A0A5K4F4L1_SCHMA Loading...

G_PROTEIN_RECEP_F1_2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F4L1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 411 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43	Very low	49.4	Very low	239 Å²	239	130 Å²	130	100%	1.177	74%	0.744	S	S	*	*				0	108.9	0	-84.6	172.7	157.9	0	0	106.5	S3	M1-S3 PolarHBondContact O-N 3.39Å
2	N	47.5	Very low	49.9	Very low	157 Å²	157	129.1 Å²	129.1	84%	0.84	73%	0.726	S	S	*	*			trans	-67.4	119	-162.2	-77.9	-12.9	0	0	0	111.6	S4	N2-S4 PolarHBondContact O-N 2.91Å
3	S	50.1	Low	50.1	Low	108 Å²	108	126.5 Å²	126.5	76%	0.755	71%	0.709	S	S	*	*			trans	-64.8	82.5	163.4	-63.3	0	0	0	0	109.5	M1 N5	M1-S3 PolarHBondContact O-N 3.39Å; S3-N5 PolarHBondContact O-N 3.42Å
4	S	54.7	Low	50.4	Low	92 Å²	92	121.1 Å²	121.1	64%	0.643	70%	0.696	S	S	*	*			trans	-70	76.5	155.7	42.3	0	0	0	0	108.2	N2 N6	N2-S4 PolarHBondContact O-N 2.91Å; S4-N6 PolarHBondContact O-N 3.31Å
5	N	56	Low	50.7	Low	154 Å²	154	119.6 Å²	119.6	82%	0.824	69%	0.69	S	S	*	*			trans	-71.8	50.5	160.9	-87.4	-7.1	0	0	0	109.4	S3 S7	S3-N5 PolarHBondContact O-N 3.42Å; N5-S7 PolarHBondContact O-N 2.85Å
6	N	49.9	Very low	51	Low	129 Å²	129	120.9 Å²	120.9	69%	0.69	68%	0.68	S	S	*	*			trans	-73.6	96.6	176	-81.3	-2	0	0	0	107.9	S4 L8	S4-N6 PolarHBondContact O-N 3.31Å; N6-L8 PolarHBondContact O-N 3.09Å
7	S	46.8	Very low	51.6	Low	92 Å²	92	118.2 Å²	118.2	64%	0.643	66%	0.66	S	S	*	*			trans	41.1	58.6	131.6	64.2	0	0	0	0	114.8	N5 T9	N5-S7 PolarHBondContact O-N 2.85Å; S7-T9 PolarHBondContact O-N 3.14Å; S7-T9 VanDerWaalsContact O-N 3.09Å
8	L	48	Very low	52.5	Low	164 Å²	164	117.7 Å²	117.7	86%	0.859	66%	0.656	S	S	*	*			trans	-79.9	44.2	157.1	-126.1	130.6	0	0	0	109	N6 S10	N6-L8 PolarHBondContact O-N 3.09Å; L8-S10 PolarHBondContact O-N 2.66Å
9	T	48.1	Very low	53.6	Low	109 Å²	109	118.1 Å²	118.1	67%	0.669	66%	0.657	S	S	*	*			trans	-73.4	74.1	150.5	46.7	0	0	0	0	105	S7 N11	S7-T9 PolarHBondContact O-N 3.14Å; S7-T9 VanDerWaalsContact O-N 3.09Å; T9-N11 PolarHBondContact O-N 2.87Å
10	S	52.6	Low	55	Low	56 Å²	56	112.5 Å²	112.5	39%	0.392	63%	0.625	S	S	.	*			trans	-51.7	113.6	160.7	53.6	0	0	0	0	105	L8 F12	L8-S10 PolarHBondContact O-N 2.66Å; S10-F12 PolarHBondContact O-N 3.5Å
11	N	47.2	Very low	56.3	Low	130 Å²	130	111.3 Å²	111.3	70%	0.695	62%	0.618	S	S	*	*			trans	-47.8	100.4	166.2	-82.5	-11.1	0	0	0	106.1	T9 D13	T9-N11 PolarHBondContact O-N 2.87Å; N11-D13 PolarHBondContact O-N 3Å
12	F	54.4	Low	58.5	Low	119 Å²	119	107.9 Å²	107.9	52%	0.522	60%	0.599	S	S	.	*			trans	-70.7	66.1	159.2	-115.2	-92.3	0	0	0	104.2	S10 G14 Y128 F133	S10-F12 PolarHBondContact O-N 3.5Å; F12-G14 PolarHBondContact O-N 2.77Å; F12-Y128 HydrophobicContact CD1-CE1 4.48Å; F12-Y128 AromaticContact CE1-CD1 3.97Å; F12-Y128 HydrophobicContact CE1-CD1 3.97Å; F12-Y128 HydrophobicContact CE1-CD2 4.04Å; F12-Y128 AromaticContact CE1-CE1 3.54Å; F12-Y128 HydrophobicContact CE1-CE1 3.54Å; F12-Y128 AromaticContact CE1-CE2 3.68Å; F12-Y128 HydrophobicContact CE1-CE2 3.68Å; F12-Y128 HydrophobicContact CE1-CG 4.21Å; F12-Y128 AromaticContact CE1-CZ 3.42Å; F12-Y128 VanDerWaalsContact CE1-CZ 3.42Å; F12-Y128 AromaticContact CZ-CD1 3.86Å; F12-Y128 HydrophobicContact CZ-CD1 3.86Å; F12-Y128 HydrophobicContact CZ-CD2 4.21Å; F12-Y128 AromaticContact CZ-CE1 3.9Å; F12-Y128 HydrophobicContact CZ-CE1 3.9Å; F12-Y128 HydrophobicContact CZ-CE2 4.31Å; F12-Y128 HydrophobicContact CZ-CG 4.03Å; F12-F133 HydrophobicContact CE2-CE1 4.12Å; F12-F133 HydrophobicContact CE2-CZ 4.49Å; F12-F133 HydrophobicContact CZ-CE1 4.01Å; F12-F133 AromaticContact CZ-CZ 3.99Å; F12-F133 HydrophobicContact CZ-CZ 3.99Å
13	D	52.5	Low	60.5	Low	96 Å²	96	102.8 Å²	102.8	51%	0.513	57%	0.568	S	S	.	*			trans	-62.2	106.9	175.6	-90.7	-25.6	0	0	0	105.1	N11 T15 R16	N11-D13 PolarHBondContact O-N 3Å; D13-T15 PolarHBondContact O-N 3.42Å; D13-R16 PolarHBondContact O-N 2.68Å
14	G	54.6	Low	62.4	Low	50 Å²	50	102.6 Å²	102.6	52%	0.515	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.4	-6.3	179.9	0	0	0	0	0	113.6	F12 H17	F12-G14 PolarHBondContact O-N 2.77Å; G14-H17 WeakPolarHBondContact O-CB 2.95Å; G14-H17 PolarHBondContact O-N 2.89Å
15	T	54.6	Low	64.2	Low	99 Å²	99	104.6 Å²	104.6	61%	0.607	56%	0.558	S	S	*	*	H	α-helix	trans	-61.6	-40.7	173.4	52.7	0	0	0	0	112.6	D13 H17 N18	D13-T15 PolarHBondContact O-N 3.42Å; T15-H17 PolarHBondContact O-N 2.96Å; T15-N18 PolarHBondContact O-N 2.96Å
16	R	56.6	Low	66.1	Low	141 Å²	141	100 Å²	100	53%	0.532	54%	0.537	S	S	.	.	H	α-helix	trans	-65.9	-25	175.9	-91.9	-168.4	176.4	-172.8	4.6	113.3	D13 N18 D19 C20 D327	D13-R16 PolarHBondContact O-N 2.68Å; R16-N18 PolarHBondContact O-N 3.09Å; R16-D19 PolarHBondContact O-N 2.96Å; R16-C20 PolarHBondContact O-SG 2.89Å; R16-D327 IonicContact CZ-OD2 3.87Å; R16-D327 IonicContact NH1-OD2 3.27Å; R16-D327 PolarHBondContact NH1-OD2 3.16Å
17	H	61.2	Low	68.2	Low	74 Å²	74	94 Å²	94	34%	0.343	51%	0.505	S	S	.	.	H	α-helix	trans	-68.8	-25.5	-177.6	-139.3	-32	0	0	0	112.3	G14 T15 Q127 Y128	G14-H17 WeakPolarHBondContact O-CB 2.95Å; G14-H17 PolarHBondContact O-N 2.89Å; T15-H17 PolarHBondContact O-N 2.96Å; H17-Q127 PolarHBondContact CE1-OE1 2.92Å; H17-Q127 VanDerWaalsContact CE1-OE1 3.32Å; H17-Y128 PolarHBondContact CD2-OH 2.81Å; H17-Y128 AromaticContact NE2-CE2 3.54Å; H17-Y128 AromaticContact NE2-CZ 3.8Å; H17-Y128 PolarHBondContact NE2-OH 3.23Å; H17-Y128 VanDerWaalsContact NE2-OH 3.16Å
18	N	66.3	Low	70.5	Confident	110 Å²	110	93.6 Å²	93.6	59%	0.588	50%	0.495	S	S	*	.	H	α-helix	trans	-74	-31	-177.6	-72.7	-15.8	0	0	0	113	T15 R16 C20	T15-N18 PolarHBondContact O-N 2.96Å; R16-N18 PolarHBondContact O-N 3.09Å; N18-C20 PolarHBondContact O-N 2.69Å
19	D	73.5	Confident	72.8	Confident	125 Å²	125	93 Å²	93	67%	0.668	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-17	-176.9	-66.5	-19.6	0	0	0	112.8	R16	R16-D19 PolarHBondContact O-N 2.96Å
20	C	81.4	Confident	75.1	Confident	5 Å²	5	88.3 Å²	88.3	3%	0.034	46%	0.457	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	4.1	-172.7	-36.1	0	0	0	0	112.9	R16 N18 E22 Y23 Q127 C329	R16-C20 PolarHBondContact O-SG 2.89Å; N18-C20 PolarHBondContact O-N 2.69Å; C20-E22 VanDerWaalsContact C-N 3.33Å; C20-E22 PolarHBondContact O-N 2.9Å; C20-Y23 PolarHBondContact O-N 2.9Å; C20-Q127 PolarHBondContact O-NE2 2.65Å; C20-C329 HydrophobicContact CB-CB 3.95Å; C20-C329 WeakPolarHBondContact CB-SG 3.5Å; C20-C329 WeakPolarHBondContact SG-CB 3.06Å; C20-C329 CovalentContact SG-SG 2.03Å; C20-C329 PolarHBondContact SG-SG 3.28Å
21	L	83.5	Confident	77.2	Confident	88 Å²	88	85.7 Å²	85.7	46%	0.461	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-60.4	-36.9	178.5	-93.7	151.2	0	0	0	112.8	Y23 E24	L21-Y23 PolarHBondContact O-N 3.32Å; L21-E24 WeakPolarHBondContact CD2-OE1 3.29Å; L21-E24 WeakPolarHBondContact O-CG 3.49Å; L21-E24 PolarHBondContact O-N 3.38Å
22	E	88.4	Confident	79.6	Confident	167 Å²	167	83.5 Å²	83.5	78%	0.78	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-61.3	-20.9	179.3	-64.6	-171	167.7	0	0	113	C20	C20-E22 VanDerWaalsContact C-N 3.33Å; C20-E22 PolarHBondContact O-N 2.9Å
23	Y	89.4	Confident	81.7	Confident	51 Å²	51	81.6 Å²	81.6	20%	0.2	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-101.1	4.6	-176.2	-60.2	-62.4	0	0	0	114	C20 L21 L25 P26 N27 C329 V331 I334	C20-Y23 PolarHBondContact O-N 2.9Å; L21-Y23 PolarHBondContact O-N 3.32Å; Y23-L25 PolarHBondContact O-N 3.16Å; Y23-P26 WeakPolarHBondContact O-CD 3.3Å; Y23-N27 WeakPolarHBondContact O-CB 3.16Å; Y23-N27 VanDerWaalsContact O-CG 3.3Å; Y23-N27 PolarHBondContact O-N 2.9Å; Y23-N27 VanDerWaalsContact O-N 3.12Å; Y23-N27 PolarHBondContact O-ND2 3.38Å; Y23-C329 WeakPolarHBondContact CE2-O 3.3Å; Y23-V331 HydrophobicContact CD1-CG2 4.43Å; Y23-V331 HydrophobicContact CE1-CG2 3.49Å; Y23-V331 VanDerWaalsContact CE1-CG2 3.49Å; Y23-I334 HydrophobicContact CD1-CD1 3.39Å; Y23-I334 HydrophobicContact CE1-CD1 4.3Å; Y23-I334 HydrophobicContact CG-CD1 3.74Å
24	E	90.1	Very high	83.8	Confident	103 Å²	103	77 Å²	77	48%	0.481	39%	0.393	S	S	.	.	H	α-helix	trans	-60	-44.6	-178.7	-76.4	-171.5	169	0	0	112.7	L21 N27 L28	L21-E24 WeakPolarHBondContact CD2-OE1 3.29Å; L21-E24 WeakPolarHBondContact O-CG 3.49Å; L21-E24 PolarHBondContact O-N 3.38Å; E24-N27 PolarHBondContact O-N 3Å; E24-L28 WeakPolarHBondContact O-CB 3.43Å; E24-L28 PolarHBondContact O-N 3.35Å
25	L	93.7	Very high	85.9	Confident	135 Å²	135	80.3 Å²	80.3	71%	0.707	39%	0.394	S	S	*	.	H	α-helix	trans	-68.3	-48.9	-176	-177.7	70.2	0	0	0	112.9	Y23 N27 L28 F29	Y23-L25 PolarHBondContact O-N 3.16Å; L25-N27 VanDerWaalsContact C-N 3.32Å; L25-N27 PolarHBondContact O-N 3.24Å; L25-L28 PolarHBondContact O-N 3.16Å; L25-F29 PolarHBondContact O-N 3.23Å; L25-F29 VanDerWaalsContact O-N 3.09Å
26	P	95.2	Very high	88	Confident	58 Å²	58	80.7 Å²	80.7	38%	0.377	39%	0.387	S	S	.	.	H	α-helix	trans	-60.1	-40.5	173.2	-24.1	33.7	0	0	0	113	Y23 F29 V30 I334	Y23-P26 WeakPolarHBondContact O-CD 3.3Å; P26-F29 PolarHBondContact O-N 2.97Å; P26-V30 WeakPolarHBondContact O-CG2 3.45Å; P26-V30 PolarHBondContact O-N 3.27Å; P26-I334 HydrophobicContact CB-CD1 4.14Å; P26-I334 HydrophobicContact CB-CG2 4.04Å
