; L914-F1025 WeakPolarHBondContact O-CE1 3.44Å
915	V	96.9	Very high	93.5	Very high	8 Å²	8	40.9 Å²	40.9	5%	0.048	20%	0.199	C	C	.	.	H	α-helix	trans	-68.1	-42.5	175	177.8	0	0	0	0	110.3	I911 P912 L913 F918 K919 F1025 H1028	I911-V915 HydrophobicContact CD1-CG1 4.11Å; P912-V915 HydrophobicContact CB-CB 4.48Å; P912-V915 HydrophobicContact CB-CG2 4.07Å; P912-V915 HydrophobicContact CG-CG2 4.16Å; P912-V915 WeakPolarHBondContact O-CB 3.34Å; P912-V915 PolarHBondContact O-N 3.19Å; L913-V915 PolarHBondContact O-N 3.28Å; V915-F918 PolarHBondContact O-N 3.14Å; V915-K919 WeakPolarHBondContact O-CG 3.48Å; V915-K919 PolarHBondContact O-N 3.5Å; V915-F1025 HydrophobicContact CG2-CD1 4.02Å; V915-F1025 HydrophobicContact CG2-CE1 4.04Å; V915-H1028 HydrophobicContact CG1-CB 3.39Å
916	K	97.5	Very high	94.2	Very high	25 Å²	25	38.4 Å²	38.4	11%	0.109	18%	0.184	C	C	.	.	H	α-helix	trans	-63.9	-41.8	175.2	-178.4	57.1	176.5	-177	0	111.9	M844 V883 G885 I911 P912 L913 F918 K919 L920	M844-K916 HydrophobicContact CB-CG 3.83Å; M844-K916 HydrophobicContact CG-CG 4Å; M844-K916 WeakPolarHBondContact O-CE 3.39Å; M844-K916 HydrophobicContact SD-CG 4.31Å; V883-K916 HydrophobicContact CG2-CB 3.53Å; V883-K916 HydrophobicContact CG2-CG 3.79Å; G885-K916 PolarHBondContact O-NZ 2.89Å; I911-K916 HydrophobicContact CD1-CB 3.89Å; I911-K916 HydrophobicContact CD1-CD 4.31Å; I911-K916 HydrophobicContact CG1-CB 4.2Å; P912-K916 PolarHBondContact O-N 3.43Å; P912-K916 VanDerWaalsContact O-N 3.1Å; L913-K916 WeakPolarHBondContact O-CB 3.35Å; L913-K916 PolarHBondContact O-N 3.02Å; K916-F918 VanDerWaalsContact C-N 3.33Å; K916-F918 PolarHBondContact O-N 3.25Å; K916-K919 PolarHBondContact O-N 3.03Å; K916-L920 HydrophobicContact CD-CD1 4.4Å; K916-L920 HydrophobicContact CD-CG 4.36Å; K916-L920 HydrophobicContact CG-CD1 4.16Å; K916-L920 WeakPolarHBondContact O-CG 3.33Å; K916-L920 PolarHBondContact O-N 2.64Å
917	I	98.1	Very high	94.9	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-57.8	-48	174.2	-68.3	174.5	0	0	0	110.2	M840 M844 L863 L866 L867 L913 L914 K919 L920 I921	M840-I917 HydrophobicContact CE-CD1 3.9Å; M840-I917 HydrophobicContact CE-CG1 4.46Å; M844-I917 HydrophobicContact CE-CG1 4.3Å; M844-I917 HydrophobicContact SD-CB 4.41Å; M844-I917 HydrophobicContact SD-CD1 4.44Å; M844-I917 HydrophobicContact SD-CG1 3.41Å; M844-I917 WeakPolarHBondContact SD-CG1 3.29Å; L863-I917 HydrophobicContact CB-CG2 3.96Å; L863-I917 HydrophobicContact CD2-CG1 4.29Å; L863-I917 HydrophobicContact CD2-CG2 4.38Å; L863-I917 WeakPolarHBondContact O-CG2 3.5Å; L866-I917 HydrophobicContact CB-CD1 4.29Å; L867-I917 HydrophobicContact CB-CG2 3.91Å; L867-I917 HydrophobicContact CD2-CG2 4.46Å; L913-I917 HydrophobicContact CD1-CD1 4.08Å; L913-I917 HydrophobicContact CD1-CG1 4.1Å; L913-I917 HydrophobicContact CG-CD1 3.95Å; L913-I917 HydrophobicContact CG-CG1 4.37Å; L913-I917 WeakPolarHBondContact O-CG1 3.03Å; L913-I917 PolarHBondContact O-N 2.83Å; L914-I917 HydrophobicContact CD2-CD1 4.18Å; L914-I917 PolarHBondContact O-N 3.11Å; I917-K919 VanDerWaalsContact C-N 3.33Å; I917-K919 PolarHBondContact O-N 3.44Å; I917-L920 PolarHBondContact O-N 2.87Å; I917-L920 VanDerWaalsContact O-N 3.16Å; I917-I921 HydrophobicContact CG2-CD1 3.75Å; I917-I921 HydrophobicContact CG2-CG1 4.35Å; I917-I921 WeakPolarHBondContact O-CG1 3.19Å; I917-I921 PolarHBondContact O-N 2.8Å
918	F	97.3	Very high	95.3	Very high	2 Å²	2	29 Å²	29	1%	0.009	16%	0.155	C	C	.	.	H	α-helix	trans	-58.4	-44.3	178.6	179.8	-119.7	0	0	0	112.4	L867 L914 V915 K916 L920 I921 I922 L1013 F1016 Y1022 F1025 L1029 L1037	L867-F918 HydrophobicContact CD2-CB 4.03Å; L867-F918 HydrophobicContact CD2-CD2 4.07Å; L914-F918 WeakPolarHBondContact O-CB 3.27Å; L914-F918 PolarHBondContact O-N 2.83Å; V915-F918 PolarHBondContact O-N 3.14Å; K916-F918 VanDerWaalsContact C-N 3.33Å; K916-F918 PolarHBondContact O-N 3.25Å; F918-L920 PolarHBondContact O-N 3.33Å; F918-I921 PolarHBondContact O-N 3.04Å; F918-I922 HydrophobicContact CD1-CD1 4.13Å; F918-I922 HydrophobicContact CE1-CD1 3.72Å; F918-I922 HydrophobicContact CE2-CD1 4.2Å; F918-I922 HydrophobicContact CE2-CG1 4.48Å; F918-I922 HydrophobicContact CZ-CD1 3.72Å; F918-I922 HydrophobicContact CZ-CG1 4.43Å; F918-I922 WeakPolarHBondContact O-CG1 3.24Å; F918-I922 PolarHBondContact O-N 3.27Å; F918-I922 VanDerWaalsContact O-N 3.15Å; F918-L1013 HydrophobicContact CD2-CD2 4.05Å; F918-L1013 HydrophobicContact CE2-CD2 3.44Å; F918-L1013 VanDerWaalsContact CE2-CD2 3.44Å; F918-L1013 HydrophobicContact CZ-CD2 4.34Å; F918-F1016 AromaticContact CD2-CD1 3.89Å; F918-F1016 HydrophobicContact CD2-CD1 3.89Å; F918-F1016 AromaticContact CD2-CE1 3.73Å; F918-F1016 HydrophobicContact CD2-CE1 3.73Å; F918-F1016 HydrophobicContact CD2-CZ 4.41Å; F918-F1016 AromaticContact CE2-CD1 3.51Å; F918-F1016 HydrophobicContact CE2-CD1 3.51Å; F918-F1016 AromaticContact CE2-CE1 3.72Å; F918-F1016 HydrophobicContact CE2-CE1 3.72Å; F918-F1016 HydrophobicContact CE2-CG 4.43Å; F918-F1016 HydrophobicContact CG-CE1 4.24Å; F918-F1016 HydrophobicContact CZ-CD1 4.15Å; F918-F1016 HydrophobicContact CZ-CE1 4.22Å; F918-Y1022 HydrophobicContact CE1-CE2 4.23Å; F918-Y1022 HydrophobicContact CZ-CD2 4.28Å; F918-Y1022 AromaticContact CZ-CE2 3.75Å; F918-Y1022 HydrophobicContact CZ-CE2 3.75Å; F918-F1025 HydrophobicContact CB-CD1 3.88Å; F918-F1025 HydrophobicContact CB-CE1 4.26Å; F918-F1025 HydrophobicContact CD1-CB 4.05Å; F918-F1025 AromaticContact CD1-CD1 3.98Å; F918-F1025 HydrophobicContact CD1-CD1 3.98Å; F918-F1025 HydrophobicContact CE1-CB 4.16Å; F918-F1025 HydrophobicContact CG-CD1 4.02Å; F918-L1029 HydrophobicContact CD1-CD2 3.95Å; F918-L1029 HydrophobicContact CE1-CD1 3.97Å; F918-L1029 HydrophobicContact CE1-CD2 3.71Å; F918-L1029 HydrophobicContact CE1-CG 4.13Å; F918-L1037 HydrophobicContact CZ-CD1 4.17Å
919	K	97	Very high	95.4	Very high	9 Å²	9	25.7 Å²	25.7	4%	0.039	15%	0.147	C	C	.	.	H	α-helix	trans	-60.3	-43.1	174.2	-70.7	177.8	163.8	-79.5	0	112.9	E886 I911 V915 K916 I917 I922 N923 H1028 L1029 E1033	E886-K919 IonicContact OE1-NZ 2.79Å; E886-K919 PolarHBondContact OE1-NZ 3.31Å; I911-K919 HydrophobicContact CD1-CD 3.95Å; V915-K919 WeakPolarHBondContact O-CG 3.48Å; V915-K919 PolarHBondContact O-N 3.5Å; K916-K919 PolarHBondContact O-N 3.03Å; I917-K919 VanDerWaalsContact C-N 3.33Å; I917-K919 PolarHBondContact O-N 3.44Å; K919-I922 PolarHBondContact O-N 3.34Å; K919-N923 PolarHBondContact O-N 3.18Å; K919-H1028 WeakPolarHBondContact CE-O 3.33Å; K919-H1028 PolarHBondContact NZ-O 3.43Å; K919-L1029 HydrophobicContact CG-CD2 4.18Å; K919-E1033 VanDerWaalsContact CB-OE1 3.29Å; K919-E1033 WeakPolarHBondContact CB-OE1 3.24Å; K919-E1033 WeakPolarHBondContact CD-OE1 3.46Å; K919-E1033 WeakPolarHBondContact CG-OE1 3.23Å; K919-E1033 IonicContact NZ-OE1 3.59Å; K919-E1033 PolarHBondContact NZ-OE1 3.44Å; K919-E1033 IonicContact NZ-OE2 2.73Å; K919-E1033 PolarHBondContact NZ-OE2 3.07Å
920	L	97.3	Very high	95.3	Very high	5 Å²	5	29.4 Å²	29.4	3%	0.026	16%	0.162	C	C	.	.	H	α-helix	trans	-64.6	-41.5	177.6	-70.9	167.1	0	0	0	111.6	M844 Q847 H848 L863 K916 I917 F918 I922 N923 E924	M844-L920 HydrophobicContact CB-CD1 4.26Å; M844-L920 HydrophobicContact CE-CD1 4.24Å; M844-L920 HydrophobicContact CG-CD1 4.43Å; M844-L920 HydrophobicContact SD-CD1 3.45Å; M844-L920 WeakPolarHBondContact SD-CD1 3.1Å; Q847-L920 HydrophobicContact CB-CD1 3.8Å; Q847-L920 HydrophobicContact CB-CD2 3.97Å; Q847-L920 HydrophobicContact CB-CG 4.38Å; Q847-L920 HydrophobicContact CG-CB 4.2Å; Q847-L920 HydrophobicContact CG-CD1 4.07Å; Q847-L920 HydrophobicContact CG-CD2 4.07Å; Q847-L920 HydrophobicContact CG-CG 4.34Å; H848-L920 HydrophobicContact CB-CD2 4.34Å; L863-L920 HydrophobicContact CD1-CB 4.48Å; K916-L920 HydrophobicContact CD-CD1 4.4Å; K916-L920 HydrophobicContact CD-CG 4.36Å; K916-L920 HydrophobicContact CG-CD1 4.16Å; K916-L920 WeakPolarHBondContact O-CG 3.33Å; K916-L920 PolarHBondContact O-N 2.64Å; I917-L920 PolarHBondContact O-N 2.87Å; I917-L920 VanDerWaalsContact O-N 3.16Å; F918-L920 PolarHBondContact O-N 3.33Å; L920-I922 VanDerWaalsContact C-N 3.26Å; L920-I922 PolarHBondContact O-N 3.16Å; L920-N923 WeakPolarHBondContact O-CA 3.33Å; L920-N923 WeakPolarHBondContact O-CB 3.48Å; L920-N923 PolarHBondContact O-N 3.44Å; L920-N923 VanDerWaalsContact O-N 3.08Å; L920-E924 VanDerWaalsContact O-CG 3.28Å; L920-E924 WeakPolarHBondContact O-CG 3.45Å; L920-E924 PolarHBondContact O-N 3.44Å