27	N	93.6	Very high	89.9	Confident	2 Å²	2	74.4 Å²	74.4	1%	0.011	36%	0.364	C	S	.	.	H	α-helix	trans	-62.5	-42.6	176.9	-85	-36.6	0	0	0	112.1	Y23 E24 L25 F29 V30 A31 A124	Y23-N27 WeakPolarHBondContact O-CB 3.16Å; Y23-N27 VanDerWaalsContact O-CG 3.3Å; Y23-N27 PolarHBondContact O-N 2.9Å; Y23-N27 VanDerWaalsContact O-N 3.12Å; Y23-N27 PolarHBondContact O-ND2 3.38Å; E24-N27 PolarHBondContact O-N 3Å; L25-N27 VanDerWaalsContact C-N 3.32Å; L25-N27 PolarHBondContact O-N 3.24Å; N27-F29 VanDerWaalsContact C-N 3.31Å; N27-F29 PolarHBondContact O-N 3.18Å; N27-V30 PolarHBondContact O-N 3.13Å; N27-A31 VanDerWaalsContact O-CB 3.3Å; N27-A31 WeakPolarHBondContact O-CB 3.5Å; N27-A31 PolarHBondContact O-N 3.12Å; N27-A124 WeakPolarHBondContact CB-O 3.31Å
28	L	95.3	Very high	91.6	Very high	83 Å²	83	71.8 Å²	71.8	44%	0.435	35%	0.352	S	S	.	.	H	α-helix	trans	-60.1	-41.7	174.7	-179.4	62.4	0	0	0	111.6	E24 L25 A31 I32 L125	E24-L28 WeakPolarHBondContact O-CB 3.43Å; E24-L28 PolarHBondContact O-N 3.35Å; L25-L28 PolarHBondContact O-N 3.16Å; L28-A31 PolarHBondContact O-N 3.29Å; L28-I32 HydrophobicContact CD1-CD1 4.08Å; L28-I32 HydrophobicContact CD1-CG1 4.29Å; L28-I32 HydrophobicContact CG-CD1 3.93Å; L28-I32 WeakPolarHBondContact O-CB 3.47Å; L28-I32 VanDerWaalsContact O-CG1 3.26Å; L28-I32 WeakPolarHBondContact O-CG1 3.48Å; L28-I32 PolarHBondContact O-N 3.38Å; L28-L125 HydrophobicContact CD1-CD2 4.26Å
29	F	97.1	Very high	93.1	Very high	152 Å²	152	70.4 Å²	70.4	67%	0.667	34%	0.344	S	S	*	.	H	α-helix	trans	-62.8	-47.4	176.2	-178	-96.4	0	0	0	112	L25 P26 N27 A31 I32 F33	L25-F29 PolarHBondContact O-N 3.23Å; L25-F29 VanDerWaalsContact O-N 3.09Å; P26-F29 PolarHBondContact O-N 2.97Å; N27-F29 VanDerWaalsContact C-N 3.31Å; N27-F29 PolarHBondContact O-N 3.18Å; F29-A31 VanDerWaalsContact C-N 3.3Å; F29-A31 PolarHBondContact O-N 3.44Å; F29-I32 PolarHBondContact O-N 2.98Å; F29-F33 WeakPolarHBondContact O-CB 3.48Å; F29-F33 PolarHBondContact O-N 3.17Å
30	V	96.2	Very high	94.2	Very high	10 Å²	10	70 Å²	70	6%	0.061	34%	0.337	C	S	.	.	H	α-helix	trans	-60.3	-41.1	176.9	172.4	0	0	0	0	110.9	P26 N27 F33 G34 A124 I334 N337 A338 I341	P26-V30 WeakPolarHBondContact O-CG2 3.45Å; P26-V30 PolarHBondContact O-N 3.27Å; N27-V30 PolarHBondContact O-N 3.13Å; V30-F33 PolarHBondContact O-N 2.75Å; V30-G34 PolarHBondContact O-N 3.31Å; V30-A124 HydrophobicContact CB-CB 4.46Å; V30-A124 HydrophobicContact CG1-CB 4.18Å; V30-I334 HydrophobicContact CG2-CG2 3.99Å; V30-N337 HydrophobicContact CG1-CB 4.23Å; V30-A338 HydrophobicContact CG1-CB 4.48Å; V30-A338 HydrophobicContact CG2-CB 4.01Å; V30-I341 HydrophobicContact CG1-CD1 3.53Å; V30-I341 WeakPolarHBondContact O-CD1 3.24Å
31	A	96.7	Very high	94.9	Very high	2 Å²	2	70 Å²	70	2%	0.017	34%	0.337	C	S	.	.	H	α-helix	trans	-64.4	-47.6	175.7	0	0	0	0	0	113.3	N27 L28 F29 F33 G34 F35 T121 A124 L125	N27-A31 VanDerWaalsContact O-CB 3.3Å; N27-A31 WeakPolarHBondContact O-CB 3.5Å; N27-A31 PolarHBondContact O-N 3.12Å; L28-A31 PolarHBondContact O-N 3.29Å; F29-A31 VanDerWaalsContact C-N 3.3Å; F29-A31 PolarHBondContact O-N 3.44Å; A31-F33 VanDerWaalsContact C-N 3.27Å; A31-F33 PolarHBondContact O-N 3.08Å; A31-G34 CarbonylContact O-C 3.6Å; A31-G34 WeakPolarHBondContact O-CA 3.39Å; A31-G34 PolarHBondContact O-N 3.12Å; A31-G34 VanDerWaalsContact O-N 3.14Å; A31-F35 PolarHBondContact O-N 3.27Å; A31-T121 WeakPolarHBondContact O-CG2 3.49Å; A31-A124 HydrophobicContact CB-CB 3.9Å; A31-L125 HydrophobicContact CB-CD1 4.4Å; A31-L125 HydrophobicContact CB-CD2 3.39Å; A31-L125 HydrophobicContact CB-CG 3.47Å; A31-L125 VanDerWaalsContact CB-CG 3.47Å
32	I	98	Very high	95.6	Very high	83 Å²	83	66.3 Å²	66.3	43%	0.426	32%	0.319	S	S	.	.	H	α-helix	trans	-59.1	-44	176.8	-71.3	167	0	0	0	109.7	L28 F29 G34 F35 F36	L28-I32 HydrophobicContact CD1-CD1 4.08Å; L28-I32 HydrophobicContact CD1-CG1 4.29Å; L28-I32 HydrophobicContact CG-CD1 3.93Å; L28-I32 WeakPolarHBondContact O-CB 3.47Å; L28-I32 VanDerWaalsContact O-CG1 3.26Å; L28-I32 WeakPolarHBondContact O-CG1 3.48Å; L28-I32 PolarHBondContact O-N 3.38Å; F29-I32 PolarHBondContact O-N 2.98Å; I32-G34 VanDerWaalsContact C-N 3.34Å; I32-G34 PolarHBondContact O-N 2.88Å; I32-F35 PolarHBondContact O-N 3.49Å; I32-F36 HydrophobicContact CG2-CD2 3.73Å; I32-F36 HydrophobicContact CG2-CE2 3.57Å; I32-F36 VanDerWaalsContact O-CD2 3.23Å; I32-F36 WeakPolarHBondContact O-CD2 3.49Å; I32-F36 PolarHBondContact O-N 2.63Å
33	F	97.8	Very high	95.9	Very high	79 Å²	79	60.2 Å²	60.2	35%	0.346	30%	0.297	S	S	.	.	H	α-helix	trans	-62.6	-40.4	175.8	-176.7	-120.2	0	0	0	112.5	F29 V30 A31 T37 I341 T345	F29-F33 WeakPolarHBondContact O-CB 3.48Å; F29-F33 PolarHBondContact O-N 3.17Å; V30-F33 PolarHBondContact O-N 2.75Å; A31-F33 VanDerWaalsContact C-N 3.27Å; A31-F33 PolarHBondContact O-N 3.08Å; F33-T37 VanDerWaalsContact O-CB 3.28Å; F33-T37 WeakPolarHBondContact O-CB 3.47Å; F33-T37 PolarHBondContact O-N 3.29Å; F33-T37 PolarHBondContact O-OG1 3.04Å; F33-I341 HydrophobicContact CD1-CB 4.41Å; F33-I341 HydrophobicContact CD1-CG2 3.43Å; F33-I341 VanDerWaalsContact CD1-CG2 3.43Å; F33-I341 HydrophobicContact CE1-CG2 3.71Å; F33-I341 HydrophobicContact CG-CG2 4.34Å; F33-T345 HydrophobicContact CE2-CG2 4.39Å; F33-T345 HydrophobicContact CZ-CG2 3.93Å; F33-T345 VanDerWaalsContact CZ-OG1 3.32Å; F33-T345 WeakPolarHBondContact CZ-OG1 3.43Å
34	G	97.4	Very high	96.2	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.3	-45	172.5	0	0	0	0	0	113.1	V30 A31 I32 T37 I38 T121	V30-G34 PolarHBondContact O-N 3.31Å; A31-G34 CarbonylContact O-C 3.6Å; A31-G34 WeakPolarHBondContact O-CA 3.39Å; A31-G34 PolarHBondContact O-N 3.12Å; A31-G34 VanDerWaalsContact O-N 3.14Å; I32-G34 VanDerWaalsContact C-N 3.34Å; I32-G34 PolarHBondContact O-N 2.88Å; G34-T37 WeakPolarHBondContact O-CB 3.36Å; G34-T37 PolarHBondContact O-N 2.96Å; G34-I38 VanDerWaalsContact O-CG1 3.3Å; G34-I38 WeakPolarHBondContact O-CG1 3.47Å; G34-I38 PolarHBondContact O-N 2.97Å; G34-T121 WeakPolarHBondContact CA-OG1 3.48Å
35	F	97.9	Very high	96.5	Very high	120 Å²	120	53 Å²	53	53%	0.526	27%	0.265	S	S	.	.	H	α-helix	trans	-62.2	-47.9	177.5	-178.2	-102.7	0	0	0	112.2	A31 I32 T37 I38 I39 T121	A31-F35 PolarHBondContact O-N 3.27Å; I32-F35 PolarHBondContact O-N 3.49Å; F35-T37 VanDerWaalsContact C-N 3.29Å; F35-T37 PolarHBondContact O-N 3.12Å; F35-I38 PolarHBondContact O-N 3.21Å; F35-I39 HydrophobicContact CD1-CD1 3.9Å; F35-I39 HydrophobicContact CE1-CD1 3.28Å; F35-I39 HydrophobicContact CE1-CG1 4.39Å; F35-I39 HydrophobicContact CE2-CD1 4.1Å; F35-I39 HydrophobicContact CZ-CD1 3.42Å; F35-I39 VanDerWaalsContact CZ-CD1 3.42Å; F35-I39 HydrophobicContact CZ-CG1 4.37Å; F35-I39 PolarHBondContact O-N 3.45Å; F35-T121 HydrophobicContact CB-CG2 4.38Å
36	F	98	Very high	96.6	Very high	107 Å²	107	49.9 Å²	49.9	47%	0.469	25%	0.249	S	C	.	.	H	α-helix	trans	-59.6	-43.1	173.6	-82	-62.2	0	0	0	111.7	I32 I38 I39 F40	I32-F36 HydrophobicContact CG2-CD2 3.73Å; I32-F36 HydrophobicContact CG2-CE2 3.57Å; I32-F36 VanDerWaalsContact O-CD2 3.23Å; I32-F36 WeakPolarHBondContact O-CD2 3.49Å; I32-F36 PolarHBondContact O-N 2.63Å; F36-I38 PolarHBondContact O-N 3.47Å; F36-I39 PolarHBondContact O-N 2.87Å; F36-F40 HydrophobicContact CB-CD2 4.33Å; F36-F40 HydrophobicContact CD1-CD2 4.11Å; F36-F40 AromaticContact CD1-CE2 3.65Å; F36-F40 HydrophobicContact CD1-CE2 3.65Å; F36-F40 HydrophobicContact CE1-CE2 4.29Å; F36-F40 WeakPolarHBondContact O-CB 3.47Å; F36-F40 VanDerWaalsContact O-CD2 3.31Å; F36-F40 WeakPolarHBondContact O-CD2 3.36Å; F36-F40 PolarHBondContact O-N 3.04Å
37	T	96.8	Very high	96.6	Very high	8 Å²	8	50.5 Å²	50.5	5%	0.049	25%	0.249	C	C	.	.	H	α-helix	trans	-57	-49.6	176.4	-68.5	0	0	0	0	110.4	F33 G34 F35 I39 G41 Q113 W344 T345	F33-T37 VanDerWaalsContact O-CB 3.28Å; F33-T37 WeakPolarHBondContact O-CB 3.47Å; F33-T37 PolarHBondContact O-N 3.29Å; F33-T37 PolarHBondContact O-OG1 3.04Å; G34-T37 WeakPolarHBondContact O-CB 3.36Å; G34-T37 PolarHBondContact O-N 2.96Å; F35-T37 VanDerWaalsContact C-N 3.29Å; F35-T37 PolarHBondContact O-N 3.12Å; T37-I39 PolarHBondContact O-N 3.43Å; T37-G41 WeakPolarHBondContact O-CA 3.41Å; T37-G41 PolarHBondContact O-N 2.76Å; T37-Q113 VanDerWaalsContact C-NE2 3.25Å; T37-Q113 VanDerWaalsContact CG2-NE2 3.31Å; T37-Q113 PolarHBondContact O-NE2 2.93Å; T37-W344 HydrophobicContact CG2-CB 4.2Å; T37-T345 WeakPolarHBondContact CG2-OG1 3.41Å; T37-T345 PolarHBondContact OG1-OG1 2.99Å
38	I	97.6	Very high	96.6	Very high	19 Å²	19	50.6 Å²	50.6	10%	0.097	25%	0.249	C	C	.	.	H	α-helix	trans	-57.8	-49.6	178.2	-67.5	160.5	0	0	0	111.3	G34 F35 F36 S42 C117 L118 T121	G34-I38 VanDerWaalsContact O-CG1 3.3Å; G34-I38 WeakPolarHBondContact O-CG1 3.47Å; G34-I38 PolarHBondContact O-N 2.97Å; F35-I38 PolarHBondContact O-N 3.21Å; F36-I38 PolarHBondContact O-N 3.47Å; I38-S42 WeakPolarHBondContact O-CB 3.46Å; I38-S42 PolarHBondContact O-N 2.71Å; I38-S42 PolarHBondContact O-OG 3.3Å; I38-C117 HydrophobicContact CD1-CB 4.46Å; I38-C117 HydrophobicContact CG1-CB 3.91Å; I38-L118 HydrophobicContact CD1-CB 4.1Å; I38-L118 HydrophobicContact CD1-CD1 4.04Å; I38-T121 HydrophobicContact CD1-CG2 4.46Å
39	I	97.5	Very high	96.6	Very high	82 Å²	82	50.7 Å²	50.7	42%	0.421	24%	0.244	S	C	.	.	H	α-helix	trans	-63.3	-54.9	-178	-69.2	178.8	0	0	0	111	F35 F36 T37 A43	F35-I39 HydrophobicContact CD1-CD1 3.9Å; F35-I39 HydrophobicContact CE1-CD1 3.28Å; F35-I39 HydrophobicContact CE1-CG1 4.39Å; F35-I39 HydrophobicContact CE2-CD1 4.1Å; F35-I39 HydrophobicContact CZ-CD1 3.42Å; F35-I39 VanDerWaalsContact CZ-CD1 3.42Å; F35-I39 HydrophobicContact CZ-CG1 4.37Å; F35-I39 PolarHBondContact O-N 3.45Å; F36-I39 PolarHBondContact O-N 2.87Å; T37-I39 PolarHBondContact O-N 3.43Å; I39-A43 VanDerWaalsContact O-CB 3.31Å; I39-A43 WeakPolarHBondContact O-CB 3.3Å; I39-A43 PolarHBondContact O-N 2.96Å
40	F	96.6	Very high	96.4	Very high	117 Å²	117	46.5 Å²	46.5	51%	0.513	23%	0.228	S	C	.	.	H	α-helix	trans	-69.4	-47.2	-175.8	-76	-69.9	0	0	0	111.2	F36 S42 A43 G44 Y352	F36-F40 HydrophobicContact CB-CD2 4.33Å; F36-F40 HydrophobicContact CD1-CD2 4.11Å; F36-F40 AromaticContact CD1-CE2 3.65Å; F36-F40 HydrophobicContact CD1-CE2 3.65Å; F36-F40 HydrophobicContact CE1-CE2 4.29Å; F36-F40 WeakPolarHBondContact O-CB 3.47Å; F36-F40 VanDerWaalsContact O-CD2 3.31Å; F36-F40 WeakPolarHBondContact O-CD2 3.36Å; F36-F40 PolarHBondContact O-N 3.04Å; F40-S42 VanDerWaalsContact C-N 3.34Å; F40-S42 PolarHBondContact O-N 2.68Å; F40-A43 PolarHBondContact O-N 2.83Å; F40-G44 PolarHBondContact O-N 2.72Å; F40-Y352 HydrophobicContact CB-CE2 4.44Å; F40-Y352 VanDerWaalsContact O-CE2 3.31Å; F40-Y352 WeakPolarHBondContact O-CE2 3.35Å; F40-Y352 PolarHBondContact O-OH 3.4Å
41	G	95.9	Very high	96.2	Very high	4 Å²	4	46.9 Å²	46.9	4%	0.041	23%	0.229	C	C	.	.	H	α-helix	trans	-63.1	-38.8	178.3	0	0	0	0	0	113	T37 G44 S45 Q113	T37-G41 WeakPolarHBondContact O-CA 3.41Å; T37-G41 PolarHBondContact O-N 2.76Å; G41-G44 PolarHBondContact O-N 3.37Å; G41-S45 WeakPolarHBondContact O-CB 3.06Å; G41-S45 PolarHBondContact O-N 3.45Å; G41-S45 PolarHBondContact O-OG 3.42Å; G41-Q113 PolarHBondContact O-OE1 3.04Å
42	S	97.2	Very high	95.9	Very high	11 Å²	11	47 Å²	47	8%	0.077	23%	0.229	C	C	.	.	H	α-helix	trans	-64.8	-42.2	173.8	-64.5	0	0	0	0	111.6	I38 F40 S45 I46 Q113 N114	I38-S42 WeakPolarHBondContact O-CB 3.46Å; I38-S42 PolarHBondContact O-N 2.71Å; I38-S42 PolarHBondContact O-OG 3.3Å; F40-S42 VanDerWaalsContact C-N 3.34Å; F40-S42 PolarHBondContact O-N 2.68Å; S42-S45 WeakPolarHBondContact CA-OG 3.05Å; S42-S45 PolarHBondContact O-OG 2.91Å; S42-I46 VanDerWaalsContact O-CB 3.29Å; S42-I46 WeakPolarHBondContact O-CB 3.4Å; S42-I46 WeakPolarHBondContact O-CG1 3.42Å; S42-I46 PolarHBondContact O-N 3.35Å; S42-Q113 VanDerWaalsContact N-OE1 3.14Å; S42-N114 PolarHBondContact OG-ND2 2.87Å; S42-N114 VanDerWaalsContact OG-ND2 3.11Å
43	A	96.1	Very high	95.5	Very high	39 Å²	39	48.8 Å²	48.8	32%	0.322	23%	0.234	S	C	.	.	H	α-helix	trans	-60.9	-48.2	176.1	0	0	0	0	0	111.3	I39 F40 L47	I39-A43 VanDerWaalsContact O-CB 3.31Å; I39-A43 WeakPolarHBondContact O-CB 3.3Å; I39-A43 PolarHBondContact O-N 2.96Å; F40-A43 PolarHBondContact O-N 2.83Å; A43-L47 WeakPolarHBondContact O-CB 3.33Å; A43-L47 WeakPolarHBondContact O-CD1 3.3Å; A43-L47 WeakPolarHBondContact O-CG 3.22Å; A43-L47 PolarHBondContact O-N 2.93Å
44	G	95.2	Very high	94.9	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.8	-43.2	179.4	0	0	0	0	0	113.7	F40 G41 T48	F40-G44 PolarHBondContact O-N 2.72Å; G41-G44 PolarHBondContact O-N 3.37Å; G44-T48 WeakPolarHBondContact O-CB 3.44Å; G44-T48 PolarHBondContact O-N 3.43Å; G44-T48 PolarHBondContact O-OG1 2.87Å
45	S	96.5	Very high	94.1	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.007	25%	0.247	C	C	.	.	H	α-helix	trans	-68.2	-48	178	52.9	0	0	0	0	112.3	G41 S42 L47 T48 Y49	G41-S45 WeakPolarHBondContact O-CB 3.06Å; G41-S45 PolarHBondContact O-N 3.45Å; G41-S45 PolarHBondContact O-OG 3.42Å; S42-S45 WeakPolarHBondContact CA-OG 3.05Å; S42-S45 PolarHBondContact O-OG 2.91Å; S45-L47 PolarHBondContact O-N 2.92Å; S45-T48 PolarHBondContact O-N 3.24Å; S45-Y49 WeakPolarHBondContact O-CB 3.37Å; S45-Y49 PolarHBondContact O-N 3.46Å
46	I	96.2	Very high	93.1	Very high	70 Å²	70	49.4 Å²	49.4	36%	0.359	24%	0.236	S	C	.	.	H	α-helix	trans	-59.8	-46.9	175.7	-70.3	169.5	0	0	0	110.9	S42 T48 Y49 I50 F110	S42-I46 VanDerWaalsContact O-CB 3.29Å; S42-I46 WeakPolarHBondContact O-CB 3.4Å; S42-I46 WeakPolarHBondContact O-CG1 3.42Å; S42-I46 PolarHBondContact O-N 3.35Å; I46-T48 VanDerWaalsContact C-N 3.32Å; I46-T48 PolarHBondContact O-N 3.47Å; I46-Y49 WeakPolarHBondContact O-CB 3.39Å; I46-Y49 PolarHBondContact O-N 3.28Å; I46-I50 HydrophobicContact CG2-CD1 3.58Å; I46-I50 HydrophobicContact CG2-CG1 4.18Å; I46-I50 WeakPolarHBondContact O-CB 3.35Å; I46-I50 WeakPolarHBondContact O-CG1 3.43Å; I46-I50 PolarHBondContact O-N 3.43Å; I46-F110 HydrophobicContact CD1-CD2 4.01Å; I46-F110 HydrophobicContact CD1-CE2 3.48Å; I46-F110 VanDerWaalsContact CD1-CE2 3.48Å; I46-F110 HydrophobicContact CD1-CZ 4.05Å; I46-F110 HydrophobicContact CG1-CD2 3.78Å; I46-F110 HydrophobicContact CG1-CE2 3.77Å; I46-F110 HydrophobicContact CG1-CG 4.42Å; I46-F110 HydrophobicContact CG1-CZ 4.39Å
47	L	94.5	Very high	92	Very high	72 Å²	72	53.6 Å²	53.6	38%	0.377	25%	0.249	S	C	.	.	H	α-helix	trans	-59.1	-44.2	179.1	-83.2	176.7	0	0	0	111.5	A43 S45 Y51 I355 M365	A43-L47 WeakPolarHBondContact O-CB 3.33Å; A43-L47 WeakPolarHBondContact O-CD1 3.3Å; A43-L47 WeakPolarHBondContact O-CG 3.22Å; A43-L47 PolarHBondContact O-N 2.93Å; S45-L47 PolarHBondContact O-N 2.92Å; L47-Y51 VanDerWaalsContact O-CB 3.27Å; L47-Y51 WeakPolarHBondContact O-CB 3.49Å; L47-Y51 PolarHBondContact O-N 3.13Å; L47-I355 HydrophobicContact CB-CD1 4.31Å; L47-M365 HydrophobicContact CB-CE 3.47Å; L47-M365 VanDerWaalsContact CB-CE 3.47Å; L47-M365 HydrophobicContact CD1-CE 4.34Å; L47-M365 HydrophobicContact CD2-CE 3.76Å; L47-M365 HydrophobicContact CG-CE 4.04Å
48	T	93.9	Very high	90.4	Very high	3 Å²	3	56.4 Å²	56.4	2%	0.018	27%	0.269	C	S	.	.	H	α-helix	trans	-65.3	-41.9	175.8	-58.4	0	0	0	0	111.7	G44 S45 I46 Y51 L52 F351 Y354	G44-T48 WeakPolarHBondContact O-CB 3.44Å; G44-T48 PolarHBondContact O-N 3.43Å; G44-T48 PolarHBondContact O-OG1 2.87Å; S45-T48 PolarHBondContact O-N 3.24Å; I46-T48 VanDerWaalsContact C-N 3.32Å; I46-T48 PolarHBondContact O-N 3.47Å; T48-Y51 WeakPolarHBondContact O-CB 3.25Å; T48-Y51 PolarHBondContact O-N 3.35Å; T48-L52 HydrophobicContact CG2-CD1 3.93Å; T48-L52 HydrophobicContact CG2-CG 4.41Å; T48-L52 VanDerWaalsContact O-CG 3.28Å; T48-L52 WeakPolarHBondContact O-CG 3.24Å; T48-L52 PolarHBondContact O-N 3.42Å; T48-F351 HydrophobicContact CG2-CD1 3.96Å; T48-Y354 HydrophobicContact CG2-CD1 3.96Å; T48-Y354 HydrophobicContact CG2-CE1 4.22Å
49	Y	95.3	Very high	88.6	Confident	85 Å²	85	57.7 Å²	57.7	33%	0.333	28%	0.28	S	S	.	.	H	α-helix	trans	-62	-49.3	177.6	-178.2	-95.9	0	0	0	112	S45 I46 Y51 L52 F53 A103 L107	S45-Y49 WeakPolarHBondContact O-CB 3.37Å; S45-Y49 PolarHBondContact O-N 3.46Å; I46-Y49 WeakPolarHBondContact O-CB 3.39Å; I46-Y49 PolarHBondContact O-N 3.28Å; Y49-Y51 VanDerWaalsContact C-N 3.34Å; Y49-Y51 PolarHBondContact O-N 3.17Å; Y49-L52 PolarHBondContact O-N 3.11Å; Y49-F53 WeakPolarHBondContact O-CB 3.37Å; Y49-F53 PolarHBondContact O-N 3.32Å; Y49-A103 HydrophobicContact CD2-CB 4.2Å; Y49-A103 WeakPolarHBondContact CD2-O 3.01Å; Y49-A103 HydrophobicContact CE2-CB 4.33Å; Y49-L107 HydrophobicContact CD2-CB 4.25Å; Y49-L107 HydrophobicContact CE2-CB 4.21Å
50	I	92.9	Very high	86.9	Confident	65 Å²	65	61.4 Å²	61.4	33%	0.333	29%	0.293	S	S	.	.	H	α-helix	trans	-60.2	-45.5	176.9	-68.6	171.9	0	0	0	110.4	I46 L52 F53 M54	I46-I50 HydrophobicContact CG2-CD1 3.58Å; I46-I50 HydrophobicContact CG2-CG1 4.18Å; I46-I50 WeakPolarHBondContact O-CB 3.35Å; I46-I50 WeakPolarHBondContact O-CG1 3.43Å; I46-I50 PolarHBondContact O-N 3.43Å; I50-L52 PolarHBondContact O-N 3.09Å; I50-F53 PolarHBondContact O-N 3.36Å; I50-M54 HydrophobicContact CG2-CG 4.11Å; I50-M54 HydrophobicContact CG2-SD 3.75Å; I50-M54 WeakPolarHBondContact O-CB 3.46Å; I50-M54 WeakPolarHBondContact O-CG 3.41Å; I50-M54 PolarHBondContact O-N 2.88Å