921	I	97.9	Very high	94.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-59.5	-38.8	175.2	-67.6	164.9	0	0	0	111.3	L863 C864 L867 I917 F918 E924 L925 L1009 F1012 L1013	L863-I921 HydrophobicContact CB-CD1 4.46Å; L863-I921 HydrophobicContact CB-CG1 4.28Å; C864-I921 HydrophobicContact CB-CD1 4.46Å; L867-I921 HydrophobicContact CB-CD1 4.47Å; L867-I921 HydrophobicContact CD2-CD1 3.83Å; I917-I921 HydrophobicContact CG2-CD1 3.75Å; I917-I921 HydrophobicContact CG2-CG1 4.35Å; I917-I921 WeakPolarHBondContact O-CG1 3.19Å; I917-I921 PolarHBondContact O-N 2.8Å; F918-I921 PolarHBondContact O-N 3.04Å; I921-E924 PolarHBondContact O-N 3.06Å; I921-L925 PolarHBondContact O-N 3.39Å; I921-L1009 HydrophobicContact CG2-CD2 3.78Å; I921-F1012 HydrophobicContact CD1-CE1 3.91Å; I921-F1012 HydrophobicContact CD1-CZ 4.46Å; I921-F1012 HydrophobicContact CG2-CD1 4.3Å; I921-L1013 HydrophobicContact CG2-CD1 4.35Å; I921-L1013 HydrophobicContact CG2-CD2 3.92Å; I921-L1013 HydrophobicContact CG2-CG 4.16Å
922	I	97	Very high	94.4	Very high	1 Å²	1	28 Å²	28	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-66.2	-42.2	174.7	-63.1	166.2	0	0	0	110.8	F918 K919 L920 L925 S926 L1013 L1029 E1033 T1036 L1037	F918-I922 HydrophobicContact CD1-CD1 4.13Å; F918-I922 HydrophobicContact CE1-CD1 3.72Å; F918-I922 HydrophobicContact CE2-CD1 4.2Å; F918-I922 HydrophobicContact CE2-CG1 4.48Å; F918-I922 HydrophobicContact CZ-CD1 3.72Å; F918-I922 HydrophobicContact CZ-CG1 4.43Å; F918-I922 WeakPolarHBondContact O-CG1 3.24Å; F918-I922 PolarHBondContact O-N 3.27Å; F918-I922 VanDerWaalsContact O-N 3.15Å; K919-I922 PolarHBondContact O-N 3.34Å; L920-I922 VanDerWaalsContact C-N 3.26Å; L920-I922 PolarHBondContact O-N 3.16Å; I922-L925 PolarHBondContact O-N 3.4Å; I922-S926 PolarHBondContact O-N 3.39Å; I922-L1013 HydrophobicContact CG1-CD1 4.44Å; I922-L1013 HydrophobicContact CG1-CD2 4.14Å; I922-L1029 HydrophobicContact CD1-CD1 4.19Å; I922-L1029 HydrophobicContact CD1-CD2 3.59Å; I922-E1033 HydrophobicContact CD1-CB 4.42Å; I922-E1033 HydrophobicContact CG2-CB 4.07Å; I922-E1033 HydrophobicContact CG2-CG 4.37Å; I922-T1036 HydrophobicContact CG2-CG2 3.85Å; I922-L1037 HydrophobicContact CD1-CD1 3.87Å; I922-L1037 HydrophobicContact CD1-CD2 4.17Å; I922-L1037 HydrophobicContact CD1-CG 4.03Å; I922-L1037 HydrophobicContact CG1-CD2 3.97Å; I922-L1037 HydrophobicContact CG1-CG 4.29Å
923	N	95.9	Very high	93.8	Very high	68 Å²	68	28.4 Å²	28.4	36%	0.364	17%	0.166	S	C	.	.	H	α-helix	trans	-58.4	-47.5	175.1	-175	86.9	0	0	0	111.4	K919 L920 L925 S926 T927	K919-N923 PolarHBondContact O-N 3.18Å; L920-N923 WeakPolarHBondContact O-CA 3.33Å; L920-N923 WeakPolarHBondContact O-CB 3.48Å; L920-N923 PolarHBondContact O-N 3.44Å; L920-N923 VanDerWaalsContact O-N 3.08Å; N923-L925 VanDerWaalsContact C-N 3.32Å; N923-L925 PolarHBondContact O-N 3.04Å; N923-S926 WeakPolarHBondContact O-CA 3.44Å; N923-S926 VanDerWaalsContact O-CB 3.25Å; N923-S926 WeakPolarHBondContact O-CB 3.24Å; N923-S926 PolarHBondContact O-N 3.2Å; N923-T927 PolarHBondContact O-N 3.35Å; N923-T927 PolarHBondContact O-OG1 2.94Å
924	E	95.8	Very high	92.9	Very high	21 Å²	21	31.9 Å²	31.9	10%	0.098	19%	0.19	C	C	.	.	H	α-helix	trans	-59.5	-41.1	176.8	-64.9	-67.5	152.9	0	0	112	Q847 T860 L920 I921 S926 T927 V928 L1009	Q847-E924 PolarHBondContact NE2-OE1 2.83Å; T860-E924 HydrophobicContact CG2-CB 3.8Å; T860-E924 HydrophobicContact CG2-CG 3.88Å; T860-E924 VanDerWaalsContact OG1-CD 3.3Å; T860-E924 WeakPolarHBondContact OG1-CG 3.3Å; T860-E924 PolarHBondContact OG1-OE2 3.43Å; L920-E924 VanDerWaalsContact O-CG 3.28Å; L920-E924 WeakPolarHBondContact O-CG 3.45Å; L920-E924 PolarHBondContact O-N 3.44Å; I921-E924 PolarHBondContact O-N 3.06Å; E924-S926 VanDerWaalsContact C-N 3.33Å; E924-S926 PolarHBondContact O-N 3.44Å; E924-T927 PolarHBondContact O-N 3.29Å; E924-V928 WeakPolarHBondContact O-CB 3.49Å; E924-V928 WeakPolarHBondContact O-CG2 3.48Å; E924-V928 PolarHBondContact O-N 2.93Å; E924-L1009 HydrophobicContact CB-CD1 4.03Å
925	L	95.5	Very high	91.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.4	-43.9	173	176.1	66.1	0	0	0	110.9	I921 I922 N923 V928 V929 Q1006 L1009 L1013 T1036 I1040	I921-L925 PolarHBondContact O-N 3.39Å; I922-L925 PolarHBondContact O-N 3.4Å; N923-L925 VanDerWaalsContact C-N 3.32Å; N923-L925 PolarHBondContact O-N 3.04Å; L925-V928 PolarHBondContact O-N 3.22Å; L925-V929 HydrophobicContact CD1-CG2 3.86Å; L925-V929 HydrophobicContact CG-CG2 4.2Å; L925-V929 WeakPolarHBondContact O-CB 3.45Å; L925-V929 WeakPolarHBondContact O-CG2 3.36Å; L925-V929 PolarHBondContact O-N 3.36Å; L925-Q1006 HydrophobicContact CD1-CG 4.1Å; L925-L1009 HydrophobicContact CB-CB 4.33Å; L925-L1009 HydrophobicContact CB-CD1 4.14Å; L925-L1009 HydrophobicContact CD1-CB 4.13Å; L925-L1013 HydrophobicContact CB-CD1 4.35Å; L925-L1013 HydrophobicContact CD2-CD1 3.6Å; L925-T1036 HydrophobicContact CD2-CG2 4.26Å; L925-T1036 HydrophobicContact CG-CG2 4.37Å; L925-I1040 HydrophobicContact CD2-CD1 3.76Å; L925-I1040 HydrophobicContact CD2-CG1 4.39Å; L925-I1040 HydrophobicContact CD2-CG2 3.94Å
926	S	93.3	Very high	89.8	Confident	44 Å²	44	40.7 Å²	40.7	31%	0.308	24%	0.235	S	C	.	.	H	α-helix	trans	-58.2	-50.6	177.8	-160.5	0	0	0	0	111.3	I922 N923 E924 V928 V929 E930	I922-S926 PolarHBondContact O-N 3.39Å; N923-S926 WeakPolarHBondContact O-CA 3.44Å; N923-S926 VanDerWaalsContact O-CB 3.25Å; N923-S926 WeakPolarHBondContact O-CB 3.24Å; N923-S926 PolarHBondContact O-N 3.2Å; E924-S926 VanDerWaalsContact C-N 3.33Å; E924-S926 PolarHBondContact O-N 3.44Å; S926-V928 PolarHBondContact O-N 2.79Å; S926-V929 PolarHBondContact O-N 3.03Å; S926-E930 WeakPolarHBondContact O-CB 3.4Å; S926-E930 PolarHBondContact O-N 3.26Å
927	T	92.1	Very high	87.4	Confident	71 Å²	71	44.6 Å²	44.6	44%	0.436	26%	0.257	S	S	.	.	H	α-helix	trans	-61.4	-42.4	179.5	-56.1	0	0	0	0	111.8	N923 E924 E930 A931	N923-T927 PolarHBondContact O-N 3.35Å; N923-T927 PolarHBondContact O-OG1 2.94Å; E924-T927 PolarHBondContact O-N 3.29Å; T927-E930 PolarHBondContact O-N 3.45Å; T927-A931 VanDerWaalsContact O-CB 3.3Å; T927-A931 WeakPolarHBondContact O-CB 3.09Å; T927-A931 PolarHBondContact O-N 2.91Å
928	V	90.6	Very high	84.5	Confident	23 Å²	23	47.2 Å²	47.2	14%	0.139	28%	0.279	C	S	.	.	H	α-helix	trans	-69.4	-40	178.7	174.4	0	0	0	0	111.8	E924 L925 S926 E930 A931 N932 L1005 Q1006	E924-V928 WeakPolarHBondContact O-CB 3.49Å; E924-V928 WeakPolarHBondContact O-CG2 3.48Å; E924-V928 PolarHBondContact O-N 2.93Å; L925-V928 PolarHBondContact O-N 3.22Å; S926-V928 PolarHBondContact O-N 2.79Å; V928-E930 VanDerWaalsContact C-N 3.34Å; V928-A931 PolarHBondContact O-N 3.41Å; V928-N932 VanDerWaalsContact O-CB 3.32Å; V928-N932 WeakPolarHBondContact O-CB 3.26Å; V928-N932 VanDerWaalsContact O-CG 3.27Å; V928-N932 PolarHBondContact O-N 3.47Å; V928-N932 PolarHBondContact O-ND2 3.41Å; V928-L1005 HydrophobicContact CG2-CB 4.49Å; V928-L1005 HydrophobicContact CG2-CD2 3.68Å; V928-L1005 HydrophobicContact CG2-CG 4.1Å; V928-Q1006 HydrophobicContact CG1-CB 3.72Å; V928-Q1006 HydrophobicContact CG1-CG 4.45Å
929	V	89.4	Confident	81.4	Confident	44 Å²	44	49.7 Å²	49.7	27%	0.267	30%	0.3	S	S	.	.	H	α-helix	trans	-62.3	-44.1	176	168.1	0	0	0	0	110.5	L925 S926 N932 A933 Q1006	L925-V929 HydrophobicContact CD1-CG2 3.86Å; L925-V929 HydrophobicContact CG-CG2 4.2Å; L925-V929 WeakPolarHBondContact O-CB 3.45Å; L925-V929 WeakPolarHBondContact O-CG2 3.36Å; L925-V929 PolarHBondContact O-N 3.36Å; S926-V929 PolarHBondContact O-N 3.03Å; V929-N932 PolarHBondContact O-N 3.47Å; V929-A933 VanDerWaalsContact O-CB 3.29Å; V929-A933 WeakPolarHBondContact O-CB 3.45Å; V929-A933 PolarHBondContact O-N 3.02Å; V929-Q1006 HydrophobicContact CG2-CG 4.06Å
930	E	88.3	Confident	78.1	Confident	128 Å²	128	55.1 Å²	55.1	60%	0.598	33%	0.329	S	S	*	.	H	α-helix	trans	-61.8	-49.7	175.4	-175	174.9	-178.9	0	0	111.4	S926 T927 V928 N932 A933 S934	S926-E930 WeakPolarHBondContact O-CB 3.4Å; S926-E930 PolarHBondContact O-N 3.26Å; T927-E930 PolarHBondContact O-N 3.45Å; V928-E930 VanDerWaalsContact C-N 3.34Å; E930-N932 VanDerWaalsContact C-N 3.27Å; E930-N932 PolarHBondContact O-N 2.84Å; E930-A933 PolarHBondContact O-N 2.78Å; E930-S934 PolarHBondContact O-N 3.35Å; E930-S934 PolarHBondContact O-OG 3.28Å
931	A	85.2	Confident	75.1	Confident	38 Å²	38	66.1 Å²	66.1	31%	0.314	37%	0.37	S	S	.	.	H	α-helix	trans	-61.1	-33.9	178.2	0	0	0	0	0	113.1	T927 V928 R935	T927-A931 VanDerWaalsContact O-CB 3.3Å; T927-A931 WeakPolarHBondContact O-CB 3.09Å; T927-A931 PolarHBondContact O-N 2.91Å; V928-A931 PolarHBondContact O-N 3.41Å; A931-R935 WeakPolarHBondContact O-CG 3.34Å; A931-R935 PolarHBondContact O-N 3.41Å; A931-R935 PolarHBondContact O-NE 2.77Å
932	N	86.1	Confident	72	Confident	52 Å²	52	70.1 Å²	70.1	28%	0.278	40%	0.399	S	S	.	.	H	α-helix	trans	-78.5	-35.9	176.4	-73.7	-15	0	0	0	112.3	V928 V929 E930 R935 A936 Q1006	V928-N932 VanDerWaalsContact O-CB 3.32Å; V928-N932 WeakPolarHBondContact O-CB 3.26Å; V928-N932 VanDerWaalsContact O-CG 3.27Å; V928-N932 PolarHBondContact O-N 3.47Å; V928-N932 PolarHBondContact O-ND2 3.41Å; V929-N932 PolarHBondContact O-N 3.47Å; E930-N932 VanDerWaalsContact C-N 3.27Å; E930-N932 PolarHBondContact O-N 2.84Å; N932-R935 PolarHBondContact O-N 3.35Å; N932-A936 WeakPolarHBondContact O-CB 3.38Å; N932-A936 PolarHBondContact O-N 2.8Å; N932-Q1006 PolarHBondContact ND2-OE1 3.48Å
933	A	84.6	Confident	68.7	Low	49 Å²	49	78.5 Å²	78.5	41%	0.405	44%	0.437	S	S	.	.	H	α-helix	trans	-64.1	-42	174.4	0	0	0	0	0	111.4	V929 E930 A936 N937	V929-A933 VanDerWaalsContact O-CB 3.29Å; V929-A933 WeakPolarHBondContact O-CB 3.45Å; V929-A933 PolarHBondContact O-N 3.02Å; E930-A933 PolarHBondContact O-N 2.78Å; A933-A936 PolarHBondContact O-N 3.45Å; A933-N937 PolarHBondContact O-N 3.46Å
934	S	76.8	Confident	65.3	Low	72 Å²	72	81.1 Å²	81.1	50%	0.503	45%	0.451	S	S	.	.	H	α-helix	trans	-62.8	-41	174.6	-60.6	0	0	0	0	112.1	E930 N937 A938	E930-S934 PolarHBondContact O-N 3.35Å; E930-S934 PolarHBondContact O-OG 3.28Å; S934-N937 PolarHBondContact O-N 3.42Å; S934-A938 WeakPolarHBondContact O-CB 3.35Å; S934-A938 PolarHBondContact O-N 3.12Å
935	R	71.1	Confident	62.6	Low	141 Å²	141	85.2 Å²	85.2	53%	0.532	48%	0.48	S	S	.	.	H	α-helix	trans	-67.2	-39.1	174.9	-81	-175.4	-93.2	-162.6	-14	113.5	A931 N932 N937 A938 A939	A931-R935 WeakPolarHBondContact O-CG 3.34Å; A931-R935 PolarHBondContact O-N 3.41Å; A931-R935 PolarHBondContact O-NE 2.77Å; N932-R935 PolarHBondContact O-N 3.35Å; R935-N937 VanDerWaalsContact C-N 3.32Å; R935-A938 PolarHBondContact O-N 3.07Å; R935-A939 PolarHBondContact O-N 3.18Å
936	A	59.2	Low	59.8	Low	62 Å²	62	90.2 Å²	90.2	51%	0.512	52%	0.515	S	S	.	.	H	α-helix	trans	-64.3	-39.1	175.2	0	0	0	0	0	111.5	N932 A933 D940	N932-A936 WeakPolarHBondContact O-CB 3.38Å; N932-A936 PolarHBondContact O-N 2.8Å; A933-A936 PolarHBondContact O-N 3.45Å; A936-D940 PolarHBondContact O-N 2.85Å
937	N	46.3	Very low	56.5	Low	107 Å²	107	91.5 Å²	91.5	57%	0.572	54%	0.535	S	S	*	.	H	α-helix	trans	-72.5	-32.5	174.9	-73.9	-11.3	0	0	0	112.8	A933 S934 R935 D940 W941	A933-N937 PolarHBondContact O-N 3.46Å; S934-N937 PolarHBondContact O-N 3.42Å; R935-N937 VanDerWaalsContact C-N 3.32Å; N937-D940 WeakPolarHBondContact O-CB 3.32Å; N937-D940 PolarHBondContact O-N 3.36Å; N937-W941 VanDerWaalsContact O-CD1 3.3Å; N937-W941 PolarHBondContact O-N 2.96Å
938	A	38.2	Very low	53.4	Low	55 Å²	55	96.2 Å²	96.2	46%	0.455	55%	0.554	S	S	.	*	H	α-helix	trans	-70.3	-32.6	174.7	0	0	0	0	0	112.9	S934 R935 D940 W941 S942	S934-A938 WeakPolarHBondContact O-CB 3.35Å; S934-A938 PolarHBondContact O-N 3.12Å; R935-A938 PolarHBondContact O-N 3.07Å; A938-D940 PolarHBondContact O-N 3.39Å; A938-W941 PolarHBondContact O-N 3.37Å; A938-S942 PolarHBondContact O-N 3.34Å; A938-S942 PolarHBondContact O-OG 3.08Å
939	A	31	Very low	50.5	Low	54 Å²	54	107.5 Å²	107.5	45%	0.446	60%	0.595	S	S	.	*	H	α-helix	trans	-63.4	-28.9	170.1	0	0	0	0	0	112.1	R935 W941 S942 H943	R935-A939 PolarHBondContact O-N 3.18Å; A939-W941 VanDerWaalsContact C-N 3.3Å; A939-W941 PolarHBondContact O-N 3.02Å; A939-S942 PolarHBondContact O-N 3.05Å; A939-S942 VanDerWaalsContact O-N 3.13Å; A939-S942 PolarHBondContact O-OG 3.45Å; A939-H943 PolarHBondContact O-N 2.74Å
940	D	29.5	Very low	47.6	Very low	123 Å²	123	112.2 Å²	112.2	66%	0.658	62%	0.618	S	S	*	*	H	α-helix	trans	-74.2	-19.6	175.9	-137.6	17.3	0	0	0	112.9	A936 N937 A938	A936-D940 PolarHBondContact O-N 2.85Å; N937-D940 WeakPolarHBondContact O-CB 3.32Å; N937-D940 PolarHBondContact O-N 3.36Å; A938-D940 PolarHBondContact O-N 3.39Å
941	W	33.7	Very low	44.9	Very low	235 Å²	235	113.2 Å²	113.2	89%	0.89	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-8.3	168.3	-73.3	99.9	0	0	0	113.7	N937 A938 A939	N937-W941 VanDerWaalsContact O-CD1 3.3Å; N937-W941 PolarHBondContact O-N 2.96Å; A938-W941 PolarHBondContact O-N 3.37Å; A939-W941 VanDerWaalsContact C-N 3.3Å; A939-W941 PolarHBondContact O-N 3.02Å
942	S	32.5	Very low	42.2	Very low	85 Å²	85	120.3 Å²	120.3	59%	0.594	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121	-11.8	-176.1	53.8	0	0	0	0	116.4	A938 A939	A938-S942 PolarHBondContact O-N 3.34Å; A938-S942 PolarHBondContact O-OG 3.08Å; A939-S942 PolarHBondContact O-N 3.05Å; A939-S942 VanDerWaalsContact O-N 3.13Å; A939-S942 PolarHBondContact O-OG 3.45Å
943	H	27.1	Very low	39.7	Very low	176 Å²	176	126.2 Å²	126.2	82%	0.815	68%	0.681	S	S	*	*	S	Bend	trans	-164.1	85.7	170.1	-112	37.3	0	0	0	115	A939	A939-H943 PolarHBondContact O-N 2.74Å
944	D	24.6	Very low	37.1	Very low	123 Å²	123	131.8 Å²	131.8	66%	0.658	70%	0.703	S	S	*	*				-170.9	112.7	124.9	-160.1	-12.8	0	0	0	112	S946	D944-S946 PolarHBondContact O-N 3.12Å
945	P	40.4	Very low	34.7	Very low	107 Å²	107	131.7 Å²	131.7	70%	0.695	71%	0.714	S	S	*	*			trans	-94.1	76.9	175.4	36.3	-30.7	0	0	0	111.7
946	S	35.2	Very low	32.7	Very low	105 Å²	105	134.6 Å²	134.6	73%	0.734	73%	0.734	S	S	*	*			trans	167	120.3	151	48.6	0	0	0	0	112.9	D944	D944-S946 PolarHBondContact O-N 3.12Å
947	G	24.8	Very low	31.2	Very low	72 Å²	72	135.1 Å²	135.1	74%	0.742	75%	0.745	S	S	*	*			trans	175.8	77.1	170.3	0	0	0	0	0	117.2
948	M	27.4	Very low	30.3	Very low	169 Å²	169	139.6 Å²	139.6	83%	0.833	76%	0.763	S	S	*	*			trans	75.5	84.1	151.8	-55.3	-162.3	126.3	0	0	119.1
949	W	29.8	Very low	30.2	Very low	261 Å²	261	144.5 Å²	144.5	99%	0.989	78%	0.782	S	S	*	*			trans	-104.6	91.1	139.2	-68.1	62.8	0	0	0	105.4
950	D	27.1	Very low	30.1	Very low	142 Å²	142	149.5 Å²	149.5	76%	0.759	80%	0.801	S	S	*	*			trans	-77.5	121	173.5	-140.1	8.5	0	0	0	107.2	Q952	D950-Q952 PolarHBondContact O-N 3.36Å
951	D	32.8	Very low	30	Very low	150 Å²	150	151.5 Å²	151.5	80%	0.802	81%	0.811	S	S	*	*			trans	-55.6	126.9	174.9	-74.6	-48.7	0	0	0	110.5
952	Q	27	Very low	29.8	Very low	186 Å²	186	148.6 Å²	148.6	87%	0.869	81%	0.808	S	S	*	*			trans	-139.4	93	152.8	-123.2	158	70.3	0	0	109.5	D950 D954	D950-Q952 PolarHBondContact O-N 3.36Å; Q952-D954 PolarHBondContact O-N 2.77Å
953	E	35.3	Very low	29.6	Very low	177 Å²	177	151.1 Å²	151.1	83%	0.827	81%	0.814	S	S	*	*			trans	-57	122.6	151.6	-73	-179.1	148.4	0	0	108.5
954	D	28.8	Very low	29.7	Very low	165 Å²	165	151.9 Å²	151.9	88%	0.882	82%	0.818	S	S	*	*				172.2	125.1	127.8	-86.6	-26.9	0	0	0	111.6	Q952	Q952-D954 PolarHBondContact O-N 2.77Å
955	G	26.2	Very low	29.9	Very low	71 Å²	71	148.2 Å²	148.2	73%	0.732	81%	0.81	S	S	*	*			trans	101.5	96.9	140.2	0	0	0	0	0	119.7
956	E	28.8	Very low	29.7	Very low	201 Å²	201	150.2 Å²	150.2	94%	0.939	81%	0.814	S	S	*	*			trans	52.3	108.3	137	-58.7	-171.3	178.4	0	0	120.7
957	G	28.4	Very low	29.4	Very low	74 Å²	74	150.3 Å²	150.3	76%	0.763	82%	0.821	S	S	*	*			trans	80.9	105.5	132.6	0	0	0	0	0	118.1
958	E	27.3	Very low	29.7	Very low	200 Å²	200	149.9 Å²	149.9	94%	0.935	82%	0.817	S	S	*	*				174.8	137.6	107.7	-92.9	177.7	177.7	0	0	108.5	D960	E958-D960 PolarHBondContact O-N 2.93Å
959	D	37	Very low	29.7	Very low	159 Å²	159	146.8 Å²	146.8	85%	0.85	80%	0.8	S	S	*	*			trans	-58.8	122.1	177.9	-63.9	-57.4	0	0	0	110.7
960	D	28.3	Very low	29.8	Very low	159 Å²	159	140.1 Å²	140.1	85%	0.85	78%	0.783	S	S	*	*			trans	-162.6	72.2	150	-93.9	-22.9	0	0	0	108	E958 E962	E958-D960 PolarHBondContact O-N 2.93Å; D960-E962 PolarHBondContact O-N 3.37Å
961	D	28.3	Very low	29.9	Very low	164 Å²	164	139.8 Å²	139.8	88%	0.877	78%	0.781	S	S	*	*			trans	-79.9	91.5	162.8	-76.1	-27.9	0	0	0	107.5	D963	D961-D963 PolarHBondContact O-N 2.86Å
962	E	28.4	Very low	29.7	Very low	175 Å²	175	135.8 Å²	135.8	82%	0.818	77%	0.765	S	S	*	*			trans	-65.2	101.5	158.5	-80.2	-175.1	161.4	0	0	107.8	D960 E964	D960-E962 PolarHBondContact O-N 3.37Å; E962-E964 PolarHBondContact O-N 3.35Å
963	D	29.5	Very low	29.8	Very low	137 Å²	137	130.1 Å²	130.1	73%	0.733	74%	0.74	S	S	*	*			trans	-64.9	75.1	173.6	-142.2	-6.2	0	0	0	108.8	D961 G965	D961-D963 PolarHBondContact O-N 2.86Å; D963-G965 PolarHBondContact O-N 2.85Å
964	E	29.1	Very low	29.5	Very low	192 Å²	192	125.6 Å²	125.6	90%	0.897	72%	0.721	S	S	*	*			trans	-76.8	58.6	163	-85.1	-171.2	163.7	0	0	109.7	E962	E962-E964 PolarHBondContact O-N 3.35Å
965	G	28	Very low	29.7	Very low	46 Å²	46	122.6 Å²	122.6	47%	0.474	70%	0.704	S	S	.	*	S	Bend	trans	-89.5	103.6	162.8	0	0	0	0	0	109.3	D963 A967	D963-G965 PolarHBondContact O-N 2.85Å; G965-A967 PolarHBondContact O-N 3.46Å
966	L	35.5	Very low	29.9	Very low	150 Å²	150	123.4 Å²	123.4	79%	0.785	70%	0.699	S	S	*	*	S	Bend	trans	53.9	10.8	154.4	-68.1	161.7	0	0	0	118.9	G968	L966-G968 PolarHBondContact O-N 3.17Å
967	A	29.6	Very low	29.8	Very low	106 Å²	106	117.4 Å²	117.4	88%	0.876	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	77	175.8	0	0	0	0	0	110.4	G965	G965-A967 PolarHBondContact O-N 3.46Å
968	G	30.3	Very low	29.6	Very low	64 Å²	64	118.6 Å²	118.6	66%	0.66	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	171.7	-5.7	176.7	0	0	0	0	0	117.6	L966 L970	L966-G968 PolarHBondContact O-N 3.17Å; G968-L970 PolarHBondContact O-N 3.38Å; G968-L970 VanDerWaalsContact O-N 3.13Å