51	Y	91.6	Very high	84.7	Confident	17 Å²	17	60.1 Å²	60.1	7%	0.067	30%	0.299	C	S	.	.	H	α-helix	trans	-53.6	-55.8	176.1	173.7	-105.1	0	0	0	111.2	L47 T48 Y49 F53 M54 F55 Y354 V361 D364 M365 I368	L47-Y51 VanDerWaalsContact O-CB 3.27Å; L47-Y51 WeakPolarHBondContact O-CB 3.49Å; L47-Y51 PolarHBondContact O-N 3.13Å; T48-Y51 WeakPolarHBondContact O-CB 3.25Å; T48-Y51 PolarHBondContact O-N 3.35Å; Y49-Y51 VanDerWaalsContact C-N 3.34Å; Y49-Y51 PolarHBondContact O-N 3.17Å; Y51-F53 VanDerWaalsContact C-N 3.29Å; Y51-F53 PolarHBondContact O-N 3.46Å; Y51-M54 PolarHBondContact O-N 2.72Å; Y51-F55 AromaticContact CD2-CD2 3.57Å; Y51-F55 HydrophobicContact CD2-CD2 3.57Å; Y51-F55 AromaticContact CD2-CE2 3.56Å; Y51-F55 HydrophobicContact CD2-CE2 3.56Å; Y51-F55 AromaticContact CE2-CD2 3.32Å; Y51-F55 HydrophobicContact CE2-CD2 3.32Å; Y51-F55 AromaticContact CE2-CE2 3.17Å; Y51-F55 HydrophobicContact CE2-CE2 3.17Å; Y51-F55 HydrophobicContact CE2-CG 4.24Å; Y51-F55 AromaticContact CE2-CZ 3.97Å; Y51-F55 HydrophobicContact CE2-CZ 3.97Å; Y51-F55 HydrophobicContact CG-CD2 4.33Å; Y51-F55 AromaticContact CZ-CD2 3.92Å; Y51-F55 VanDerWaalsContact O-CD2 3.31Å; Y51-F55 WeakPolarHBondContact O-CD2 3.37Å; Y51-F55 PolarHBondContact O-N 2.77Å; Y51-F55 VanDerWaalsContact O-N 3.13Å; Y51-Y354 HydrophobicContact CD1-CE1 4.25Å; Y51-Y354 HydrophobicContact CE1-CE1 4.23Å; Y51-V361 HydrophobicContact CD1-CG1 4.25Å; Y51-V361 HydrophobicContact CD2-CG1 4.47Å; Y51-V361 HydrophobicContact CE1-CB 4.43Å; Y51-V361 HydrophobicContact CE1-CG1 4.04Å; Y51-V361 HydrophobicContact CE1-CG2 3.79Å; Y51-V361 HydrophobicContact CE2-CG1 4.28Å; Y51-V361 HydrophobicContact CG-CG1 4.47Å; Y51-D364 HydrophobicContact CD2-CB 4.2Å; Y51-D364 HydrophobicContact CE2-CB 3.44Å; Y51-D364 VanDerWaalsContact CE2-CB 3.44Å; Y51-D364 WeakPolarHBondContact CE2-OD2 3.28Å; Y51-D364 PolarHBondContact OH-OD2 3.49Å; Y51-M365 HydrophobicContact CD2-CG 4.31Å; Y51-M365 HydrophobicContact CD2-SD 3.78Å; Y51-M365 HydrophobicContact CG-SD 3.98Å; Y51-I368 HydrophobicContact CD2-CD1 4Å
52	L	91.4	Very high	82.5	Confident	5 Å²	5	63.8 Å²	63.8	3%	0.026	32%	0.32	C	S	.	.	H	α-helix	trans	-62.8	-36.8	-177.8	-66.7	171.5	0	0	0	112.1	T48 Y49 I50 R56 Q99 M102 A103	T48-L52 HydrophobicContact CG2-CD1 3.93Å; T48-L52 HydrophobicContact CG2-CG 4.41Å; T48-L52 VanDerWaalsContact O-CG 3.28Å; T48-L52 WeakPolarHBondContact O-CG 3.24Å; T48-L52 PolarHBondContact O-N 3.42Å; Y49-L52 PolarHBondContact O-N 3.11Å; I50-L52 PolarHBondContact O-N 3.09Å; L52-R56 WeakPolarHBondContact O-CB 3.35Å; L52-R56 PolarHBondContact O-N 2.9Å; L52-Q99 HydrophobicContact CD2-CB 4.41Å; L52-Q99 HydrophobicContact CD2-CG 4.27Å; L52-M102 HydrophobicContact CD1-CB 3.54Å; L52-M102 HydrophobicContact CD1-CE 4.29Å; L52-M102 HydrophobicContact CD2-CE 3.81Å; L52-A103 HydrophobicContact CB-CB 4.32Å; L52-A103 HydrophobicContact CD1-CB 4.14Å
53	F	88.6	Confident	79.9	Confident	121 Å²	121	67.9 Å²	67.9	53%	0.531	35%	0.348	S	S	.	.	H	α-helix	trans	-70.3	-45.1	178.7	-169.2	-95.7	0	0	0	113	Y49 I50 Y51 F55 R56 R57	Y49-F53 WeakPolarHBondContact O-CB 3.37Å; Y49-F53 PolarHBondContact O-N 3.32Å; I50-F53 PolarHBondContact O-N 3.36Å; Y51-F53 VanDerWaalsContact C-N 3.29Å; Y51-F53 PolarHBondContact O-N 3.46Å; F53-F55 PolarHBondContact O-N 2.77Å; F53-R56 PolarHBondContact O-N 3.46Å; F53-R57 PolarHBondContact O-N 2.71Å
54	M	86.6	Confident	77.5	Confident	81 Å²	81	71 Å²	71	40%	0.399	36%	0.363	S	S	.	.	H	α-helix	trans	-62.6	-42.7	179.1	-74.7	-174.4	65.7	0	0	111.7	I50 Y51 R56 R57 S58 I368	I50-M54 HydrophobicContact CG2-CG 4.11Å; I50-M54 HydrophobicContact CG2-SD 3.75Å; I50-M54 WeakPolarHBondContact O-CB 3.46Å; I50-M54 WeakPolarHBondContact O-CG 3.41Å; I50-M54 PolarHBondContact O-N 2.88Å; Y51-M54 PolarHBondContact O-N 2.72Å; M54-R56 VanDerWaalsContact C-N 3.34Å; M54-R56 PolarHBondContact O-N 3.45Å; M54-R57 PolarHBondContact O-N 2.94Å; M54-S58 PolarHBondContact O-N 2.95Å; M54-I368 HydrophobicContact CE-CG1 4.1Å; M54-I368 HydrophobicContact SD-CD1 4.06Å; M54-I368 HydrophobicContact SD-CG1 4.04Å; M54-I368 HydrophobicContact SD-CG2 4.12Å
55	F	79	Confident	75.1	Confident	49 Å²	49	76.2 Å²	76.2	22%	0.215	40%	0.396	C	S	.	.	H	α-helix	trans	-69.6	-30.8	179.4	-86.6	-86.1	0	0	0	113.3	Y51 F53 R57 S59 D364 I368	Y51-F55 AromaticContact CD2-CD2 3.57Å; Y51-F55 HydrophobicContact CD2-CD2 3.57Å; Y51-F55 AromaticContact CD2-CE2 3.56Å; Y51-F55 HydrophobicContact CD2-CE2 3.56Å; Y51-F55 AromaticContact CE2-CD2 3.32Å; Y51-F55 HydrophobicContact CE2-CD2 3.32Å; Y51-F55 AromaticContact CE2-CE2 3.17Å; Y51-F55 HydrophobicContact CE2-CE2 3.17Å; Y51-F55 HydrophobicContact CE2-CG 4.24Å; Y51-F55 AromaticContact CE2-CZ 3.97Å; Y51-F55 HydrophobicContact CE2-CZ 3.97Å; Y51-F55 HydrophobicContact CG-CD2 4.33Å; Y51-F55 AromaticContact CZ-CD2 3.92Å; Y51-F55 VanDerWaalsContact O-CD2 3.31Å; Y51-F55 WeakPolarHBondContact O-CD2 3.37Å; Y51-F55 PolarHBondContact O-N 2.77Å; Y51-F55 VanDerWaalsContact O-N 3.13Å; F53-F55 PolarHBondContact O-N 2.77Å; F55-R57 VanDerWaalsContact C-N 3.32Å; F55-R57 PolarHBondContact O-N 2.91Å; F55-S59 PolarHBondContact O-N 3.4Å; F55-S59 PolarHBondContact O-OG 3.17Å; F55-S59 VanDerWaalsContact O-OG 3.1Å; F55-D364 HydrophobicContact CE2-CB 3.64Å; F55-D364 HydrophobicContact CZ-CB 3.48Å; F55-D364 VanDerWaalsContact CZ-CB 3.48Å; F55-D364 VanDerWaalsContact CZ-OD2 3.27Å; F55-D364 WeakPolarHBondContact CZ-OD2 2.91Å; F55-I368 HydrophobicContact CE2-CD1 4.26Å
56	R	78.2	Confident	72.9	Confident	81 Å²	81	82.1 Å²	82.1	31%	0.306	43%	0.432	S	S	.	.	H	α-helix	trans	-62.5	-39.9	172.5	-172.8	173.5	179.6	165.2	-3.2	112	L52 F53 M54	L52-R56 WeakPolarHBondContact O-CB 3.35Å; L52-R56 PolarHBondContact O-N 2.9Å; F53-R56 PolarHBondContact O-N 3.46Å; M54-R56 VanDerWaalsContact C-N 3.34Å; M54-R56 PolarHBondContact O-N 3.45Å
57	R	73.5	Confident	70.4	Confident	195 Å²	195	83.6 Å²	83.6	74%	0.736	44%	0.444	S	S	*	.	H	α-helix	trans	-71	-41.7	-179.6	-166.5	174.3	-179.7	167.2	0.3	112.4	F53 M54 F55 S59 K60	F53-R57 PolarHBondContact O-N 2.71Å; M54-R57 PolarHBondContact O-N 2.94Å; F55-R57 VanDerWaalsContact C-N 3.32Å; F55-R57 PolarHBondContact O-N 2.91Å; R57-S59 PolarHBondContact O-N 3.17Å; R57-K60 PolarHBondContact O-N 2.93Å; R57-K60 VanDerWaalsContact O-N 3.09Å
58	S	63.4	Low	68.2	Low	67 Å²	67	84 Å²	84	47%	0.469	46%	0.457	S	S	.	.	H	α-helix	trans	-59.6	-32.5	178.8	-179.9	0	0	0	0	112.7	M54 K60 S61	M54-S58 PolarHBondContact O-N 2.95Å; S58-K60 PolarHBondContact O-N 3.14Å; S58-S61 PolarHBondContact O-N 3.34Å; S58-S61 PolarHBondContact O-OG 3.14Å
59	S	61.5	Low	66	Low	47 Å²	47	89.4 Å²	89.4	33%	0.329	49%	0.491	S	S	.	.	H	α-helix	trans	-63.9	-23.3	178.1	-59.3	0	0	0	0	113.9	F55 R57 N93	F55-S59 PolarHBondContact O-N 3.4Å; F55-S59 PolarHBondContact O-OG 3.17Å; F55-S59 VanDerWaalsContact O-OG 3.1Å; R57-S59 PolarHBondContact O-N 3.17Å; S59-N93 PolarHBondContact OG-ND2 2.69Å
60	K	60.1	Low	63.6	Low	159 Å²	159	95.9 Å²	95.9	69%	0.691	52%	0.515	S	S	*	.	H	α-helix	trans	-89.1	-27.1	-179.5	-68.9	-173.1	176.2	-174.3	0	113.9	R57 S58	R57-K60 PolarHBondContact O-N 2.93Å; R57-K60 VanDerWaalsContact O-N 3.09Å; S58-K60 PolarHBondContact O-N 3.14Å
61	S	51.8	Low	61.4	Low	91 Å²	91	97.7 Å²	97.7	64%	0.636	53%	0.529	S	S	*	.	H	α-helix	trans	-87.1	-6.6	-171.9	61	0	0	0	0	114.7	S58	S58-S61 PolarHBondContact O-N 3.34Å; S58-S61 PolarHBondContact O-OG 3.14Å
62	V	49.4	Very low	59.3	Low	80 Å²	80	104.3 Å²	104.3	49%	0.485	56%	0.561	S	S	.	*			trans	-112.2	44.8	179.7	-162.4	0	0	0	0	110.9	V64	V62-V64 HydrophobicContact CG1-CG2 4.39Å
63	S	42.7	Very low	57	Low	97 Å²	97	114.8 Å²	114.8	68%	0.678	60%	0.6	S	S	*	*			trans	-92	69.5	143	66.8	0	0	0	0	106.4	T65	S63-T65 PolarHBondContact O-N 3.06Å
64	V	46.2	Very low	54.9	Low	105 Å²	105	115.2 Å²	115.2	64%	0.636	61%	0.612	S	S	*	*			trans	-61.8	106.4	160.2	176.1	0	0	0	0	103.3	V62 T66	V62-V64 HydrophobicContact CG1-CG2 4.39Å; V64-T66 PolarHBondContact O-N 2.75Å; V64-T66 PolarHBondContact O-OG1 3.39Å
65	T	44.7	Very low	53	Low	110 Å²	110	115.9 Å²	115.9	68%	0.675	63%	0.625	S	S	*	*			trans	-49.7	96.8	160.3	-47.5	0	0	0	0	103.7	S63 T67	S63-T65 PolarHBondContact O-N 3.06Å; T65-T67 WeakPolarHBondContact CG2-OG1 3.4Å; T65-T67 PolarHBondContact O-N 3.45Å
66	T	48.7	Very low	51.6	Low	125 Å²	125	120.1 Å²	120.1	77%	0.767	65%	0.65	S	S	*	*			trans	-70.3	76	156.5	-38.1	0	0	0	0	101	V64 A68	V64-T66 PolarHBondContact O-N 2.75Å; V64-T66 PolarHBondContact O-OG1 3.39Å; T66-A68 PolarHBondContact O-N 2.91Å
67	T	44.3	Very low	50.1	Low	100 Å²	100	124.2 Å²	124.2	61%	0.613	68%	0.678	S	S	*	*			trans	-57.8	97.8	159.6	-48.4	0	0	0	0	100.2	T65 T69	T65-T67 WeakPolarHBondContact CG2-OG1 3.4Å; T65-T67 PolarHBondContact O-N 3.45Å; T67-T69 PolarHBondContact O-N 2.82Å
68	A	49	Very low	48.7	Very low	80 Å²	80	119.5 Å²	119.5	66%	0.661	68%	0.675	S	S	*	*			trans	-56.5	93.8	164.2	0	0	0	0	0	102.9	T66 R70	T66-A68 PolarHBondContact O-N 2.91Å; A68-R70 PolarHBondContact O-N 3.13Å
69	T	46.6	Very low	47.6	Very low	118 Å²	118	123.2 Å²	123.2	72%	0.724	70%	0.699	S	S	*	*			trans	-54.6	90.6	146.8	25.6	0	0	0	0	103.3	T67 T71	T67-T69 PolarHBondContact O-N 2.82Å; T69-T71 PolarHBondContact O-N 3.39Å
70	R	45.1	Very low	46.8	Very low	221 Å²	221	125.2 Å²	125.2	83%	0.834	71%	0.713	S	S	*	*			trans	-62.1	73.9	158.9	-175.9	-179.5	-179.6	164.6	0.1	104.5	A68 E72	A68-R70 PolarHBondContact O-N 3.13Å; R70-E72 PolarHBondContact O-N 3.28Å; R70-E72 VanDerWaalsContact O-N 3.08Å
71	T	47.7	Very low	46.1	Very low	103 Å²	103	123.2 Å²	123.2	63%	0.632	72%	0.719	S	S	*	*			trans	-74.9	96.3	164.9	-52.9	0	0	0	0	103.9	T69 R73	T69-T71 PolarHBondContact O-N 3.39Å; T71-R73 VanDerWaalsContact C-N 3.27Å; T71-R73 HydrophobicContact CG2-CG 4.42Å; T71-R73 PolarHBondContact O-N 3.07Å
72	E	47	Very low	45.7	Very low	156 Å²	156	124 Å²	124	73%	0.729	73%	0.732	S	S	*	*			trans	-49.3	96	158.3	-68.9	174.4	153.5	0	0	108.2	R70	R70-E72 PolarHBondContact O-N 3.28Å; R70-E72 VanDerWaalsContact O-N 3.08Å
73	R	42.6	Very low	45.1	Very low	225 Å²	225	123.4 Å²	123.4	85%	0.849	74%	0.741	S	S	*	*			trans	-136.3	86.2	157.4	-85.9	-168.7	179.9	157.4	0.3	108.7	T71	T71-R73 VanDerWaalsContact C-N 3.27Å; T71-R73 HydrophobicContact CG2-CG 4.42Å; T71-R73 PolarHBondContact O-N 3.07Å
74	T	45.4	Very low	44.9	Very low	129 Å²	129	121.9 Å²	121.9	79%	0.791	74%	0.74	S	S	*	*			trans	-24.6	144.4	135.8	-20.3	0	0	0	0	112.1
75	S	47.1	Very low	44.8	Very low	95 Å²	95	121 Å²	121	66%	0.664	74%	0.739	S	S	*	*			trans	95.5	108.8	161.9	80.9	0	0	0	0	117.8
76	N	48.5	Very low	44.7	Very low	138 Å²	138	122.9 Å²	122.9	74%	0.738	75%	0.745	S	S	*	*				87.4	97.3	129.9	-59.2	-5.3	0	0	0	118.5	S78	N76-S78 PolarHBondContact O-N 3.37Å
77	N	46.8	Very low	44.5	Very low	167 Å²	167	123.6 Å²	123.6	89%	0.893	74%	0.743	S	S	*	*				36	87.8	121.1	-79.4	-1.4	0	0	0	115.6
78	S	44.3	Very low	44.3	Very low	97 Å²	97	124.1 Å²	124.1	68%	0.678	74%	0.738	S	S	*	*			trans	-151	104.9	146	39.5	0	0	0	0	109.3	N76 S80	N76-S78 PolarHBondContact O-N 3.37Å; S78-S80 PolarHBondContact O-N 3.28Å; S78-S80 PolarHBondContact O-OG 2.92Å
79	C	40.8	Very low	43.9	Very low	145 Å²	145	124.8 Å²	124.8	98%	0.98	74%	0.736	S	S	*	*			trans	-52.7	98.8	163.7	-77.7	0	0	0	0	108.8
80	S	43.6	Very low	44.1	Very low	88 Å²	88	127.2 Å²	127.2	62%	0.615	74%	0.736	S	S	*	*			trans	-135	97.8	171.4	-32.5	0	0	0	0	108	S78	S78-S80 PolarHBondContact O-N 3.28Å; S78-S80 PolarHBondContact O-OG 2.92Å
81	S	46	Very low	44.3	Very low	117 Å²	117	121.8 Å²	121.8	82%	0.818	72%	0.72	S	S	*	*			trans	60.5	104.5	142.8	-49.1	0	0	0	0	115.7	G83	S81-G83 PolarHBondContact O-N 3.45Å
82	A	43	Very low	44.7	Very low	109 Å²	109	118.7 Å²	118.7	90%	0.901	70%	0.703	S	S	*	*			trans	-48.3	76.9	153.9	0	0	0	0	0	111.2	G84	A82-G84 PolarHBondContact O-N 2.9Å
83	G	37.5	Very low	45.8	Very low	67 Å²	67	114.7 Å²	114.7	69%	0.691	69%	0.686	S	S	*	*			trans	-67.5	76.5	149.4	0	0	0	0	0	105.5	S81 S85	S81-G83 PolarHBondContact O-N 3.45Å; G83-S85 PolarHBondContact O-N 3.25Å
84	G	37.8	Very low	47.5	Very low	64 Å²	64	106.7 Å²	106.7	66%	0.66	66%	0.66	S	S	*	*			trans	-58.4	85.7	163.3	0	0	0	0	0	105.7	A82 D86	A82-G84 PolarHBondContact O-N 2.9Å; G84-D86 VanDerWaalsContact C-N 3.29Å; G84-D86 PolarHBondContact O-N 3.49Å
85	S	43.9	Very low	49.4	Very low	87 Å²	87	101.5 Å²	101.5	61%	0.608	63%	0.626	S	S	*	*			trans	-49.9	112.9	155.6	54.5	0	0	0	0	103.3	G83 I87	G83-S85 PolarHBondContact O-N 3.25Å; S85-I87 PolarHBondContact O-N 3.25Å; S85-I87 WeakPolarHBondContact OG-CG1 3.22Å
86	D	43.6	Very low	51.5	Low	149 Å²	149	99.2 Å²	99.2	80%	0.797	61%	0.605	S	S	*	*			trans	-56.9	79.9	163.7	-93.8	-36.6	0	0	0	105	G84 Q88	G84-D86 VanDerWaalsContact C-N 3.29Å; G84-D86 PolarHBondContact O-N 3.49Å; D86-Q88 PolarHBondContact O-N 3.17Å
87	I	43.6	Very low	53.6	Low	141 Å²	141	92.6 Å²	92.6	72%	0.723	57%	0.57	S	S	*	*			trans	-68.2	76.4	162.2	-57.6	173.7	0	0	0	101.9	S85 P89	S85-I87 PolarHBondContact O-N 3.25Å; S85-I87 WeakPolarHBondContact OG-CG1 3.22Å; I87-P89 WeakPolarHBondContact O-CD 3.46Å
88	Q	40.2	Very low	55.7	Low	111 Å²	111	84.7 Å²	84.7	52%	0.519	53%	0.527	S	S	.	.			trans	-49.6	121.5	167.2	-90.6	-173.8	4.3	0	0	104.3	D86 K90	D86-Q88 PolarHBondContact O-N 3.17Å; Q88-K90 PolarHBondContact O-N 3Å
89	P	40.8	Very low	58	Low	93 Å²	93	80.6 Å²	80.6	60%	0.604	50%	0.498	S	S	*	.			trans	-52.1	115.5	177.2	19.4	-30.5	0	0	0	105.5	I87 Q91	I87-P89 WeakPolarHBondContact O-CD 3.46Å; P89-Q91 WeakPolarHBondContact O-CA 3.39Å; P89-Q91 PolarHBondContact O-N 3.21Å
90	K	50.5	Low	60.6	Low	169 Å²	169	75.1 Å²	75.1	74%	0.735	46%	0.458	S	S	*	.			trans	-54.6	96.7	-172.9	-169	175.1	-175.8	175.4	0	105.9	Q88 S92	Q88-K90 PolarHBondContact O-N 3Å; K90-S92 PolarHBondContact O-N 3.34Å; K90-S92 VanDerWaalsContact O-N 3.11Å
91	Q	50.6	Low	63.1	Low	108 Å²	108	71.1 Å²	71.1	51%	0.505	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-57	122.9	-166	-104.2	-167.8	-14.5	0	0	107.1	P89 N93 R360	P89-Q91 WeakPolarHBondContact O-CA 3.39Å; P89-Q91 PolarHBondContact O-N 3.21Å; Q91-N93 PolarHBondContact O-N 3.35Å; Q91-N93 VanDerWaalsContact O-N 3.09Å; Q91-R360 VanDerWaalsContact CG-NH2 3.34Å; Q91-R360 VanDerWaalsContact OE1-NH2 3.09Å
92	S	54.8	Low	65.3	Low	37 Å²	37	66.1 Å²	66.1	26%	0.259	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-62.7	122.3	-163.2	101.6	0	0	0	0	108.7	K90 L94 K179 E287 R360	K90-S92 PolarHBondContact O-N 3.34Å; K90-S92 VanDerWaalsContact O-N 3.11Å; S92-L94 PolarHBondContact O-N 2.93Å; S92-K179 PolarHBondContact OG-NZ 3.33Å; S92-K179 VanDerWaalsContact OG-NZ 3.17Å; S92-E287 PolarHBondContact OG-OE2 3.42Å; S92-R360 PolarHBondContact O-NH1 3.36Å
93	N	69.6	Low	67.9	Low	72 Å²	72	61.7 Å²	61.7	39%	0.385	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-56	142.8	174.8	-74.8	-21.3	0	0	0	108	S59 Q91 R95	S59-N93 PolarHBondContact OG-ND2 2.69Å; Q91-N93 PolarHBondContact O-N 3.35Å; Q91-N93 VanDerWaalsContact O-N 3.09Å; N93-R95 PolarHBondContact O-N 3.05Å
94	L	78.5	Confident	70.7	Confident	57 Å²	57	60.1 Å²	60.1	30%	0.298	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-50	138.8	175	-148.4	90.3	0	0	0	109	S92 E96 T98 Q99 M102	S92-L94 PolarHBondContact O-N 2.93Å; L94-E96 PolarHBondContact O-N 2.83Å; L94-T98 HydrophobicContact CD2-CG2 4.26Å; L94-Q99 HydrophobicContact CB-CG 3.86Å; L94-Q99 HydrophobicContact CD2-CG 4.05Å; L94-Q99 PolarHBondContact O-NE2 3.2Å; L94-M102 HydrophobicContact CD2-CE 3.04Å; L94-M102 HydrophobicContact CD2-SD 4.44Å
95	R	86.4	Confident	73.5	Confident	20 Å²	20	57.4 Å²	57.4	8%	0.075	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-50.9	134	-178.1	-172.3	-176.9	168.1	111.1	16.7	111	N93 S97 T98 Q99 E163 L167 Y175 S176 N178 K179	N93-R95 PolarHBondContact O-N 3.05Å; R95-S97 VanDerWaalsContact CD-OG 3.28Å; R95-S97 WeakPolarHBondContact CD-OG 3.38Å; R95-S97 WeakPolarHBondContact CG-OG 3.15Å; R95-S97 PolarHBondContact NE-OG 3.49Å; R95-S97 PolarHBondContact O-N 3.31Å; R95-T98 PolarHBondContact O-N 3.42Å; R95-T98 VanDerWaalsContact O-N 3.13Å; R95-Q99 WeakPolarHBondContact O-CG 3.37Å; R95-Q99 PolarHBondContact O-N 2.9Å; R95-E163 IonicContact NE-OE1 3.57Å; R95-L167 VanDerWaalsContact NH1-CD2 3.27Å; R95-Y175 VanDerWaalsContact CZ-O 3.23Å; R95-Y175 PolarHBondContact NH1-O 3.19Å; R95-Y175 VanDerWaalsContact NH2-CZ 3.33Å; R95-Y175 PolarHBondContact NH2-O 3.48Å; R95-S176 PolarHBondContact NH1-O 3.22Å; R95-N178 PolarHBondContact NH2-O 3.21Å; R95-K179 WeakPolarHBondContact CG-O 3.38Å
96	E	90.9	Very high	76	Confident	47 Å²	47	53.3 Å²	53.3	22%	0.22	28%	0.277	C	S	.	.	H	α-helix	trans	-61.8	-32.5	-171.3	-65.4	-173.4	-178.8	0	0	112.8	L94 Q99 L100 K179 I182	L94-E96 PolarHBondContact O-N 2.83Å; E96-Q99 PolarHBondContact O-N 3.26Å; E96-L100 PolarHBondContact O-N 3.08Å; E96-K179 PolarHBondContact N-O 3.01Å; E96-I182 HydrophobicContact CB-CD1 3.95Å; E96-I182 HydrophobicContact CB-CG1 3.59Å; E96-I182 WeakPolarHBondContact OE2-CD1 3.25Å
97	S	92.7	Very high	78.6	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-66.3	-45.8	175.4	54	0	0	0	0	112.5	R95 Q99 L100 L101 E163 Y175	R95-S97 VanDerWaalsContact CD-OG 3.28Å; R95-S97 WeakPolarHBondContact CD-OG 3.38Å; R95-S97 WeakPolarHBondContact CG-OG 3.15Å; R95-S97 PolarHBondContact NE-OG 3.49Å; R95-S97 PolarHBondContact O-N 3.31Å; S97-Q99 VanDerWaalsContact C-N 3.34Å; S97-Q99 PolarHBondContact O-N 3.36Å; S97-L100 WeakPolarHBondContact O-CB 3.13Å; S97-L100 PolarHBondContact O-N 2.89Å; S97-L101 WeakPolarHBondContact O-CG 3.41Å; S97-L101 PolarHBondContact O-N 3.19Å; S97-E163 WeakPolarHBondContact CB-OE1 3.47Å; S97-E163 PolarHBondContact OG-OE1 2.96Å; S97-Y175 PolarHBondContact OG-OH 3.26Å
98	T	91.2	Very high	81.2	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-66.4	-36.7	175	-46.5	0	0	0	0	111.6	L94 R95 L100 L101 M102 E163 R164	L94-T98 HydrophobicContact CD2-CG2 4.26Å; R95-T98 PolarHBondContact O-N 3.42Å; R95-T98 VanDerWaalsContact O-N 3.13Å; T98-L100 VanDerWaalsContact C-N 3.31Å; T98-L100 PolarHBondContact O-N 3.14Å; T98-L101 PolarHBondContact O-N 3.27Å; T98-M102 HydrophobicContact CG2-CE 4.12Å; T98-M102 HydrophobicContact CG2-CG 4.33Å; T98-M102 HydrophobicContact CG2-SD 4.29Å; T98-M102 WeakPolarHBondContact O-CB 3.25Å; T98-M102 WeakPolarHBondContact O-CG 3.18Å; T98-M102 PolarHBondContact O-N 3.32Å; T98-E163 WeakPolarHBondContact CB-OE2 3.3Å; T98-E163 PolarHBondContact OG1-OE2 2.79Å; T98-R164 VanDerWaalsContact OG1-CZ 3.26Å; T98-R164 PolarHBondContact OG1-NH2 3.29Å