969	Q	28.8	Very low	29.7	Very low	103 Å²	103	118.6 Å²	118.6	48%	0.481	67%	0.665	S	S	.	*			trans	-68.2	114.5	174.3	-75	179.6	-14.6	0	0	109.3	D973 L974	Q969-D973 HydrophobicContact CB-CB 4.26Å; Q969-D973 HydrophobicContact CG-CB 4.35Å; Q969-L974 HydrophobicContact CB-CD1 4.34Å
970	L	30.7	Very low	29.2	Very low	121 Å²	121	119.6 Å²	119.6	63%	0.634	66%	0.658	S	S	*	*			trans	-63.8	153.3	167	-78.8	159.2	0	0	0	107.7	G968 S972 D973 L974	G968-L970 PolarHBondContact O-N 3.38Å; G968-L970 VanDerWaalsContact O-N 3.13Å; L970-S972 WeakPolarHBondContact CB-OG 3.48Å; L970-S972 PolarHBondContact O-N 3.1Å; L970-D973 PolarHBondContact N-OD2 2.98Å; L970-D973 WeakPolarHBondContact O-CB 3.41Å; L970-D973 PolarHBondContact O-N 3.48Å; L970-L974 PolarHBondContact O-N 3.01Å
971	L	29.6	Very low	29.1	Very low	136 Å²	136	118.7 Å²	118.7	71%	0.712	65%	0.653	S	S	*	*	H	α-helix	trans	-54.2	-24.7	175	-164.8	73.9	0	0	0	111.6	I975	L971-I975 HydrophobicContact CG-CD1 4.22Å; L971-I975 VanDerWaalsContact O-CD1 3.28Å; L971-I975 WeakPolarHBondContact O-CD1 3.37Å; L971-I975 WeakPolarHBondContact O-CG1 3.17Å; L971-I975 PolarHBondContact O-N 3.4Å; L971-I975 VanDerWaalsContact O-N 3.15Å
972	S	28.5	Very low	28.9	Very low	66 Å²	66	115.6 Å²	115.6	46%	0.462	64%	0.636	S	S	.	*	H	α-helix	trans	-63.2	-34.7	171.3	51.7	0	0	0	0	114.1	L970 S976	L970-S972 WeakPolarHBondContact CB-OG 3.48Å; L970-S972 PolarHBondContact O-N 3.1Å; S972-S976 PolarHBondContact O-N 3.07Å; S972-S976 VanDerWaalsContact O-N 3.1Å; S972-S976 PolarHBondContact O-OG 3.41Å
973	D	30.3	Very low	28.8	Very low	67 Å²	67	113.1 Å²	113.1	36%	0.358	63%	0.629	S	S	.	*	H	α-helix	trans	-81.4	-31.5	-175	-51.1	-19.9	0	0	0	110.7	Q969 L970 S976 S977	Q969-D973 HydrophobicContact CB-CB 4.26Å; Q969-D973 HydrophobicContact CG-CB 4.35Å; L970-D973 PolarHBondContact N-OD2 2.98Å; L970-D973 WeakPolarHBondContact O-CB 3.41Å; L970-D973 PolarHBondContact O-N 3.48Å; D973-S976 WeakPolarHBondContact CA-OG 3.44Å; D973-S976 PolarHBondContact O-OG 2.99Å; D973-S977 WeakPolarHBondContact O-CB 3.48Å; D973-S977 PolarHBondContact O-N 3.36Å; D973-S977 PolarHBondContact O-OG 2.93Å
974	L	28.9	Very low	28.7	Very low	82 Å²	82	115.6 Å²	115.6	43%	0.429	63%	0.629	S	S	.	*	H	α-helix	trans	-72.9	-32.4	171.4	-95.5	149.4	0	0	0	112.6	Q969 L970 S977 N978	Q969-L974 HydrophobicContact CB-CD1 4.34Å; L970-L974 PolarHBondContact O-N 3.01Å; L974-S977 WeakPolarHBondContact CA-OG 3.34Å; L974-S977 PolarHBondContact O-OG 3.2Å; L974-N978 PolarHBondContact O-N 3.39Å
975	I	32.6	Very low	28.7	Very low	102 Å²	102	115.6 Å²	115.6	52%	0.523	62%	0.622	S	S	.	*	H	α-helix	trans	-70.7	-39.2	173.8	-68.6	164.8	0	0	0	110.4	L971	L971-I975 HydrophobicContact CG-CD1 4.22Å; L971-I975 VanDerWaalsContact O-CD1 3.28Å; L971-I975 WeakPolarHBondContact O-CD1 3.37Å; L971-I975 WeakPolarHBondContact O-CG1 3.17Å; L971-I975 PolarHBondContact O-N 3.4Å; L971-I975 VanDerWaalsContact O-N 3.15Å
976	S	30.6	Very low	28.7	Very low	88 Å²	88	120.1 Å²	120.1	62%	0.615	63%	0.631	S	S	*	*	H	α-helix	trans	-78.2	-19.5	178.3	39.2	0	0	0	0	114.4	S972 D973	S972-S976 PolarHBondContact O-N 3.07Å; S972-S976 VanDerWaalsContact O-N 3.1Å; S972-S976 PolarHBondContact O-OG 3.41Å; D973-S976 WeakPolarHBondContact CA-OG 3.44Å; D973-S976 PolarHBondContact O-OG 2.99Å
977	S	26.4	Very low	28.5	Very low	75 Å²	75	118.3 Å²	118.3	52%	0.524	62%	0.622	S	S	.	*	H	α-helix	trans	-84.3	-17	172.5	65.5	0	0	0	0	114.4	D973 L974 K979	D973-S977 WeakPolarHBondContact O-CB 3.48Å; D973-S977 PolarHBondContact O-N 3.36Å; D973-S977 PolarHBondContact O-OG 2.93Å; L974-S977 WeakPolarHBondContact CA-OG 3.34Å; L974-S977 PolarHBondContact O-OG 3.2Å; S977-K979 PolarHBondContact O-N 2.92Å
978	N	23.9	Very low	28.9	Very low	99 Å²	99	119.9 Å²	119.9	53%	0.529	62%	0.616	S	S	.	*	S	Bend	trans	-80.8	109.8	169	-83.7	-21.2	0	0	0	107.7	L974 Y980	L974-N978 PolarHBondContact O-N 3.39Å; N978-Y980 PolarHBondContact O-N 3.44Å
979	K	28.7	Very low	29.3	Very low	200 Å²	200	118.7 Å²	118.7	87%	0.87	59%	0.593	S	S	*	*			trans	-66.4	45.1	163.8	-74.9	-175	167.9	-170.8	0	111.9	S977	S977-K979 PolarHBondContact O-N 2.92Å
980	Y	27.3	Very low	30.3	Very low	180 Å²	180	118.8 Å²	118.8	71%	0.706	59%	0.594	S	S	*	*	S	Bend	trans	-128	112.9	172.6	-79.8	-76.4	0	0	0	106.6	N978	N978-Y980 PolarHBondContact O-N 3.44Å
981	D	27.2	Very low	31.8	Very low	139 Å²	139	118.4 Å²	118.4	74%	0.743	59%	0.592	S	S	*	*	S	Bend	trans	89.7	12.6	156.7	-110.7	4.4	0	0	0	120.6
982	D	23.4	Very low	34.2	Very low	99 Å²	99	112.9 Å²	112.9	53%	0.529	56%	0.563	S	S	.	*	S	Bend	trans	-102.6	-14.1	168	-105.5	-16.6	0	0	0	114.7	Y984 Y985	D982-Y984 PolarHBondContact O-N 3.08Å; D982-Y984 VanDerWaalsContact O-N 3.15Å; D982-Y985 PolarHBondContact O-N 3.1Å
983	D	26	Very low	36.9	Very low	124 Å²	124	112 Å²	112	66%	0.663	56%	0.556	S	S	*	*	H	α-helix	trans	-67.8	-13.7	178	-76.7	-16.6	0	0	0	113.4	Y985	D983-Y985 VanDerWaalsContact C-N 3.29Å; D983-Y985 PolarHBondContact O-N 3.22Å
984	Y	27.5	Very low	39.5	Very low	188 Å²	188	110.3 Å²	110.3	74%	0.737	55%	0.547	S	S	*	.	H	α-helix	trans	-77.5	-10.5	-178.7	-112.2	-79.4	0	0	0	114.3	D982	D982-Y984 PolarHBondContact O-N 3.08Å; D982-Y984 VanDerWaalsContact O-N 3.15Å
985	Y	28.6	Very low	42.2	Very low	192 Å²	192	106.6 Å²	106.6	75%	0.753	53%	0.528	S	S	*	.	H	α-helix	trans	-126	-19.4	-178.3	-68.1	-69	0	0	0	115.2	D982 D983	D982-Y985 PolarHBondContact O-N 3.1Å; D983-Y985 VanDerWaalsContact C-N 3.29Å; D983-Y985 PolarHBondContact O-N 3.22Å
986	E	27.8	Very low	44.8	Very low	142 Å²	142	105.6 Å²	105.6	66%	0.664	52%	0.524	S	S	*	.	H	α-helix	trans	-85.5	-34.6	179.7	-72.1	-163.2	152.6	0	0	113.8	D988	E986-D988 PolarHBondContact O-N 3.11Å
987	D	31.1	Very low	47.4	Very low	112 Å²	112	108.6 Å²	108.6	60%	0.599	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-27.4	-174.1	-97.4	-7.3	0	0	0	114.2
988	D	38.3	Very low	50.3	Low	139 Å²	139	107.1 Å²	107.1	74%	0.743	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-20.2	-174.9	-87.3	-20.6	0	0	0	114.2	E986	E986-D988 PolarHBondContact O-N 3.11Å
989	E	39.3	Very low	53.5	Low	39 Å²	39	107.2 Å²	107.2	18%	0.182	52%	0.518	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-23.7	-178.1	-69.8	-167.8	163.6	0	0	114	R765 G852 D991	R765-E989 IonicContact CZ-OE1 3.11Å; R765-E989 VanDerWaalsContact NH2-CD 3.31Å; R765-E989 IonicContact NH2-OE1 3.19Å; R765-E989 PolarHBondContact NH2-OE1 3.36Å; G852-E989 WeakPolarHBondContact CA-OE2 3.43Å; E989-D991 PolarHBondContact O-N 3.08Å
990	E	50	Low	56.5	Low	105 Å²	105	98.6 Å²	98.6	49%	0.491	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-15.6	177.6	-67.5	-157	153.6	0	0	113.2
991	D	61	Low	59.5	Low	112 Å²	112	91.8 Å²	91.8	60%	0.599	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	3	-174.7	-92.9	-6.9	0	0	0	115	E989 P993	E989-D991 PolarHBondContact O-N 3.08Å; D991-P993 WeakPolarHBondContact O-CD 3.36Å; D991-P993 VanDerWaalsContact O-N 3.08Å
992	D	81.7	Confident	62.5	Low	21 Å²	21	92.1 Å²	92.1	11%	0.112	46%	0.455	C	S	.	.			trans	-64.5	113.5	-179.3	-171.6	-23.3	0	0	0	111.1	R718 D994 A995 L996	R718-D992 IonicContact CZ-OD2 3.66Å; R718-D992 VanDerWaalsContact CZ-OD2 3.25Å; R718-D992 IonicContact NH1-OD1 3.04Å; R718-D992 PolarHBondContact NH1-OD1 3.39Å; R718-D992 IonicContact NH1-OD2 3.78Å; R718-D992 PolarHBondContact NH1-OD2 2.99Å; R718-D992 IonicContact NH2-OD1 3.37Å; R718-D992 IonicContact NH2-OD2 3.58Å; R718-D992 PolarHBondContact NH2-OD2 3.1Å; D992-D994 PolarHBondContact O-N 3.33Å; D992-D994 VanDerWaalsContact O-N 3.11Å; D992-D994 WeakPolarHBondContact OD1-CB 3.42Å; D992-D994 PolarHBondContact OD1-N 2.94Å; D992-A995 HydrophobicContact CB-CB 4.03Å; D992-A995 PolarHBondContact O-N 3.21Å; D992-A995 VanDerWaalsContact O-N 3.09Å; D992-L996 WeakPolarHBondContact O-CG 3.34Å; D992-L996 PolarHBondContact O-N 3.13Å
993	P	83.4	Confident	65.8	Low	48 Å²	48	89.5 Å²	89.5	31%	0.312	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-14.8	-176.1	29.3	-37.1	0	0	0	113.9	D991 K997	D991-P993 WeakPolarHBondContact O-CD 3.36Å; D991-P993 VanDerWaalsContact O-N 3.08Å; P993-K997 WeakPolarHBondContact O-CD 3.18Å; P993-K997 VanDerWaalsContact O-CE 3.28Å; P993-K997 WeakPolarHBondContact O-CE 3.49Å; P993-K997 VanDerWaalsContact O-CG 3.26Å; P993-K997 WeakPolarHBondContact O-CG 3.45Å