99	Q	92.3	Very high	83.9	Confident	12 Å²	12	38.6 Å²	38.6	6%	0.056	20%	0.203	C	C	.	.	H	α-helix	trans	-59.3	-43.8	173.1	-68.1	-176	8.6	0	0	111.4	L52 L94 R95 E96 S97 A103	L52-Q99 HydrophobicContact CD2-CB 4.41Å; L52-Q99 HydrophobicContact CD2-CG 4.27Å; L94-Q99 HydrophobicContact CB-CG 3.86Å; L94-Q99 HydrophobicContact CD2-CG 4.05Å; L94-Q99 PolarHBondContact O-NE2 3.2Å; R95-Q99 WeakPolarHBondContact O-CG 3.37Å; R95-Q99 PolarHBondContact O-N 2.9Å; E96-Q99 PolarHBondContact O-N 3.26Å; S97-Q99 VanDerWaalsContact C-N 3.34Å; S97-Q99 PolarHBondContact O-N 3.36Å; Q99-A103 VanDerWaalsContact O-CB 3.28Å; Q99-A103 WeakPolarHBondContact O-CB 3.41Å; Q99-A103 PolarHBondContact O-N 2.96Å
100	L	94.8	Very high	86.6	Confident	30 Å²	30	36.8 Å²	36.8	16%	0.157	19%	0.186	C	C	.	.	H	α-helix	trans	-61.5	-50.2	175.9	177	66.4	0	0	0	111.2	E96 S97 T98 M102 A103 C104 I182 A186 L189	E96-L100 PolarHBondContact O-N 3.08Å; S97-L100 WeakPolarHBondContact O-CB 3.13Å; S97-L100 PolarHBondContact O-N 2.89Å; T98-L100 VanDerWaalsContact C-N 3.31Å; T98-L100 PolarHBondContact O-N 3.14Å; L100-M102 VanDerWaalsContact C-N 3.34Å; L100-M102 PolarHBondContact O-N 2.96Å; L100-A103 PolarHBondContact O-N 2.91Å; L100-C104 PolarHBondContact O-N 3.48Å; L100-C104 PolarHBondContact O-SG 3.36Å; L100-C104 VanDerWaalsContact O-SG 3.38Å; L100-I182 HydrophobicContact CD2-CG2 3.55Å; L100-A186 HydrophobicContact CD2-CB 4Å; L100-L189 HydrophobicContact CD2-CD1 3.98Å; L100-L189 HydrophobicContact CG-CD1 3.85Å
101	L	95.6	Very high	88.9	Confident	3 Å²	3	32.4 Å²	32.4	2%	0.016	17%	0.17	C	C	.	.	H	α-helix	trans	-58.2	-45.2	179.8	-70.8	168.3	0	0	0	111.8	S97 T98 C104 L105 A159 M160 E163 A185 L189	S97-L101 WeakPolarHBondContact O-CG 3.41Å; S97-L101 PolarHBondContact O-N 3.19Å; T98-L101 PolarHBondContact O-N 3.27Å; L101-C104 PolarHBondContact O-N 2.9Å; L101-L105 WeakPolarHBondContact O-CB 3.21Å; L101-L105 PolarHBondContact O-N 3.31Å; L101-A159 HydrophobicContact CD2-CB 4.16Å; L101-M160 HydrophobicContact CB-CE 4.2Å; L101-M160 HydrophobicContact CB-CG 4.46Å; L101-E163 HydrophobicContact CD1-CB 4.16Å; L101-E163 HydrophobicContact CD1-CG 4.4Å; L101-E163 WeakPolarHBondContact CD1-OE2 3.28Å; L101-A185 HydrophobicContact CD1-CB 4.19Å; L101-A185 HydrophobicContact CD2-CB 4.44Å; L101-A185 HydrophobicContact CG-CB 4.17Å; L101-L189 HydrophobicContact CD2-CD1 3.77Å; L101-L189 HydrophobicContact CD2-CD2 3.66Å; L101-L189 HydrophobicContact CD2-CG 3.59Å
102	M	94.1	Very high	91	Very high	12 Å²	12	27.2 Å²	27.2	6%	0.059	15%	0.146	C	C	.	.	H	α-helix	trans	-68.8	-35.5	178	-72.2	-171.6	-52.4	0	0	113	L52 L94 T98 L100 L105 A106 M160 M295 Y354	L52-M102 HydrophobicContact CD1-CB 3.54Å; L52-M102 HydrophobicContact CD1-CE 4.29Å; L52-M102 HydrophobicContact CD2-CE 3.81Å; L94-M102 HydrophobicContact CD2-CE 3.04Å; L94-M102 HydrophobicContact CD2-SD 4.44Å; T98-M102 HydrophobicContact CG2-CE 4.12Å; T98-M102 HydrophobicContact CG2-CG 4.33Å; T98-M102 HydrophobicContact CG2-SD 4.29Å; T98-M102 WeakPolarHBondContact O-CB 3.25Å; T98-M102 WeakPolarHBondContact O-CG 3.18Å; T98-M102 PolarHBondContact O-N 3.32Å; L100-M102 VanDerWaalsContact C-N 3.34Å; L100-M102 PolarHBondContact O-N 2.96Å; M102-L105 PolarHBondContact O-N 2.92Å; M102-A106 VanDerWaalsContact O-CB 3.32Å; M102-A106 WeakPolarHBondContact O-CB 3.3Å; M102-A106 PolarHBondContact O-N 3.34Å; M102-M160 HydrophobicContact CB-CE 4.17Å; M102-M160 HydrophobicContact CG-CE 3.5Å; M102-M160 HydrophobicContact CG-SD 3.46Å; M102-M160 WeakPolarHBondContact CG-SD 3.39Å; M102-M160 HydrophobicContact SD-SD 4.36Å; M102-M295 HydrophobicContact SD-CE 4.47Å; M102-Y354 HydrophobicContact CE-CE2 3.89Å; M102-Y354 HydrophobicContact SD-CD2 4.06Å; M102-Y354 HydrophobicContact SD-CE2 3.59Å; M102-Y354 VanDerWaalsContact SD-CE2 3.59Å
103	A	95.8	Very high	93	Very high	16 Å²	16	25.6 Å²	25.6	13%	0.132	13%	0.134	C	C	.	.	H	α-helix	trans	-67.2	-42.5	175.7	0	0	0	0	0	111.2	Y49 L52 Q99 L100 A106 L107	Y49-A103 HydrophobicContact CD2-CB 4.2Å; Y49-A103 WeakPolarHBondContact CD2-O 3.01Å; Y49-A103 HydrophobicContact CE2-CB 4.33Å; L52-A103 HydrophobicContact CB-CB 4.32Å; L52-A103 HydrophobicContact CD1-CB 4.14Å; Q99-A103 VanDerWaalsContact O-CB 3.28Å; Q99-A103 WeakPolarHBondContact O-CB 3.41Å; Q99-A103 PolarHBondContact O-N 2.96Å; L100-A103 PolarHBondContact O-N 2.91Å; A103-A106 PolarHBondContact O-N 3.37Å; A103-L107 WeakPolarHBondContact O-CB 3.49Å; A103-L107 PolarHBondContact O-N 2.97Å
104	C	97.6	Very high	94.2	Very high	34 Å²	34	24.6 Å²	24.6	23%	0.23	13%	0.129	C	C	.	.	H	α-helix	trans	-63.7	-42.7	174.3	-70.2	0	0	0	0	111.7	L100 L101 L107 V108 F156 L189	L100-C104 PolarHBondContact O-N 3.48Å; L100-C104 PolarHBondContact O-SG 3.36Å; L100-C104 VanDerWaalsContact O-SG 3.38Å; L101-C104 PolarHBondContact O-N 2.9Å; C104-L107 PolarHBondContact O-N 3.48Å; C104-V108 WeakPolarHBondContact O-CB 3.46Å; C104-V108 WeakPolarHBondContact O-CG2 3.4Å; C104-V108 PolarHBondContact O-N 2.88Å; C104-F156 HydrophobicContact CB-CD2 4Å; C104-F156 HydrophobicContact CB-CE2 3.8Å; C104-L189 HydrophobicContact CB-CD1 4.22Å; C104-L189 HydrophobicContact CB-CD2 4.3Å
105	L	96.5	Very high	95	Very high	7 Å²	7	24.2 Å²	24.2	4%	0.037	13%	0.127	C	C	.	.	H	α-helix	trans	-61.3	-45.7	174.5	-178.3	63.7	0	0	0	111.5	L101 M102 L107 V108 D109 F156 M157 M160 F351	L101-L105 WeakPolarHBondContact O-CB 3.21Å; L101-L105 PolarHBondContact O-N 3.31Å; M102-L105 PolarHBondContact O-N 2.92Å; L105-L107 VanDerWaalsContact C-N 3.33Å; L105-L107 PolarHBondContact O-N 2.81Å; L105-V108 PolarHBondContact O-N 3.04Å; L105-D109 WeakPolarHBondContact O-CB 3.12Å; L105-D109 VanDerWaalsContact O-CG 3.31Å; L105-D109 PolarHBondContact O-N 2.88Å; L105-F156 HydrophobicContact CB-CB 4.4Å; L105-F156 HydrophobicContact CD1-CB 4.08Å; L105-M157 HydrophobicContact CD2-SD 4Å; L105-M160 HydrophobicContact CB-CE 4Å; L105-M160 HydrophobicContact CD2-CE 3.52Å; L105-M160 HydrophobicContact CG-CE 4.41Å; L105-F351 HydrophobicContact CG-CZ 4.34Å
106	A	97	Very high	95.4	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.008	12%	0.124	C	C	.	.	H	α-helix	trans	-60	-41.6	176.6	0	0	0	0	0	112.8	M102 A103 F110 F351	M102-A106 VanDerWaalsContact O-CB 3.32Å; M102-A106 WeakPolarHBondContact O-CB 3.3Å; M102-A106 PolarHBondContact O-N 3.34Å; A103-A106 PolarHBondContact O-N 3.37Å; A106-F110 VanDerWaalsContact O-CB 3.25Å; A106-F110 WeakPolarHBondContact O-CB 3.27Å; A106-F110 PolarHBondContact O-N 2.96Å; A106-F351 HydrophobicContact CB-CD1 4.25Å; A106-F351 HydrophobicContact CB-CE1 3.6Å; A106-F351 HydrophobicContact CB-CZ 3.98Å
107	L	97.3	Very high	95.6	Very high	72 Å²	72	21 Å²	21	38%	0.377	11%	0.113	S	C	.	.	H	α-helix	trans	-66.6	-46.3	177.8	-178.8	63.3	0	0	0	111.8	Y49 A103 C104 L105 F110 L111	Y49-L107 HydrophobicContact CD2-CB 4.25Å; Y49-L107 HydrophobicContact CE2-CB 4.21Å; A103-L107 WeakPolarHBondContact O-CB 3.49Å; A103-L107 PolarHBondContact O-N 2.97Å; C104-L107 PolarHBondContact O-N 3.48Å; L105-L107 VanDerWaalsContact C-N 3.33Å; L105-L107 PolarHBondContact O-N 2.81Å; L107-F110 WeakPolarHBondContact O-CB 3.46Å; L107-F110 PolarHBondContact O-N 3.36Å; L107-L111 HydrophobicContact CG-CD1 4.42Å; L107-L111 WeakPolarHBondContact O-CG 3.15Å; L107-L111 PolarHBondContact O-N 3.16Å
108	V	97.6	Very high	95.7	Very high	19 Å²	19	24.5 Å²	24.5	12%	0.115	13%	0.131	C	C	.	.	H	α-helix	trans	-64.2	-43.6	178.9	162.7	0	0	0	0	111.5	C104 L105 F110 L111 G112 C149 S152 F156	C104-V108 WeakPolarHBondContact O-CB 3.46Å; C104-V108 WeakPolarHBondContact O-CG2 3.4Å; C104-V108 PolarHBondContact O-N 2.88Å; L105-V108 PolarHBondContact O-N 3.04Å; V108-F110 VanDerWaalsContact C-N 3.33Å; V108-L111 PolarHBondContact O-N 3.44Å; V108-G112 PolarHBondContact O-N 3.48Å; V108-C149 HydrophobicContact CG1-CB 4.43Å; V108-C149 VanDerWaalsContact CG1-O 3.27Å; V108-C149 WeakPolarHBondContact CG1-O 3.24Å; V108-S152 VanDerWaalsContact CG1-CB 3.45Å; V108-F156 HydrophobicContact CB-CE2 4.46Å; V108-F156 HydrophobicContact CG2-CD2 4.12Å; V108-F156 HydrophobicContact CG2-CE2 3.57Å; V108-F156 HydrophobicContact CG2-CZ 4.43Å
109	D	97.2	Very high	95.8	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-66.3	-38.4	178.6	-75	-11.5	0	0	0	111.4	L105 G112 Q113 S153 V347 R350 F351	L105-D109 WeakPolarHBondContact O-CB 3.12Å; L105-D109 VanDerWaalsContact O-CG 3.31Å; L105-D109 PolarHBondContact O-N 2.88Å; D109-G112 PolarHBondContact O-N 3.24Å; D109-Q113 WeakPolarHBondContact O-CB 3.24Å; D109-Q113 PolarHBondContact O-N 3.32Å; D109-S153 WeakPolarHBondContact OD1-CB 3.47Å; D109-S153 PolarHBondContact OD1-OG 3.46Å; D109-V347 HydrophobicContact CB-CG1 3.65Å; D109-V347 WeakPolarHBondContact OD2-CG1 3.27Å; D109-R350 IonicContact OD1-NH2 2.69Å; D109-R350 PolarHBondContact OD1-NH2 3.3Å; D109-R350 IonicContact OD2-CZ 3.95Å; D109-R350 IonicContact OD2-NH2 3.6Å; D109-R350 PolarHBondContact OD2-NH2 3.32Å; D109-F351 HydrophobicContact CB-CE2 3.59Å; D109-F351 HydrophobicContact CB-CZ 3.81Å; D109-F351 VanDerWaalsContact OD2-CE2 3.29Å; D109-F351 WeakPolarHBondContact OD2-CE2 3.49Å; D109-F351 WeakPolarHBondContact OD2-CZ 3.33Å