994	D	86.1	Confident	69.1	Low	30 Å²	30	88.2 Å²	88.2	16%	0.16	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-41	172.9	-63.5	-23.2	0	0	0	111	R679 R718 S722 D992 K997 D998	R679-D994 IonicContact CZ-OD1 2.83Å; R679-D994 IonicContact CZ-OD2 3.66Å; R679-D994 IonicContact NH1-OD1 2.65Å; R679-D994 PolarHBondContact NH1-OD1 2.97Å; R679-D994 IonicContact NH1-OD2 3.45Å; R679-D994 PolarHBondContact NH1-OD2 3.06Å; R679-D994 IonicContact NH2-OD2 2.8Å; R679-D994 PolarHBondContact NH2-OD2 3.22Å; R718-D994 IonicContact CZ-OD2 3.33Å; R718-D994 IonicContact NH1-OD2 2.69Å; R718-D994 PolarHBondContact NH1-OD2 2.87Å; S722-D994 WeakPolarHBondContact CB-OD1 3.23Å; S722-D994 PolarHBondContact OG-OD1 2.95Å; D992-D994 PolarHBondContact O-N 3.33Å; D992-D994 VanDerWaalsContact O-N 3.11Å; D992-D994 WeakPolarHBondContact OD1-CB 3.42Å; D992-D994 PolarHBondContact OD1-N 2.94Å; D994-K997 PolarHBondContact O-N 3.31Å; D994-D998 PolarHBondContact O-N 3.32Å
995	A	86.3	Confident	72.2	Confident	5 Å²	5	80 Å²	80	4%	0.041	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-46.1	176.6	0	0	0	0	0	111.3	Y854 D992 K997 D998 Y1001	Y854-A995 HydrophobicContact CD1-CB 3.6Å; Y854-A995 HydrophobicContact CD2-CB 4.01Å; Y854-A995 HydrophobicContact CE1-CB 3.95Å; Y854-A995 HydrophobicContact CE2-CB 4.32Å; Y854-A995 HydrophobicContact CG-CB 3.63Å; D992-A995 HydrophobicContact CB-CB 4.03Å; D992-A995 PolarHBondContact O-N 3.21Å; D992-A995 VanDerWaalsContact O-N 3.09Å; A995-K997 PolarHBondContact O-N 3.14Å; A995-K997 VanDerWaalsContact O-N 3.08Å; A995-D998 WeakPolarHBondContact O-CB 3.4Å; A995-D998 PolarHBondContact O-N 3.33Å; A995-Y1001 HydrophobicContact CB-CD2 4.32Å; A995-Y1001 WeakPolarHBondContact O-CB 3.35Å
996	L	86.4	Confident	75.3	Confident	81 Å²	81	73.7 Å²	73.7	42%	0.424	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-22.4	177.6	-68.9	171.1	0	0	0	113.8	D992 Y1001	D992-L996 WeakPolarHBondContact O-CG 3.34Å; D992-L996 PolarHBondContact O-N 3.13Å; L996-Y1001 HydrophobicContact CD2-CD1 4.07Å; L996-Y1001 HydrophobicContact CD2-CD2 4.49Å; L996-Y1001 HydrophobicContact CD2-CE1 3.49Å; L996-Y1001 VanDerWaalsContact CD2-CE1 3.49Å; L996-Y1001 HydrophobicContact CD2-CE2 3.98Å; L996-Y1001 VanDerWaalsContact CD2-CZ 3.44Å
997	K	85.4	Confident	78.5	Confident	151 Å²	151	69 Å²	69	66%	0.657	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-15.1	177.1	-71.7	171.4	-166.9	157.6	0	113.3	P993 D994 A995	P993-K997 WeakPolarHBondContact O-CD 3.18Å; P993-K997 VanDerWaalsContact O-CE 3.28Å; P993-K997 WeakPolarHBondContact O-CE 3.49Å; P993-K997 VanDerWaalsContact O-CG 3.26Å; P993-K997 WeakPolarHBondContact O-CG 3.45Å; D994-K997 PolarHBondContact O-N 3.31Å; A995-K997 PolarHBondContact O-N 3.14Å; A995-K997 VanDerWaalsContact O-N 3.08Å
998	D	87.6	Confident	81.7	Confident	44 Å²	44	66.9 Å²	66.9	24%	0.235	35%	0.35	C	S	.	.	S	Bend	trans	-77	127.3	177.6	-166.3	-51.2	0	0	0	110	Y854 D994 A995 I1000 Y1001	Y854-D998 HydrophobicContact CE2-CB 3.75Å; Y854-D998 PolarHBondContact OH-OD2 2.95Å; D994-D998 PolarHBondContact O-N 3.32Å; A995-D998 WeakPolarHBondContact O-CB 3.4Å; A995-D998 PolarHBondContact O-N 3.33Å; D998-I1000 PolarHBondContact O-N 2.98Å; D998-I1000 VanDerWaalsContact O-N 3.09Å; D998-I1000 WeakPolarHBondContact OD1-CB 2.91Å; D998-I1000 WeakPolarHBondContact OD1-CG1 3.47Å; D998-I1000 PolarHBondContact OD1-N 3.1Å; D998-Y1001 WeakPolarHBondContact O-CB 3.39Å; D998-Y1001 PolarHBondContact O-N 3.07Å
999	P	89.6	Confident	84.5	Confident	101 Å²	101	60.3 Å²	60.3	66%	0.656	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-56	-24.6	177	-25.8	34.8	0	0	0	115.1	Y1001 L1002	P999-Y1001 PolarHBondContact O-N 3.23Å; P999-L1002 PolarHBondContact O-N 2.92Å
1000	I	92	Very high	87.2	Confident	18 Å²	18	60 Å²	60	9%	0.092	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-63.7	-31.3	176.7	-65.3	169.8	0	0	0	111	H814 K857 V858 D998 L1002 I1003	H814-I1000 HydrophobicContact CB-CD1 4.43Å; H814-I1000 WeakPolarHBondContact ND1-CD1 3.37Å; K857-I1000 HydrophobicContact CB-CG2 3.88Å; V858-I1000 HydrophobicContact CG2-CB 4.4Å; V858-I1000 HydrophobicContact CG2-CD1 4.23Å; V858-I1000 HydrophobicContact CG2-CG2 3.86Å; D998-I1000 PolarHBondContact O-N 2.98Å; D998-I1000 VanDerWaalsContact O-N 3.09Å; D998-I1000 WeakPolarHBondContact OD1-CB 2.91Å; D998-I1000 WeakPolarHBondContact OD1-CG1 3.47Å; D998-I1000 PolarHBondContact OD1-N 3.1Å; I1000-L1002 PolarHBondContact O-N 3.15Å; I1000-I1003 HydrophobicContact CB-CD1 4.39Å; I1000-I1003 HydrophobicContact CG1-CD1 4.38Å; I1000-I1003 HydrophobicContact CG2-CD1 4.33Å; I1000-I1003 WeakPolarHBondContact O-CB 3.31Å; I1000-I1003 PolarHBondContact O-N 3.38Å; I1000-I1003 VanDerWaalsContact O-N 3.08Å
1001	Y	90.9	Very high	89.4	Confident	37 Å²	37	59.6 Å²	59.6	15%	0.145	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-56.5	-37.3	177.8	-167.7	-85.7	0	0	0	112.1	Y854 K857 A995 L996 D998 P999 I1003	Y854-Y1001 AromaticContact CD2-CD2 3.78Å; Y854-Y1001 HydrophobicContact CD2-CD2 3.78Å; Y854-Y1001 HydrophobicContact CG-CD2 4.21Å; K857-Y1001 PolarHBondContact NZ-O 3.02Å; A995-Y1001 HydrophobicContact CB-CD2 4.32Å; A995-Y1001 WeakPolarHBondContact O-CB 3.35Å; L996-Y1001 HydrophobicContact CD2-CD1 4.07Å; L996-Y1001 HydrophobicContact CD2-CD2 4.49Å; L996-Y1001 HydrophobicContact CD2-CE1 3.49Å; L996-Y1001 VanDerWaalsContact CD2-CE1 3.49Å; L996-Y1001 HydrophobicContact CD2-CE2 3.98Å; L996-Y1001 VanDerWaalsContact CD2-CZ 3.44Å; D998-Y1001 WeakPolarHBondContact O-CB 3.39Å; D998-Y1001 PolarHBondContact O-N 3.07Å; P999-Y1001 PolarHBondContact O-N 3.23Å; Y1001-I1003 VanDerWaalsContact C-N 3.29Å; Y1001-I1003 PolarHBondContact O-N 3.2Å
1002	L	90.9	Very high	91.1	Very high	146 Å²	146	55.3 Å²	55.3	76%	0.764	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-80	-5.5	-177.7	-61.6	175.3	0	0	0	114.1	P999 I1000 D1004	P999-L1002 PolarHBondContact O-N 2.92Å; I1000-L1002 PolarHBondContact O-N 3.15Å; L1002-D1004 PolarHBondContact O-N 3.05Å
1003	I	92.9	Very high	91.8	Very high	45 Å²	45	54.4 Å²	54.4	23%	0.231	29%	0.288	C	S	.	.			trans	-70.3	129	179.3	-63.4	176.8	0	0	0	109.2	K857 I1000 Y1001 L1005 Y1008	K857-I1003 WeakPolarHBondContact CE-O 3.48Å; K857-I1003 PolarHBondContact NZ-O 3.42Å; I1000-I1003 HydrophobicContact CB-CD1 4.39Å; I1000-I1003 HydrophobicContact CG1-CD1 4.38Å; I1000-I1003 HydrophobicContact CG2-CD1 4.33Å; I1000-I1003 WeakPolarHBondContact O-CB 3.31Å; I1000-I1003 PolarHBondContact O-N 3.38Å; I1000-I1003 VanDerWaalsContact O-N 3.08Å; Y1001-I1003 VanDerWaalsContact C-N 3.29Å; Y1001-I1003 PolarHBondContact O-N 3.2Å; I1003-L1005 PolarHBondContact O-N 3.38Å; I1003-Y1008 HydrophobicContact CG2-CD2 4.22Å; I1003-Y1008 HydrophobicContact CG2-CG 4.08Å
1004	D	93.3	Very high	92.3	Very high	97 Å²	97	54.2 Å²	54.2	52%	0.519	29%	0.286	S	S	.	.			trans	-71.4	104.8	160.3	177.6	-9.6	0	0	0	108	L1002 Q1006 A1007 Y1008	L1002-D1004 PolarHBondContact O-N 3.05Å; D1004-Q1006 VanDerWaalsContact C-N 3.31Å; D1004-Q1006 PolarHBondContact O-N 2.91Å; D1004-Q1006 PolarHBondContact OD1-N 2.68Å; D1004-A1007 HydrophobicContact CB-CB 4.02Å; D1004-A1007 PolarHBondContact O-N 3.42Å; D1004-A1007 PolarHBondContact OD1-N 2.82Å; D1004-A1007 WeakPolarHBondContact OD2-CB 3.32Å; D1004-Y1008 WeakPolarHBondContact O-CB 3.27Å; D1004-Y1008 PolarHBondContact O-N 3.23Å
1005	L	93.4	Very high	92.7	Very high	15 Å²	15	58.5 Å²	58.5	8%	0.079	31%	0.305	C	S	.	.	H	α-helix	trans	-64.9	-36.5	-174.9	-171.7	57.4	0	0	0	111.4	K857 T860 V861 V928 I1003 Y1008 L1009	K857-L1005 HydrophobicContact CG-CB 4.22Å; K857-L1005 HydrophobicContact CG-CD1 4.47Å; K857-L1005 HydrophobicContact CG-CD2 4.02Å; K857-L1005 HydrophobicContact CG-CG 4.47Å; T860-L1005 HydrophobicContact CG2-CD1 3.99Å; V861-L1005 HydrophobicContact CG2-CD1 4.32Å; V928-L1005 HydrophobicContact CG2-CB 4.49Å; V928-L1005 HydrophobicContact CG2-CD2 3.68Å; V928-L1005 HydrophobicContact CG2-CG 4.1Å; I1003-L1005 PolarHBondContact O-N 3.38Å; L1005-Y1008 PolarHBondContact O-N 3.25Å; L1005-L1009 HydrophobicContact CD1-CD1 4.02Å; L1005-L1009 HydrophobicContact CD1-CD2 4.4Å; L1005-L1009 HydrophobicContact CD1-CG 3.98Å; L1005-L1009 HydrophobicContact CG-CD1 3.86Å; L1005-L1009 HydrophobicContact CG-CG 4.26Å; L1005-L1009 WeakPolarHBondContact O-CB 3.37Å; L1005-L1009 WeakPolarHBondContact O-CG 3.48Å; L1005-L1009 PolarHBondContact O-N 2.88Å
1006	Q	94.4	Very high	93.1	Very high	60 Å²	60	58.5 Å²	58.5	28%	0.28	30%	0.304	S	S	.	.	H	α-helix	trans	-65.3	-48.9	179.3	-171	177.3	-25.8	0	0	110.7	L925 V928 V929 N932 D1004 L1009 T1010	L925-Q1006 HydrophobicContact CD1-CG 4.1Å; V928-Q1006 HydrophobicContact CG1-CB 3.72Å; V928-Q1006 HydrophobicContact CG1-CG 4.45Å; V929-Q1006 HydrophobicContact CG2-CG 4.06Å; N932-Q1006 PolarHBondContact ND2-OE1 3.48Å; D1004-Q1006 VanDerWaalsContact C-N 3.31Å; D1004-Q1006 PolarHBondContact O-N 2.91Å; D1004-Q1006 PolarHBondContact OD1-N 2.68Å; Q1006-L1009 PolarHBondContact O-N 3.07Å; Q1006-T1010 VanDerWaalsContact O-CB 3.31Å; Q1006-T1010 WeakPolarHBondContact O-CB 3.34Å; Q1006-T1010 PolarHBondContact O-N 3.07Å; Q1006-T1010 PolarHBondContact O-OG1 3.34Å