110	F	97.8	Very high	95.9	Very high	56 Å²	56	24.6 Å²	24.6	25%	0.246	13%	0.131	C	C	.	.	H	α-helix	trans	-58.1	-49.9	171.9	170.7	-104.5	0	0	0	111.4	I46 A106 L107 V108 Q113 N114	I46-F110 HydrophobicContact CD1-CD2 4.01Å; I46-F110 HydrophobicContact CD1-CE2 3.48Å; I46-F110 VanDerWaalsContact CD1-CE2 3.48Å; I46-F110 HydrophobicContact CD1-CZ 4.05Å; I46-F110 HydrophobicContact CG1-CD2 3.78Å; I46-F110 HydrophobicContact CG1-CE2 3.77Å; I46-F110 HydrophobicContact CG1-CG 4.42Å; I46-F110 HydrophobicContact CG1-CZ 4.39Å; A106-F110 VanDerWaalsContact O-CB 3.25Å; A106-F110 WeakPolarHBondContact O-CB 3.27Å; A106-F110 PolarHBondContact O-N 2.96Å; L107-F110 WeakPolarHBondContact O-CB 3.46Å; L107-F110 PolarHBondContact O-N 3.36Å; V108-F110 VanDerWaalsContact C-N 3.33Å; F110-Q113 PolarHBondContact O-N 3.3Å; F110-N114 WeakPolarHBondContact CD2-ND2 3.37Å; F110-N114 WeakPolarHBondContact CE2-ND2 3.12Å; F110-N114 PolarHBondContact O-N 3.5Å; F110-N114 PolarHBondContact O-ND2 2.94Å
111	L	97.9	Very high	95.9	Very high	76 Å²	76	23.4 Å²	23.4	40%	0.398	13%	0.125	S	C	.	.	H	α-helix	trans	-63.6	-47.2	178.5	-68.4	174.7	0	0	0	111.4	L107 V108 Q113 N114 I115	L107-L111 HydrophobicContact CG-CD1 4.42Å; L107-L111 WeakPolarHBondContact O-CG 3.15Å; L107-L111 PolarHBondContact O-N 3.16Å; V108-L111 PolarHBondContact O-N 3.44Å; L111-Q113 VanDerWaalsContact C-N 3.29Å; L111-Q113 PolarHBondContact O-N 3.21Å; L111-N114 PolarHBondContact O-N 3.01Å; L111-I115 WeakPolarHBondContact O-CB 3.31Å; L111-I115 VanDerWaalsContact O-CG1 3.27Å; L111-I115 WeakPolarHBondContact O-CG1 3.33Å; L111-I115 PolarHBondContact O-N 2.94Å
112	G	96.1	Very high	95.9	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.1	-39.4	179.4	0	0	0	0	0	112.7	V108 D109 S116 C149 W344	V108-G112 PolarHBondContact O-N 3.48Å; D109-G112 PolarHBondContact O-N 3.24Å; G112-S116 WeakPolarHBondContact O-CA 3.5Å; G112-S116 WeakPolarHBondContact O-CB 3.49Å; G112-S116 PolarHBondContact O-N 3.44Å; G112-S116 PolarHBondContact O-OG 3.44Å; G112-C149 VanDerWaalsContact CA-CB 3.47Å; G112-W344 VanDerWaalsContact C-CH2 3.42Å; G112-W344 VanDerWaalsContact CA-CH2 3.43Å; G112-W344 WeakPolarHBondContact O-CZ2 3.41Å
113	Q	95.6	Very high	95.7	Very high	2 Å²	2	25 Å²	25	1%	0.009	13%	0.133	C	C	.	.	I	π-helix	trans	-66.5	-44.8	174.9	-175.2	162.1	34.2	0	0	112.1	T37 G41 S42 D109 F110 L111 I115 C117 L118 W344	T37-Q113 VanDerWaalsContact C-NE2 3.25Å; T37-Q113 VanDerWaalsContact CG2-NE2 3.31Å; T37-Q113 PolarHBondContact O-NE2 2.93Å; G41-Q113 PolarHBondContact O-OE1 3.04Å; S42-Q113 VanDerWaalsContact N-OE1 3.14Å; D109-Q113 WeakPolarHBondContact O-CB 3.24Å; D109-Q113 PolarHBondContact O-N 3.32Å; F110-Q113 PolarHBondContact O-N 3.3Å; L111-Q113 VanDerWaalsContact C-N 3.29Å; L111-Q113 PolarHBondContact O-N 3.21Å; Q113-I115 VanDerWaalsContact C-N 3.33Å; Q113-I115 PolarHBondContact O-N 2.67Å; Q113-C117 HydrophobicContact CG-CB 4.04Å; Q113-C117 WeakPolarHBondContact O-CA 3.19Å; Q113-C117 WeakPolarHBondContact O-CB 3.35Å; Q113-C117 PolarHBondContact O-N 3.27Å; Q113-L118 PolarHBondContact O-N 3.39Å; Q113-W344 HydrophobicContact CB-CE3 4.17Å
114	N	96.5	Very high	95.5	Very high	52 Å²	52	24.3 Å²	24.3	28%	0.278	13%	0.128	S	C	.	.	I	π-helix	trans	-71.5	-25.9	179.3	-77.6	-85.5	0	0	0	113.3	S42 F110 L111 L118	S42-N114 PolarHBondContact OG-ND2 2.87Å; S42-N114 VanDerWaalsContact OG-ND2 3.11Å; F110-N114 WeakPolarHBondContact CD2-ND2 3.37Å; F110-N114 WeakPolarHBondContact CE2-ND2 3.12Å; F110-N114 PolarHBondContact O-N 3.5Å; F110-N114 PolarHBondContact O-ND2 2.94Å; L111-N114 PolarHBondContact O-N 3.01Å; N114-L118 WeakPolarHBondContact O-CB 3.28Å; N114-L118 WeakPolarHBondContact O-CD2 3.41Å
115	I	95.4	Very high	95.3	Very high	49 Å²	49	27.2 Å²	27.2	25%	0.251	14%	0.141	S	C	.	.	I	π-helix	trans	-87.9	-49.4	178.2	-65.5	169	0	0	0	110.8	L111 Q113 R119 Q142 A145 E146	L111-I115 WeakPolarHBondContact O-CB 3.31Å; L111-I115 VanDerWaalsContact O-CG1 3.27Å; L111-I115 WeakPolarHBondContact O-CG1 3.33Å; L111-I115 PolarHBondContact O-N 2.94Å; Q113-I115 VanDerWaalsContact C-N 3.33Å; Q113-I115 PolarHBondContact O-N 2.67Å; I115-R119 WeakPolarHBondContact O-CB 3.48Å; I115-R119 PolarHBondContact O-N 2.84Å; I115-Q142 HydrophobicContact CG2-CG 4.05Å; I115-A145 HydrophobicContact CD1-CB 3.89Å; I115-A145 HydrophobicContact CG2-CB 4.47Å; I115-E146 HydrophobicContact CG2-CB 4.45Å
116	S	93.5	Very high	95	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.169	C	C	.	.	I	π-helix	trans	-90.7	-50.4	-169.5	-38.3	0	0	0	0	111.6	G112 L118 R119 Y120 E146 W344	G112-S116 WeakPolarHBondContact O-CA 3.5Å; G112-S116 WeakPolarHBondContact O-CB 3.49Å; G112-S116 PolarHBondContact O-N 3.44Å; G112-S116 PolarHBondContact O-OG 3.44Å; S116-L118 VanDerWaalsContact C-N 3.29Å; S116-L118 PolarHBondContact O-N 3.26Å; S116-R119 WeakPolarHBondContact O-CB 3.41Å; S116-R119 PolarHBondContact O-N 3.49Å; S116-R119 VanDerWaalsContact O-N 3.16Å; S116-Y120 WeakPolarHBondContact O-CD2 3.49Å; S116-Y120 PolarHBondContact O-N 2.71Å; S116-E146 WeakPolarHBondContact OG-CG 3.33Å; S116-W344 WeakPolarHBondContact OG-CZ2 3.31Å
117	C	95	Very high	94.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.171	C	C	.	.	I	π-helix	trans	-65.5	-36.7	179.9	-164.5	0	0	0	0	110.9	I38 Q113 Y120 T121 W344	I38-C117 HydrophobicContact CD1-CB 4.46Å; I38-C117 HydrophobicContact CG1-CB 3.91Å; Q113-C117 HydrophobicContact CG-CB 4.04Å; Q113-C117 WeakPolarHBondContact O-CA 3.19Å; Q113-C117 WeakPolarHBondContact O-CB 3.35Å; Q113-C117 PolarHBondContact O-N 3.27Å; C117-Y120 PolarHBondContact O-N 2.92Å; C117-T121 VanDerWaalsContact O-CB 3.29Å; C117-T121 WeakPolarHBondContact O-CB 3.46Å; C117-T121 PolarHBondContact O-N 3.36Å; C117-T121 PolarHBondContact O-OG1 2.94Å; C117-W344 HydrophobicContact CB-CB 4.01Å; C117-W344 HydrophobicContact CB-CG 3.97Å
118	L	95.2	Very high	93.8	Very high	72 Å²	72	32.7 Å²	32.7	38%	0.377	16%	0.16	S	C	.	.	H	α-helix	trans	-60.4	-43.6	172.7	-175.1	62.3	0	0	0	111.9	I38 Q113 N114 S116 T121 I122	I38-L118 HydrophobicContact CD1-CB 4.1Å; I38-L118 HydrophobicContact CD1-CD1 4.04Å; Q113-L118 PolarHBondContact O-N 3.39Å; N114-L118 WeakPolarHBondContact O-CB 3.28Å; N114-L118 WeakPolarHBondContact O-CD2 3.41Å; S116-L118 VanDerWaalsContact C-N 3.29Å; S116-L118 PolarHBondContact O-N 3.26Å; L118-T121 PolarHBondContact O-N 3.06Å; L118-I122 HydrophobicContact CD1-CD1 3.94Å; L118-I122 HydrophobicContact CD1-CG1 4.25Å; L118-I122 HydrophobicContact CG-CD1 3.82Å; L118-I122 HydrophobicContact CG-CG1 4.47Å; L118-I122 VanDerWaalsContact O-CG1 3.31Å; L118-I122 WeakPolarHBondContact O-CG1 3.11Å; L118-I122 PolarHBondContact O-N 3.08Å
119	R	93.7	Very high	93.2	Very high	7 Å²	7	31.9 Å²	31.9	3%	0.026	16%	0.155	C	C	.	.	H	α-helix	trans	-57.2	-55.1	174.2	177.7	-163.9	175.7	-152.6	-2.4	111.2	I115 S116 T121 I122 L123 D129 I130 R131 E146 L323	I115-R119 WeakPolarHBondContact O-CB 3.48Å; I115-R119 PolarHBondContact O-N 2.84Å; S116-R119 WeakPolarHBondContact O-CB 3.41Å; S116-R119 PolarHBondContact O-N 3.49Å; S116-R119 VanDerWaalsContact O-N 3.16Å; R119-T121 PolarHBondContact O-N 3.27Å; R119-I122 PolarHBondContact O-N 3.18Å; R119-L123 VanDerWaalsContact O-CB 3.24Å; R119-L123 WeakPolarHBondContact O-CB 3.19Å; R119-L123 PolarHBondContact O-N 2.98Å; R119-D129 IonicContact CZ-OD2 3Å; R119-D129 VanDerWaalsContact CZ-OD2 3.25Å; R119-D129 IonicContact NE-OD1 3.34Å; R119-D129 PolarHBondContact NE-OD1 3.06Å; R119-D129 IonicContact NE-OD2 2.57Å; R119-D129 PolarHBondContact NE-OD2 2.98Å; R119-D129 IonicContact NH2-OD2 3.37Å; R119-D129 PolarHBondContact NH2-OD2 3.47Å; R119-I130 HydrophobicContact CB-CD1 4.36Å; R119-I130 HydrophobicContact CG-CG1 4.31Å; R119-R131 VanDerWaalsContact NH1-CZ 3.26Å; R119-E146 IonicContact NH1-OE2 3.47Å; R119-E146 PolarHBondContact NH1-OE2 3.26Å; R119-L323 PolarHBondContact NH2-O 2.83Å; R119-L323 VanDerWaalsContact NH2-O 3.13Å
120	Y	93.7	Very high	92.7	Very high	7 Å²	7	33.5 Å²	33.5	3%	0.027	16%	0.164	C	C	.	.	H	α-helix	trans	-63.7	-31.3	-178.6	-65.7	-65	0	0	0	112.5	S116 C117 L123 A124 E146 Y336 N337 N340	S116-Y120 WeakPolarHBondContact O-CD2 3.49Å; S116-Y120 PolarHBondContact O-N 2.71Å; C117-Y120 PolarHBondContact O-N 2.92Å; Y120-L123 HydrophobicContact CD1-CD2 4.41Å; Y120-A124 WeakPolarHBondContact O-CB 3.2Å; Y120-A124 PolarHBondContact O-N 3.36Å; Y120-E146 PolarHBondContact OH-OE1 2.85Å; Y120-Y336 HydrophobicContact CE1-CE1 4.27Å; Y120-N337 VanDerWaalsContact CD1-OD1 3.3Å; Y120-N337 WeakPolarHBondContact CD1-OD1 3.09Å; Y120-N340 HydrophobicContact CD1-CB 4.26Å; Y120-N340 HydrophobicContact CD2-CB 3.71Å; Y120-N340 HydrophobicContact CE1-CB 4.2Å; Y120-N340 HydrophobicContact CE2-CB 3.67Å; Y120-N340 HydrophobicContact CG-CB 4.04Å
121	T	95.8	Very high	92.1	Very high	5 Å²	5	30.9 Å²	30.9	3%	0.031	15%	0.152	C	C	.	.	H	α-helix	trans	-67.4	-46	174.3	-57.1	0	0	0	0	111.4	A31 G34 F35 I38 C117 L118 R119 A124 L125	A31-T121 WeakPolarHBondContact O-CG2 3.49Å; G34-T121 WeakPolarHBondContact CA-OG1 3.48Å; F35-T121 HydrophobicContact CB-CG2 4.38Å; I38-T121 HydrophobicContact CD1-CG2 4.46Å; C117-T121 VanDerWaalsContact O-CB 3.29Å; C117-T121 WeakPolarHBondContact O-CB 3.46Å; C117-T121 PolarHBondContact O-N 3.36Å; C117-T121 PolarHBondContact O-OG1 2.94Å; L118-T121 PolarHBondContact O-N 3.06Å; R119-T121 PolarHBondContact O-N 3.27Å; T121-A124 PolarHBondContact O-N 3.39Å; T121-L125 HydrophobicContact CG2-CD1 4.38Å; T121-L125 WeakPolarHBondContact O-CG 3.43Å; T121-L125 PolarHBondContact O-N 3.21Å