1007	A	94.8	Very high	93.4	Very high	43 Å²	43	55.6 Å²	55.6	36%	0.355	29%	0.291	S	S	.	.	H	α-helix	trans	-61.9	-46	178.5	0	0	0	0	0	111.2	D1004 L1009 T1010 D1011	D1004-A1007 HydrophobicContact CB-CB 4.02Å; D1004-A1007 PolarHBondContact O-N 3.42Å; D1004-A1007 PolarHBondContact OD1-N 2.82Å; D1004-A1007 WeakPolarHBondContact OD2-CB 3.32Å; A1007-L1009 PolarHBondContact O-N 3.3Å; A1007-T1010 PolarHBondContact O-N 3Å; A1007-D1011 WeakPolarHBondContact O-CB 3.48Å; A1007-D1011 PolarHBondContact O-N 2.87Å
1008	Y	97.2	Very high	93.8	Very high	68 Å²	68	55.8 Å²	55.8	27%	0.267	30%	0.295	S	S	.	.	H	α-helix	trans	-59.3	-47.3	178.7	-178	-88.8	0	0	0	112.4	V861 C864 I1003 D1004 L1005 D1011 F1012	V861-Y1008 HydrophobicContact CB-CE1 4.32Å; V861-Y1008 HydrophobicContact CG1-CE1 4.1Å; V861-Y1008 HydrophobicContact CG2-CD1 3.95Å; V861-Y1008 HydrophobicContact CG2-CE1 3.8Å; C864-Y1008 HydrophobicContact CB-CE1 4.03Å; I1003-Y1008 HydrophobicContact CG2-CD2 4.22Å; I1003-Y1008 HydrophobicContact CG2-CG 4.08Å; D1004-Y1008 WeakPolarHBondContact O-CB 3.27Å; D1004-Y1008 PolarHBondContact O-N 3.23Å; L1005-Y1008 PolarHBondContact O-N 3.25Å; Y1008-D1011 PolarHBondContact O-N 3.45Å; Y1008-F1012 VanDerWaalsContact O-CB 3.3Å; Y1008-F1012 WeakPolarHBondContact O-CB 3.15Å; Y1008-F1012 PolarHBondContact O-N 3.12Å
1009	L	97.1	Very high	94	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-67.8	-39.6	-179.8	-68.2	174.8	0	0	0	111.9	T860 I921 E924 L925 L1005 Q1006 A1007 F1012 L1013	T860-L1009 HydrophobicContact CG2-CD1 3.94Å; T860-L1009 HydrophobicContact CG2-CD2 3.44Å; T860-L1009 VanDerWaalsContact CG2-CD2 3.44Å; T860-L1009 HydrophobicContact CG2-CG 4.18Å; I921-L1009 HydrophobicContact CG2-CD2 3.78Å; E924-L1009 HydrophobicContact CB-CD1 4.03Å; L925-L1009 HydrophobicContact CB-CB 4.33Å; L925-L1009 HydrophobicContact CB-CD1 4.14Å; L925-L1009 HydrophobicContact CD1-CB 4.13Å; L1005-L1009 HydrophobicContact CD1-CD1 4.02Å; L1005-L1009 HydrophobicContact CD1-CD2 4.4Å; L1005-L1009 HydrophobicContact CD1-CG 3.98Å; L1005-L1009 HydrophobicContact CG-CD1 3.86Å; L1005-L1009 HydrophobicContact CG-CG 4.26Å; L1005-L1009 WeakPolarHBondContact O-CB 3.37Å; L1005-L1009 WeakPolarHBondContact O-CG 3.48Å; L1005-L1009 PolarHBondContact O-N 2.88Å; Q1006-L1009 PolarHBondContact O-N 3.07Å; A1007-L1009 PolarHBondContact O-N 3.3Å; L1009-F1012 PolarHBondContact O-N 2.88Å; L1009-L1013 WeakPolarHBondContact O-CB 3.41Å; L1009-L1013 VanDerWaalsContact O-CG 3.29Å; L1009-L1013 WeakPolarHBondContact O-CG 3.47Å; L1009-L1013 PolarHBondContact O-N 2.93Å
1010	T	95.9	Very high	94	Very high	32 Å²	32	57.1 Å²	57.1	20%	0.196	30%	0.302	C	S	.	.	H	α-helix	trans	-60.5	-47.7	176.4	-59	0	0	0	0	111	Q1006 A1007 T1014 I1040	Q1006-T1010 VanDerWaalsContact O-CB 3.31Å; Q1006-T1010 WeakPolarHBondContact O-CB 3.34Å; Q1006-T1010 PolarHBondContact O-N 3.07Å; Q1006-T1010 PolarHBondContact O-OG1 3.34Å; A1007-T1010 PolarHBondContact O-N 3Å; T1010-T1014 VanDerWaalsContact O-CB 3.32Å; T1010-T1014 WeakPolarHBondContact O-CB 3.3Å; T1010-T1014 PolarHBondContact O-N 3.25Å; T1010-T1014 PolarHBondContact O-OG1 3.48Å; T1010-I1040 HydrophobicContact CG2-CB 4.12Å; T1010-I1040 HydrophobicContact CG2-CD1 4.37Å; T1010-I1040 HydrophobicContact CG2-CG2 4.15Å
1011	D	96.4	Very high	93.9	Very high	98 Å²	98	57.9 Å²	57.9	52%	0.524	31%	0.308	S	S	.	.	H	α-helix	trans	-62.9	-44.9	177	-80.3	-13	0	0	0	111.5	A1007 Y1008 T1014 Q1015	A1007-D1011 WeakPolarHBondContact O-CB 3.48Å; A1007-D1011 PolarHBondContact O-N 2.87Å; Y1008-D1011 PolarHBondContact O-N 3.45Å; D1011-T1014 PolarHBondContact O-N 3.36Å; D1011-Q1015 WeakPolarHBondContact O-CB 3.49Å; D1011-Q1015 VanDerWaalsContact O-CG 3.29Å; D1011-Q1015 WeakPolarHBondContact O-CG 3.44Å; D1011-Q1015 PolarHBondContact O-N 3.07Å
1012	F	97.3	Very high	94	Very high	21 Å²	21	58 Å²	58	9%	0.092	31%	0.308	C	S	.	.	H	α-helix	trans	-60	-50.3	178.9	178.8	-90.9	0	0	0	111.8	C864 L867 Q868 I921 Y1008 L1009 T1014 Q1015 F1016	C864-F1012 HydrophobicContact CB-CD1 4.36Å; C864-F1012 HydrophobicContact CB-CD2 3.81Å; C864-F1012 HydrophobicContact CB-CE1 4.23Å; C864-F1012 HydrophobicContact CB-CE2 3.64Å; C864-F1012 HydrophobicContact CB-CG 4.17Å; C864-F1012 HydrophobicContact CB-CZ 3.87Å; C864-F1012 WeakPolarHBondContact O-CE2 3.13Å; C864-F1012 WeakPolarHBondContact O-CZ 3.4Å; L867-F1012 HydrophobicContact CB-CZ 4.3Å; L867-F1012 HydrophobicContact CD2-CE1 3.95Å; L867-F1012 HydrophobicContact CD2-CZ 4.02Å; L867-F1012 HydrophobicContact CG-CZ 4.34Å; Q868-F1012 HydrophobicContact CB-CE2 4.2Å; I921-F1012 HydrophobicContact CD1-CE1 3.91Å; I921-F1012 HydrophobicContact CD1-CZ 4.46Å; I921-F1012 HydrophobicContact CG2-CD1 4.3Å; Y1008-F1012 VanDerWaalsContact O-CB 3.3Å; Y1008-F1012 WeakPolarHBondContact O-CB 3.15Å; Y1008-F1012 PolarHBondContact O-N 3.12Å; L1009-F1012 PolarHBondContact O-N 2.88Å; F1012-T1014 PolarHBondContact O-N 2.89Å; F1012-Q1015 PolarHBondContact O-N 2.87Å; F1012-F1016 VanDerWaalsContact O-CB 3.3Å; F1012-F1016 WeakPolarHBondContact O-CB 3.43Å; F1012-F1016 PolarHBondContact O-N 3.37Å
1013	L	96.6	Very high	93.9	Very high	2 Å²	2	54.4 Å²	54.4	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-65.8	-37.9	-179.3	-70.9	168.7	0	0	0	111.8	F918 I921 I922 L925 L1009 F1016 A1017 L1037 I1040 L1042	F918-L1013 HydrophobicContact CD2-CD2 4.05Å; F918-L1013 HydrophobicContact CE2-CD2 3.44Å; F918-L1013 VanDerWaalsContact CE2-CD2 3.44Å; F918-L1013 HydrophobicContact CZ-CD2 4.34Å; I921-L1013 HydrophobicContact CG2-CD1 4.35Å; I921-L1013 HydrophobicContact CG2-CD2 3.92Å; I921-L1013 HydrophobicContact CG2-CG 4.16Å; I922-L1013 HydrophobicContact CG1-CD1 4.44Å; I922-L1013 HydrophobicContact CG1-CD2 4.14Å; L925-L1013 HydrophobicContact CB-CD1 4.35Å; L925-L1013 HydrophobicContact CD2-CD1 3.6Å; L1009-L1013 WeakPolarHBondContact O-CB 3.41Å; L1009-L1013 VanDerWaalsContact O-CG 3.29Å; L1009-L1013 WeakPolarHBondContact O-CG 3.47Å; L1009-L1013 PolarHBondContact O-N 2.93Å; L1013-F1016 PolarHBondContact O-N 3Å; L1013-A1017 WeakPolarHBondContact O-CB 3.27Å; L1013-A1017 PolarHBondContact O-N 3.31Å; L1013-L1037 HydrophobicContact CB-CD2 4.4Å; L1013-L1037 HydrophobicContact CD1-CD2 4Å; L1013-L1037 HydrophobicContact CD2-CD2 4.33Å; L1013-L1037 HydrophobicContact CG-CD2 4.49Å; L1013-I1040 HydrophobicContact CB-CD1 4.03Å; L1013-I1040 HydrophobicContact CD1-CD1 4.16Å; L1013-L1042 HydrophobicContact CB-CD1 4.22Å
1014	T	94.9	Very high	93.8	Very high	44 Å²	44	58.3 Å²	58.3	27%	0.27	32%	0.315	S	S	.	.	H	α-helix	trans	-63.2	-43.3	175.8	-58.7	0	0	0	0	111.8	T1010 D1011 F1012	T1010-T1014 VanDerWaalsContact O-CB 3.32Å; T1010-T1014 WeakPolarHBondContact O-CB 3.3Å; T1010-T1014 PolarHBondContact O-N 3.25Å; T1010-T1014 PolarHBondContact O-OG1 3.48Å; D1011-T1014 PolarHBondContact O-N 3.36Å; F1012-T1014 PolarHBondContact O-N 2.89Å
1015	Q	94.4	Very high	93.7	Very high	121 Å²	121	54.7 Å²	54.7	57%	0.565	29%	0.294	S	S	*	.	H	α-helix	trans	-69	-38.6	175.5	-69.5	176	30.6	0	0	111.8	D1011 F1012 Q1018	D1011-Q1015 WeakPolarHBondContact O-CB 3.49Å; D1011-Q1015 VanDerWaalsContact O-CG 3.29Å; D1011-Q1015 WeakPolarHBondContact O-CG 3.44Å; D1011-Q1015 PolarHBondContact O-N 3.07Å; F1012-Q1015 PolarHBondContact O-N 2.87Å; Q1015-Q1018 PolarHBondContact O-N 3.28Å
1016	F	94.4	Very high	93.6	Very high	4 Å²	4	55.3 Å²	55.3	2%	0.018	30%	0.3	C	S	.	.	H	α-helix	trans	-63.4	-42.1	178.7	-170.9	-97.7	0	0	0	112.2	L867 I871 F918 F1012 L1013 Q1018 Q1019 Y1022 F1025	L867-F1016 HydrophobicContact CD1-CE2 4.04Å; L867-F1016 HydrophobicContact CD1-CZ 4.13Å; L867-F1016 HydrophobicContact CD2-CD2 4.22Å; L867-F1016 HydrophobicContact CD2-CE2 3.77Å; L867-F1016 HydrophobicContact CD2-CZ 4.01Å; L867-F1016 HydrophobicContact CG-CD2 4.44Å; L867-F1016 HydrophobicContact CG-CE2 3.75Å; L867-F1016 HydrophobicContact CG-CZ 4.22Å; I871-F1016 HydrophobicContact CD1-CE2 3.32Å; I871-F1016 HydrophobicContact CD1-CZ 3.63Å; F918-F1016 AromaticContact CD2-CD1 3.89Å; F918-F1016 HydrophobicContact CD2-CD1 3.89Å; F918-F1016 AromaticContact CD2-CE1 3.73Å; F918-F1016 HydrophobicContact CD2-CE1 3.73Å; F918-F1016 HydrophobicContact CD2-CZ 4.41Å; F918-F1016 AromaticContact CE2-CD1 3.51Å; F918-F1016 HydrophobicContact CE2-CD1 3.51Å; F918-F1016 AromaticContact CE2-CE1 3.72Å; F918-F1016 HydrophobicContact CE2-CE1 3.72Å; F918-F1016 HydrophobicContact CE2-CG 4.43Å; F918-F1016 HydrophobicContact CG-CE1 4.24Å; F918-F1016 HydrophobicContact CZ-CD1 4.15Å; F918-F1016 HydrophobicContact CZ-CE1 4.22Å; F1012-F1016 VanDerWaalsContact O-CB 3.3Å; F1012-F1016 WeakPolarHBondContact O-CB 3.43Å; F1012-F1016 PolarHBondContact O-N 3.37Å; L1013-F1016 PolarHBondContact O-N 3Å; F1016-Q1018 PolarHBondContact O-N 3.07Å; F1016-Q1019 WeakPolarHBondContact O-CB 3.46Å; F1016-Q1019 PolarHBondContact O-N 3.42Å; F1016-Y1022 AromaticContact CD1-CD2 4Å; F1016-Y1022 HydrophobicContact CD1-CD2 4Å; F1016-Y1022 HydrophobicContact CE1-CD2 4.14Å; F1016-F1025 HydrophobicContact CE1-CB 4.38Å; F1016-F1025 HydrophobicContact CE1-CD1 4.18Å; F1016-F1025 HydrophobicContact CE1-CG 4.14Å; F1016-F1025 HydrophobicContact CZ-CD1 4.03Å; F1016-F1025 HydrophobicContact CZ-CD2 4.34Å; F1016-F1025 HydrophobicContact CZ-CE1 4.04Å; F1016-F1025 HydrophobicContact CZ-CE2 4.37Å; F1016-F1025 HydrophobicContact CZ-CG 4.18Å; F1016-F1025 HydrophobicContact CZ-CZ 4.23Å
1017	A	92.9	Very high	93.5	Very high	20 Å²	20	58 Å²	58	17%	0.165	32%	0.316	C	S	.	.	H	α-helix	trans	-62.7	-22.8	-179.7	0	0	0	0	0	113.8	L1013 Q1019 Y1022 L1042	L1013-A1017 WeakPolarHBondContact O-CB 3.27Å; L1013-A1017 PolarHBondContact O-N 3.31Å; A1017-Q1019 VanDerWaalsContact C-N 3.32Å; A1017-Y1022 HydrophobicContact CB-CD1 4.14Å; A1017-Y1022 HydrophobicContact CB-CD2 4.29Å; A1017-Y1022 HydrophobicContact CB-CE1 4.01Å; A1017-Y1022 HydrophobicContact CB-CE2 4.18Å; A1017-Y1022 HydrophobicContact CB-CG 4.27Å; A1017-Y1022 WeakPolarHBondContact O-CD1 3.42Å; A1017-L1042 HydrophobicContact CB-CD1 4.03Å; A1017-L1042 HydrophobicContact CB-CD2 3.64Å; A1017-L1042 HydrophobicContact CB-CG 4.4Å
1018	Q	92.4	Very high	93.4	Very high	155 Å²	155	59.7 Å²	59.7	72%	0.724	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-11.5	176.3	-63.4	176.2	14.8	0	0	113.2	Q1015 F1016	Q1015-Q1018 PolarHBondContact O-N 3.28Å; F1016-Q1018 PolarHBondContact O-N 3.07Å
1019	Q	92.8	Very high	93.2	Very high	49 Å²	49	57 Å²	57	23%	0.229	31%	0.306	C	S	.	.	S	Bend	trans	-78.3	147.4	-179.3	-59.7	-172.4	10.4	0	0	111.9	F1016 A1017 C1021 Y1022	F1016-Q1019 WeakPolarHBondContact O-CB 3.46Å; F1016-Q1019 PolarHBondContact O-N 3.42Å; A1017-Q1019 VanDerWaalsContact C-N 3.32Å; Q1019-C1021 PolarHBondContact O-N 2.95Å; Q1019-C1021 VanDerWaalsContact O-N 3.13Å; Q1019-Y1022 VanDerWaalsContact O-CB 3.3Å; Q1019-Y1022 WeakPolarHBondContact O-CB 3.19Å; Q1019-Y1022 PolarHBondContact O-N 3.42Å
1020	P	89.8	Confident	92.9	Very high	124 Å²	124	59.3 Å²	59.3	81%	0.805	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-31.2	-177.8	-24.2	33.3	0	0	0	114.3	Y1022 S1023	P1020-Y1022 VanDerWaalsContact C-N 3.25Å; P1020-Y1022 PolarHBondContact O-N 3.45Å; P1020-S1023 PolarHBondContact O-OG 2.92Å
1021	C	90.3	Very high	92.6	Very high	34 Å²	34	64 Å²	64	23%	0.23	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-22.3	-180	54.9	0	0	0	0	113.2	Q1019 S1023 M1024 F1025	Q1019-C1021 PolarHBondContact O-N 2.95Å; Q1019-C1021 VanDerWaalsContact O-N 3.13Å; C1021-S1023 PolarHBondContact O-N 2.59Å; C1021-S1023 VanDerWaalsContact O-N 3.12Å; C1021-M1024 PolarHBondContact O-N 3.27Å; C1021-F1025 HydrophobicContact CB-CD2 4.45Å; C1021-F1025 HydrophobicContact CB-CE2 4.22Å; C1021-F1025 WeakPolarHBondContact O-CD2 3.31Å; C1021-F1025 PolarHBondContact O-N 2.99Å
1022	Y	91.9	Very high	92.3	Very high	39 Å²	39	62 Å²	62	15%	0.153	34%	0.341	C	S	.	.	H	α-helix	trans	-54.7	-36.3	-175.9	178.5	-115.9	0	0	0	113.3	F918 F1016 A1017 Q1019 P1020 M1024 F1025 S1026	F918-Y1022 HydrophobicContact CE1-CE2 4.23Å; F918-Y1022 HydrophobicContact CZ-CD2 4.28Å; F918-Y1022 AromaticContact CZ-CE2 3.75Å; F918-Y1022 HydrophobicContact CZ-CE2 3.75Å; F1016-Y1022 AromaticContact CD1-CD2 4Å; F1016-Y1022 HydrophobicContact CD1-CD2 4Å; F1016-Y1022 HydrophobicContact CE1-CD2 4.14Å; A1017-Y1022 HydrophobicContact CB-CD1 4.14Å; A1017-Y1022 HydrophobicContact CB-CD2 4.29Å; A1017-Y1022 HydrophobicContact CB-CE1 4.01Å; A1017-Y1022 HydrophobicContact CB-CE2 4.18Å; A1017-Y1022 HydrophobicContact CB-CG 4.27Å; A1017-Y1022 WeakPolarHBondContact O-CD1 3.42Å; Q1019-Y1022 VanDerWaalsContact O-CB 3.3Å; Q1019-Y1022 WeakPolarHBondContact O-CB 3.19Å; Q1019-Y1022 PolarHBondContact O-N 3.42Å; P1020-Y1022 VanDerWaalsContact C-N 3.25Å; P1020-Y1022 PolarHBondContact O-N 3.45Å; Y1022-M1024 PolarHBondContact O-N 3.48Å; Y1022-M1024 VanDerWaalsContact O-N 3.13Å; Y1022-F1025 PolarHBondContact O-N 3.4Å; Y1022-S1026 PolarHBondContact O-N 3.38Å; Y1022-S1026 PolarHBondContact O-OG 3.45Å
1023	S	89.1	Confident	92.1	Very high	72 Å²	72	62 Å²	62	50%	0.503	34%	0.341	S	S	.	.	H	α-helix	trans	-55.8	-30.5	177.1	61.1	0	0	0	0	114.2	P1020 C1021 S1026 N1027	P1020-S1023 PolarHBondContact O-OG 2.92Å; C1021-S1023 PolarHBondContact O-N 2.59Å; C1021-S1023 VanDerWaalsContact O-N 3.12Å; S1023-S1026 PolarHBondContact O-OG 3.29Å; S1023-N1027 PolarHBondContact O-ND2 3.04Å
1024	M	89.8	Confident	91.9	Very high	127 Å²	127	67 Å²	67	63%	0.626	36%	0.36	S	S	*	.	H	α-helix	trans	-80.8	-38.1	175	-69.8	-65.5	-66.3	0	0	111.5	C1021 Y1022 H1028	C1021-M1024 PolarHBondContact O-N 3.27Å; Y1022-M1024 PolarHBondContact O-N 3.48Å; Y1022-M1024 VanDerWaalsContact O-N 3.13Å; M1024-H1028 PolarHBondContact O-CD2 3.18Å
1025	F	93.1	Very high	91.8	Very high	21 Å²	21	71 Å²	71	9%	0.092	38%	0.375	C	S	.	.	H	α-helix	trans	-68.8	-42	179.8	-77.7	-108.2	0	0	0	112	L867 I871 L914 V915 F918 F1016 C1021 Y1022 N1027 H1028	L867-F1025 HydrophobicContact CD1-CE1 3.97Å; L867-F1025 HydrophobicContact CD1-CZ 4.31Å; I871-F1025 HydrophobicContact CD1-CE2 4.24Å; I871-F1025 HydrophobicContact CD1-CZ 3.9Å; L914-F1025 HydrophobicContact CB-CE1 3.91Å; L914-F1025 HydrophobicContact CB-CZ 3.88Å; L914-F1025 WeakPolarHBondContact O-CE1 3.44Å; V915-F1025 HydrophobicContact CG2-CD1 4.02Å; V915-F1025 HydrophobicContact CG2-CE1 4.04Å; F918-F1025 HydrophobicContact CB-CD1 3.88Å; F918-F1025 HydrophobicContact CB-CE1 4.26Å; F918-F1025 HydrophobicContact CD1-CB 4.05Å; F918-F1025 AromaticContact CD1-CD1 3.98Å; F918-F1025 HydrophobicContact CD1-CD1 3.98Å; F918-F1025 HydrophobicContact CE1-CB 4.16Å; F918-F1025 HydrophobicContact CG-CD1 4.02Å; F1016-F1025 HydrophobicContact CE1-CB 4.38Å; F1016-F1025 HydrophobicContact CE1-CD1 4.18Å; F1016-F1025 HydrophobicContact CE1-CG 4.14Å; F1016-F1025 HydrophobicContact CZ-CD1 4.03Å; F1016-F1025 HydrophobicContact CZ-CD2 4.34Å; F1016-F1025 HydrophobicContact CZ-CE1 4.04Å; F1016-F1025 HydrophobicContact CZ-CE2 4.37Å; F1016-F1025 HydrophobicContact CZ-CG 4.18Å; F1016-F1025 HydrophobicContact CZ-CZ 4.23Å; C1021-F1025 HydrophobicContact CB-CD2 4.45Å; C1021-F1025 HydrophobicContact CB-CE2 4.22Å; C1021-F1025 WeakPolarHBondContact O-CD2 3.31Å; C1021-F1025 PolarHBondContact O-N 2.99Å; Y1022-F1025 PolarHBondContact O-N 3.4Å; F1025-N1027 PolarHBondContact O-N 2.69Å; F1025-H1028 WeakPolarHBondContact O-CB 3.33Å; F1025-H1028 PolarHBondContact O-N 2.89Å
1026	S	90.5	Very high	91.7	Very high	27 Å²	27	66.1 Å²	66.1	19%	0.189	35%	0.353	C	S	.	.	H	α-helix	trans	-62.2	-28.1	-178.5	64	0	0	0	0	113.2	Y1022 S1023 H1028 L1029 R1034	Y1022-S1026 PolarHBondContact O-N 3.38Å; Y1022-S1026 PolarHBondContact O-OG 3.45Å; S1023-S1026 PolarHBondContact O-OG 3.29Å; S1026-H1028 PolarHBondContact O-N 3.05Å; S1026-L1029 PolarHBondContact O-N 3.22Å; S1026-R1034 PolarHBondContact O-NH2 2.99Å
1027	N	91.6	Very high	91.6	Very high	116 Å²	116	66 Å²	66	62%	0.62	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-21.8	175.2	-70.9	-33	0	0	0	113.5	S1023 F1025	S1023-N1027 PolarHBondContact O-ND2 3.04Å; F1025-N1027 PolarHBondContact O-N 2.69Å
1028	H	92.5	Very high	91.5	Very high	79 Å²	79	71.3 Å²	71.3	37%	0.366	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-9.5	177	-74.2	-84.5	0	0	0	113.2	V915 K919 M1024 F1025 S1026	V915-H1028 HydrophobicContact CG1-CB 3.39Å; K919-H1028 WeakPolarHBondContact CE-O 3.33Å; K919-H1028 PolarHBondContact NZ-O 3.43Å; M1024-H1028 PolarHBondContact O-CD2 3.18Å; F1025-H1028 WeakPolarHBondContact O-CB 3.33Å; F1025-H1028 PolarHBondContact O-N 2.89Å; S1026-H1028 PolarHBondContact O-N 3.05Å
1029	L	92.8	Very high	91.3	Very high	11 Å²	11	67.9 Å²	67.9	6%	0.058	37%	0.368	C	S	.	.			trans	-75.2	135.2	-176.6	-61.9	-178.5	0	0	0	112.4	F918 K919 I922 S1026 E1033 R1034 L1037	F918-L1029 HydrophobicContact CD1-CD2 3.95Å; F918-L1029 HydrophobicContact CE1-CD1 3.97Å; F918-L1029 HydrophobicContact CE1-CD2 3.71Å; F918-L1029 HydrophobicContact CE1-CG 4.13Å; K919-L1029 HydrophobicContact CG-CD2 4.18Å; I922-L1029 HydrophobicContact CD1-CD1 4.19Å; I922-L1029 HydrophobicContact CD1-CD2 3.59Å; S1026-L1029 PolarHBondContact O-N 3.22Å; L1029-E1033 WeakPolarHBondContact CA-OE2 3.35Å; L1029-E1033 HydrophobicContact CB-CB 4.34Å; L1029-E1033 HydrophobicContact CD2-CB 4.12Å; L1029-E1033 WeakPolarHBondContact CD2-OE2 3.32Å; L1029-R1034 HydrophobicContact CB-CG 3.83Å; L1029-R1034 HydrophobicContact CD1-CG 4.3Å; L1029-R1034 PolarHBondContact O-NE 3.41Å; L1029-R1034 VanDerWaalsContact O-NE 3.13Å; L1029-R1034 PolarHBondContact O-NH2 2.93Å; L1029-L1037 HydrophobicContact CD1-CD1 3.46Å; L1029-L1037 VanDerWaalsContact CD1-CD1 3.46Å
1030	N	91.1	Very high	91	Very high	50 Å²	50	67.4 Å²	67.4	27%	0.267	37%	0.366	S	S	.	.			trans	-77	176.7	170.1	75.3	42	0	0	0	110.7	E886 A1032 E1033 R1034	E886-N1030 PolarHBondContact OE1-ND2 2.81Å; N1030-A1032 PolarHBondContact OD1-N 3.19Å; N1030-E1033 PolarHBondContact N-OE2 2.92Å; N1030-E1033 PolarHBondContact ND2-OE1 3.33Å; N1030-E1033 PolarHBondContact ND2-OE2 3.27Å; N1030-E1033 WeakPolarHBondContact OD1-CG 3.47Å; N1030-E1033 PolarHBondContact OD1-N 2.89Å; N1030-R1034 VanDerWaalsContact O-CG 3.29Å; N1030-R1034 WeakPolarHBondContact O-CG 3.42Å; N1030-R1034 PolarHBondContact O-N 3.28Å; N1030-R1034 VanDerWaalsContact O-N 3.17Å
1031	N	89.8	Confident	90.5	Very high	129 Å²	129	64.8 Å²	64.8	69%	0.69	36%	0.362	S	S	*	.	H	α-helix	trans	-68	-40	-175.4	-70.9	-21.6	0	0	0	113.2	R1034 Q1035	N1031-R1034 PolarHBondContact O-N 3.07Å; N1031-Q1035 WeakPolarHBondContact O-CG 3.47Å; N1031-Q1035 PolarHBondContact O-N 3.43Å
1032	A	89.7	Confident	89.8	Confident	58 Å²	58	67 Å²	67	48%	0.479	37%	0.371	S	S	.	.	H	α-helix	trans	-64.9	-46.1	179.9	0	0	0	0	0	110.9	N1030 R1034 Q1035 T1036	N1030-A1032 PolarHBondContact OD1-N 3.19Å; A1032-R1034 VanDerWaalsContact C-N 3.29Å; A1032-R1034 PolarHBondContact O-N 3.42Å; A1032-Q1035 WeakPolarHBondContact O-CB 3.26Å; A1032-Q1035 PolarHBondContact O-N 2.82Å; A1032-T1036 PolarHBondContact O-N 3Å; A1032-T1036 PolarHBondContact O-OG1 3.49Å
1033	E	94.1	Very high	89.7	Confident	21 Å²	21	68.4 Å²	68.4	10%	0.098	38%	0.381	C	S	.	.	H	α-helix	trans	-60.9	-38	176.7	-66.1	164.6	159.1	0	0	112.3	K919 I922 L1029 N1030 T1036 L1037	K919-E1033 VanDerWaalsContact CB-OE1 3.29Å; K919-E1033 WeakPolarHBondContact CB-OE1 3.24Å; K919-E1033 WeakPolarHBondContact CD-OE1 3.46Å; K919-E1033 WeakPolarHBondContact CG-OE1 3.23Å; K919-E1033 IonicContact NZ-OE1 3.59Å; K919-E1033 PolarHBondContact NZ-OE1 3.44Å; K919-E1033 IonicContact NZ-OE2 2.73Å; K919-E1033 PolarHBondContact NZ-OE2 3.07Å; I922-E1033 HydrophobicContact CD1-CB 4.42Å; I922-E1033 HydrophobicContact CG2-CB 4.07Å; I922-E1033 HydrophobicContact CG2-CG 4.37Å; L1029-E1033 WeakPolarHBondContact CA-OE2 3.35Å; L1029-E1033 HydrophobicContact CB-CB 4.34Å; L1029-E1033 HydrophobicContact CD2-CB 4.12Å; L1029-E1033 WeakPolarHBondContact CD2-OE2 3.32Å; N1030-E1033 PolarHBondContact N-OE2 2.92Å; N1030-E1033 PolarHBondContact ND2-OE1 3.33Å; N1030-E1033 PolarHBondContact ND2-OE2 3.27Å; N1030-E1033 WeakPolarHBondContact OD1-CG 3.47Å; N1030-E1033 PolarHBondContact OD1-N 2.89Å; E1033-T1036 PolarHBondContact O-N 2.96Å; E1033-L1037 PolarHBondContact O-N 3.39Å; E1033-L1037 VanDerWaalsContact O-N 3.09Å
1034	R	92.9	Very high	89.7	Confident	107 Å²	107	68.2 Å²	68.2	40%	0.404	38%	0.375	S	S	.	.	H	α-helix	trans	-65.8	-38.5	174.1	-72.1	173.9	-168.6	-132	0.2	111.8	S1026 L1029 N1030 N1031 A1032 L1037 Q1038	S1026-R1034 PolarHBondContact O-NH2 2.99Å; L1029-R1034 HydrophobicContact CB-CG 3.83Å; L1029-R1034 HydrophobicContact CD1-CG 4.3Å; L1029-R1034 PolarHBondContact O-NE 3.41Å; L1029-R1034 VanDerWaalsContact O-NE 3.13Å; L1029-R1034 PolarHBondContact O-NH2 2.93Å; N1030-R1034 VanDerWaalsContact O-CG 3.29Å; N1030-R1034 WeakPolarHBondContact O-CG 3.42Å; N1030-R1034 PolarHBondContact O-N 3.28Å; N1030-R1034 VanDerWaalsContact O-N 3.17Å; N1031-R1034 PolarHBondContact O-N 3.07Å; A1032-R1034 VanDerWaalsContact C-N 3.29Å; A1032-R1034 PolarHBondContact O-N 3.42Å; R1034-L1037 PolarHBondContact O-N 3.22Å; R1034-Q1038 VanDerWaalsContact O-CG 3.29Å; R1034-Q1038 WeakPolarHBondContact O-CG 3.45Å; R1034-Q1038 PolarHBondContact O-N 2.85Å
1035	Q	92.3	Very high	89.7	Confident	126 Å²	126	64.9 Å²	64.9	59%	0.589	36%	0.361	S	S	*	.	H	α-helix	trans	-64.5	-41.2	176.1	-73.7	171.3	-17.2	0	0	111.3	N1031 A1032 L1037 Q1038 S1039	N1031-Q1035 WeakPolarHBondContact O-CG 3.47Å; N1031-Q1035 PolarHBondContact O-N 3.43Å; A1032-Q1035 WeakPolarHBondContact O-CB 3.26Å; A1032-Q1035 PolarHBondContact O-N 2.82Å; Q1035-L1037 VanDerWaalsContact C-N 3.33Å; Q1035-L1037 PolarHBondContact O-N 3.24Å; Q1035-Q1038 PolarHBondContact O-N 3Å; Q1035-S1039 PolarHBondContact O-N 3.34Å
1036	T	92.4	Very high	89.5	Confident	19 Å²	19	67.5 Å²	67.5	12%	0.117	38%	0.377	C	S	.	.	H	α-helix	trans	-61.4	-39.3	173.8	-51	0	0	0	0	112	I922 L925 A1032 E1033 S1039	I922-T1036 HydrophobicContact CG2-CG2 3.85Å; L925-T1036 HydrophobicContact CD2-CG2 4.26Å; L925-T1036 HydrophobicContact CG-CG2 4.37Å; A1032-T1036 PolarHBondContact O-N 3Å; A1032-T1036 PolarHBondContact O-OG1 3.49Å; E1033-T1036 PolarHBondContact O-N 2.96Å; T1036-S1039 PolarHBondContact O-N 3.21Å; T1036-S1039 PolarHBondContact O-OG 3.36Å
1037	L	92.5	Very high	89.5	Confident	3 Å²	3	70 Å²	70	2%	0.016	39%	0.389	C	S	.	.	H	α-helix	trans	-69.2	-37.1	174.6	-70.5	-177.2	0	0	0	112.6	F918 I922 L1013 L1029 E1033 R1034 Q1035 S1039 I1040 G1041 L1042	F918-L1037 HydrophobicContact CZ-CD1 4.17Å; I922-L1037 HydrophobicContact CD1-CD1 3.87Å; I922-L1037 HydrophobicContact CD1-CD2 4.17Å; I922-L1037 HydrophobicContact CD1-CG 4.03Å; I922-L1037 HydrophobicContact CG1-CD2 3.97Å; I922-L1037 HydrophobicContact CG1-CG 4.29Å; L1013-L1037 HydrophobicContact CB-CD2 4.4Å; L1013-L1037 HydrophobicContact CD1-CD2 4Å; L1013-L1037 HydrophobicContact CD2-CD2 4.33Å; L1013-L1037 HydrophobicContact CG-CD2 4.49Å; L1029-L1037 HydrophobicContact CD1-CD1 3.46Å; L1029-L1037 VanDerWaalsContact CD1-CD1 3.46Å; E1033-L1037 PolarHBondContact O-N 3.39Å; E1033-L1037 VanDerWaalsContact O-N 3.09Å; R1034-L1037 PolarHBondContact O-N 3.22Å; Q1035-L1037 VanDerWaalsContact C-N 3.33Å; Q1035-L1037 PolarHBondContact O-N 3.24Å; L1037-S1039 VanDerWaalsContact C-N 3.28Å; L1037-S1039 PolarHBondContact O-N 2.86Å; L1037-I1040 HydrophobicContact CD2-CD1 4.27Å; L1037-I1040 WeakPolarHBondContact O-CG1 3.48Å; L1037-I1040 PolarHBondContact O-N 3.02Å; L1037-G1041 PolarHBondContact O-N 2.84Å; L1037-L1042 HydrophobicContact CB-CB 4.13Å; L1037-L1042 HydrophobicContact CD2-CD1 4.22Å; L1037-L1042 WeakPolarHBondContact O-CB 3.48Å; L1037-L1042 PolarHBondContact O-N 2.81Å
1038	Q	90.9	Very high	89.3	Confident	130 Å²	130	66.9 Å²	66.9	61%	0.607	37%	0.373	S	S	*	.	H	α-helix	trans	-63.8	-33.6	176.4	-75.9	171.8	4.2	0	0	112.5	R1034 Q1035 I1040 G1041 L1042	R1034-Q1038 VanDerWaalsContact O-CG 3.29Å; R1034-Q1038 WeakPolarHBondContact O-CG 3.45Å; R1034-Q1038 PolarHBondContact O-N 2.85Å; Q1035-Q1038 PolarHBondContact O-N 3Å; Q1038-I1040 PolarHBondContact O-N 3.18Å; Q1038-G1041 PolarHBondContact O-N 3.5Å; Q1038-L1042 WeakPolarHBondContact CA-O 3.41Å; Q1038-L1042 WeakPolarHBondContact CG-O 3.45Å
1039	S	87.8	Confident	89.1	Confident	84 Å²	84	66.1 Å²	66.1	59%	0.587	37%	0.374	S	S	*	.	H	α-helix	trans	-65.1	-24.8	178.6	75.4	0	0	0	0	113	Q1035 T1036 L1037	Q1035-S1039 PolarHBondContact O-N 3.34Å; T1036-S1039 PolarHBondContact O-N 3.21Å; T1036-S1039 PolarHBondContact O-OG 3.36Å; L1037-S1039 VanDerWaalsContact C-N 3.28Å; L1037-S1039 PolarHBondContact O-N 2.86Å
1040	I	87.1	Confident	88.8	Confident	39 Å²	39	70.3 Å²	70.3	20%	0.2	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	7.7	172.3	64	164.8	0	0	0	113.6	L925 T1010 L1013 L1037 Q1038 L1042	L925-I1040 HydrophobicContact CD2-CD1 3.76Å; L925-I1040 HydrophobicContact CD2-CG1 4.39Å; L925-I1040 HydrophobicContact CD2-CG2 3.94Å; T1010-I1040 HydrophobicContact CG2-CB 4.12Å; T1010-I1040 HydrophobicContact CG2-CD1 4.37Å; T1010-I1040 HydrophobicContact CG2-CG2 4.15Å; L1013-I1040 HydrophobicContact CB-CD1 4.03Å; L1013-I1040 HydrophobicContact CD1-CD1 4.16Å; L1037-I1040 HydrophobicContact CD2-CD1 4.27Å; L1037-I1040 WeakPolarHBondContact O-CG1 3.48Å; L1037-I1040 PolarHBondContact O-N 3.02Å; Q1038-I1040 PolarHBondContact O-N 3.18Å; I1040-L1042 HydrophobicContact CD1-CD1 3.83Å; I1040-L1042 HydrophobicContact CG1-CD1 4.24Å; I1040-L1042 HydrophobicContact CG1-CG 4.43Å
1041	G	79.2	Confident	88.6	Confident	68 Å²	68	72 Å²	72	70%	0.701	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.1	22.2	173.1	0	0	0	0	0	116.4	L1037 Q1038	L1037-G1041 PolarHBondContact O-N 2.84Å; Q1038-G1041 PolarHBondContact O-N 3.5Å
1042	L	74.8	Confident	88.5	Confident	80 Å²	80	66.8 Å²	66.8	42%	0.419	38%	0.383	S	S	.	.			trans	-108.4	0	-179	-68.4	175.3	0	0	0	115.4	L1013 A1017 L1037 Q1038 I1040	L1013-L1042 HydrophobicContact CB-CD1 4.22Å; A1017-L1042 HydrophobicContact CB-CD1 4.03Å; A1017-L1042 HydrophobicContact CB-CD2 3.64Å; A1017-L1042 HydrophobicContact CB-CG 4.4Å; L1037-L1042 HydrophobicContact CB-CB 4.13Å; L1037-L1042 HydrophobicContact CD2-CD1 4.22Å; L1037-L1042 WeakPolarHBondContact O-CB 3.48Å; L1037-L1042 PolarHBondContact O-N 2.81Å; Q1038-L1042 WeakPolarHBondContact CA-O 3.41Å; Q1038-L1042 WeakPolarHBondContact CG-O 3.45Å; I1040-L1042 HydrophobicContact CD1-CD1 3.83Å; I1040-L1042 HydrophobicContact CG1-CD1 4.24Å; I1040-L1042 HydrophobicContact CG1-CG 4.43Å

Retrieved 1,042 of 1,042 residues in 338.2 ms (Link to these results)

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