122	I	93.8	Very high	91.5	Very high	48 Å²	48	30.7 Å²	30.7	25%	0.246	15%	0.151	C	C	.	.	H	α-helix	trans	-68.8	-41.2	177.6	-64.6	166.8	0	0	0	110.7	L118 R119 A124 L125 K126 I130	L118-I122 HydrophobicContact CD1-CD1 3.94Å; L118-I122 HydrophobicContact CD1-CG1 4.25Å; L118-I122 HydrophobicContact CG-CD1 3.82Å; L118-I122 HydrophobicContact CG-CG1 4.47Å; L118-I122 VanDerWaalsContact O-CG1 3.31Å; L118-I122 WeakPolarHBondContact O-CG1 3.11Å; L118-I122 PolarHBondContact O-N 3.08Å; R119-I122 PolarHBondContact O-N 3.18Å; I122-A124 VanDerWaalsContact C-N 3.26Å; I122-A124 PolarHBondContact O-N 3.13Å; I122-L125 PolarHBondContact O-N 2.98Å; I122-K126 HydrophobicContact CG2-CB 4.44Å; I122-K126 HydrophobicContact CG2-CG 4.15Å; I122-K126 WeakPolarHBondContact O-CB 3.37Å; I122-K126 PolarHBondContact O-N 2.75Å; I122-I130 HydrophobicContact CB-CG2 4.07Å; I122-I130 HydrophobicContact CD1-CD1 4.37Å; I122-I130 HydrophobicContact CD1-CG2 4.11Å; I122-I130 HydrophobicContact CG2-CG2 3.42Å; I122-I130 VanDerWaalsContact CG2-CG2 3.42Å
123	L	91	Very high	90.8	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-56.5	-44.1	175.5	-172.7	60.9	0	0	0	109.8	R119 Y120 Q127 D129 I328	R119-L123 VanDerWaalsContact O-CB 3.24Å; R119-L123 WeakPolarHBondContact O-CB 3.19Å; R119-L123 PolarHBondContact O-N 2.98Å; Y120-L123 HydrophobicContact CD1-CD2 4.41Å; L123-Q127 WeakPolarHBondContact O-CA 3.45Å; L123-Q127 PolarHBondContact O-N 3.18Å; L123-D129 HydrophobicContact CD1-CB 3.92Å; L123-D129 VanDerWaalsContact CD1-N 3.35Å; L123-I328 VanDerWaalsContact C-CD1 3.47Å; L123-I328 HydrophobicContact CB-CD1 4.44Å; L123-I328 HydrophobicContact CD1-CD1 4.49Å; L123-I328 HydrophobicContact CD1-CG1 4.19Å; L123-I328 HydrophobicContact CD2-CG1 4.37Å; L123-I328 HydrophobicContact CG-CD1 3.78Å; L123-I328 HydrophobicContact CG-CG1 3.83Å; L123-I328 WeakPolarHBondContact O-CD1 3.26Å
124	A	92	Very high	90.2	Very high	3 Å²	3	44.1 Å²	44.1	3%	0.025	21%	0.206	C	C	.	.	H	α-helix	trans	-66	-38.1	174.1	0	0	0	0	0	113.3	N27 V30 A31 Y120 T121 I122	N27-A124 WeakPolarHBondContact CB-O 3.31Å; V30-A124 HydrophobicContact CB-CB 4.46Å; V30-A124 HydrophobicContact CG1-CB 4.18Å; A31-A124 HydrophobicContact CB-CB 3.9Å; Y120-A124 WeakPolarHBondContact O-CB 3.2Å; Y120-A124 PolarHBondContact O-N 3.36Å; T121-A124 PolarHBondContact O-N 3.39Å; I122-A124 VanDerWaalsContact C-N 3.26Å; I122-A124 PolarHBondContact O-N 3.13Å
125	L	92.4	Very high	89.9	Confident	95 Å²	95	45.4 Å²	45.4	50%	0.497	22%	0.216	S	C	.	.	H	α-helix	trans	-74.5	-36.2	179.7	-74.2	172.6	0	0	0	114.5	L28 A31 T121 I122	L28-L125 HydrophobicContact CD1-CD2 4.26Å; A31-L125 HydrophobicContact CB-CD1 4.4Å; A31-L125 HydrophobicContact CB-CD2 3.39Å; A31-L125 HydrophobicContact CB-CG 3.47Å; A31-L125 VanDerWaalsContact CB-CG 3.47Å; T121-L125 HydrophobicContact CG2-CD1 4.38Å; T121-L125 WeakPolarHBondContact O-CG 3.43Å; T121-L125 PolarHBondContact O-N 3.21Å; I122-L125 PolarHBondContact O-N 2.98Å
126	K	90.7	Very high	89.6	Confident	143 Å²	143	46.7 Å²	46.7	62%	0.622	22%	0.223	S	C	*	.	H	α-helix	trans	-110.2	-11.2	-170.2	-65.6	-60.3	-173.5	-178.3	0	113.3	I122 Y128	I122-K126 HydrophobicContact CG2-CB 4.44Å; I122-K126 HydrophobicContact CG2-CG 4.15Å; I122-K126 WeakPolarHBondContact O-CB 3.37Å; I122-K126 PolarHBondContact O-N 2.75Å; K126-Y128 WeakPolarHBondContact O-CD2 3.45Å; K126-Y128 VanDerWaalsContact O-CE2 3.28Å; K126-Y128 WeakPolarHBondContact O-CE2 3.31Å; K126-Y128 PolarHBondContact O-N 3.32Å; K126-Y128 VanDerWaalsContact O-N 3.13Å
127	Q	85.5	Confident	89.6	Confident	13 Å²	13	51.4 Å²	51.4	6%	0.061	25%	0.247	C	C	.	.	S	Bend	trans	62.5	6.5	-175	-58.3	176.9	-22.5	0	0	115.1	H17 C20 L123	H17-Q127 PolarHBondContact CE1-OE1 2.92Å; H17-Q127 VanDerWaalsContact CE1-OE1 3.32Å; C20-Q127 PolarHBondContact O-NE2 2.65Å; L123-Q127 WeakPolarHBondContact O-CA 3.45Å; L123-Q127 PolarHBondContact O-N 3.18Å
128	Y	83.7	Confident	89.4	Confident	39 Å²	39	55 Å²	55	15%	0.153	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-127.5	144.5	177.4	-54.3	-75.3	0	0	0	111.8	F12 H17 K126 F133	F12-Y128 HydrophobicContact CD1-CE1 4.48Å; F12-Y128 AromaticContact CE1-CD1 3.97Å; F12-Y128 HydrophobicContact CE1-CD1 3.97Å; F12-Y128 HydrophobicContact CE1-CD2 4.04Å; F12-Y128 AromaticContact CE1-CE1 3.54Å; F12-Y128 HydrophobicContact CE1-CE1 3.54Å; F12-Y128 AromaticContact CE1-CE2 3.68Å; F12-Y128 HydrophobicContact CE1-CE2 3.68Å; F12-Y128 HydrophobicContact CE1-CG 4.21Å; F12-Y128 AromaticContact CE1-CZ 3.42Å; F12-Y128 VanDerWaalsContact CE1-CZ 3.42Å; F12-Y128 AromaticContact CZ-CD1 3.86Å; F12-Y128 HydrophobicContact CZ-CD1 3.86Å; F12-Y128 HydrophobicContact CZ-CD2 4.21Å; F12-Y128 AromaticContact CZ-CE1 3.9Å; F12-Y128 HydrophobicContact CZ-CE1 3.9Å; F12-Y128 HydrophobicContact CZ-CE2 4.31Å; F12-Y128 HydrophobicContact CZ-CG 4.03Å; H17-Y128 PolarHBondContact CD2-OH 2.81Å; H17-Y128 AromaticContact NE2-CE2 3.54Å; H17-Y128 AromaticContact NE2-CZ 3.8Å; H17-Y128 PolarHBondContact NE2-OH 3.23Å; H17-Y128 VanDerWaalsContact NE2-OH 3.16Å; K126-Y128 WeakPolarHBondContact O-CD2 3.45Å; K126-Y128 VanDerWaalsContact O-CE2 3.28Å; K126-Y128 WeakPolarHBondContact O-CE2 3.31Å; K126-Y128 PolarHBondContact O-N 3.32Å; K126-Y128 VanDerWaalsContact O-N 3.13Å; Y128-F133 HydrophobicContact CG-CZ 4.28Å
129	D	85.3	Confident	89.3	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	25%	0.246	C	C	.	.			trans	-80.5	121.4	178.7	-164.4	-15.9	0	0	0	112.2	R119 L123 R131 L132 F133 A325	R119-D129 IonicContact CZ-OD2 3Å; R119-D129 VanDerWaalsContact CZ-OD2 3.25Å; R119-D129 IonicContact NE-OD1 3.34Å; R119-D129 PolarHBondContact NE-OD1 3.06Å; R119-D129 IonicContact NE-OD2 2.57Å; R119-D129 PolarHBondContact NE-OD2 2.98Å; R119-D129 IonicContact NH2-OD2 3.37Å; R119-D129 PolarHBondContact NH2-OD2 3.47Å; L123-D129 HydrophobicContact CD1-CB 3.92Å; L123-D129 VanDerWaalsContact CD1-N 3.35Å; D129-R131 PolarHBondContact O-N 3.4Å; D129-R131 WeakPolarHBondContact OD1-CG 3.45Å; D129-R131 PolarHBondContact OD1-N 3.28Å; D129-L132 HydrophobicContact CB-CD1 4.47Å; D129-L132 PolarHBondContact O-N 2.9Å; D129-F133 WeakPolarHBondContact O-CD2 3.32Å; D129-A325 WeakPolarHBondContact CB-O 3.17Å
130	I	86.6	Confident	89.3	Confident	36 Å²	36	51.8 Å²	51.8	19%	0.185	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-54.4	-23.1	178.4	61	170.8	0	0	0	113.7	R119 I122 L132	R119-I130 HydrophobicContact CB-CD1 4.36Å; R119-I130 HydrophobicContact CG-CG1 4.31Å; I122-I130 HydrophobicContact CB-CG2 4.07Å; I122-I130 HydrophobicContact CD1-CD1 4.37Å; I122-I130 HydrophobicContact CD1-CG2 4.11Å; I122-I130 HydrophobicContact CG2-CG2 3.42Å; I122-I130 VanDerWaalsContact CG2-CG2 3.42Å; I130-L132 VanDerWaalsContact C-N 3.25Å; I130-L132 PolarHBondContact O-N 3.1Å
131	R	85.3	Confident	89.4	Confident	1 Å²	1	55.7 Å²	55.7	0%	0.004	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-60.1	-36	177.8	-74.8	175.6	-177.9	-176.7	-1	113.1	R119 D129 F133 C139 Q142 E146	R119-R131 VanDerWaalsContact NH1-CZ 3.26Å; D129-R131 PolarHBondContact O-N 3.4Å; D129-R131 WeakPolarHBondContact OD1-CG 3.45Å; D129-R131 PolarHBondContact OD1-N 3.28Å; R131-F133 VanDerWaalsContact C-N 3.34Å; R131-C139 HydrophobicContact CB-CB 4.01Å; R131-C139 WeakPolarHBondContact O-CB 3.28Å; R131-Q142 HydrophobicContact CG-CB 4.37Å; R131-Q142 HydrophobicContact CG-CG 4.5Å; R131-E146 IonicContact CZ-OE2 3.88Å; R131-E146 VanDerWaalsContact CZ-OE2 3.32Å; R131-E146 IonicContact NH1-OE2 3.63Å; R131-E146 PolarHBondContact NH1-OE2 3.46Å; R131-E146 IonicContact NH2-OE2 3.25Å; R131-E146 PolarHBondContact NH2-OE2 3.31Å
132	L	83.9	Confident	89.3	Confident	72 Å²	72	56.2 Å²	56.2	38%	0.377	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-84.7	-10	-169.8	-59.7	176.6	0	0	0	112.9	D129 I130 R326	D129-L132 HydrophobicContact CB-CD1 4.47Å; D129-L132 PolarHBondContact O-N 2.9Å; I130-L132 VanDerWaalsContact C-N 3.25Å; I130-L132 PolarHBondContact O-N 3.1Å; L132-R326 HydrophobicContact CD1-CB 4.29Å; L132-R326 HydrophobicContact CD1-CG 3.73Å
133	F	81.5	Confident	89.3	Confident	114 Å²	114	54 Å²	54	50%	0.5	26%	0.258	S	S	.	.	S	Bend	trans	-83.6	-28.1	-173	-78	-82.4	0	0	0	115.3	F12 Y128 D129 R131	F12-F133 HydrophobicContact CE2-CE1 4.12Å; F12-F133 HydrophobicContact CE2-CZ 4.49Å; F12-F133 HydrophobicContact CZ-CE1 4.01Å; F12-F133 AromaticContact CZ-CZ 3.99Å; F12-F133 HydrophobicContact CZ-CZ 3.99Å; Y128-F133 HydrophobicContact CG-CZ 4.28Å; D129-F133 WeakPolarHBondContact O-CD2 3.32Å; R131-F133 VanDerWaalsContact C-N 3.34Å
134	Y	83.7	Confident	89.5	Confident	170 Å²	170	55.8 Å²	55.8	67%	0.667	27%	0.266	S	S	*	.	S	Bend	trans	-99.9	-78	-168.8	-69.4	-76.3	0	0	0	112.4	F138	Y134-F138 AromaticContact CD2-CD1 3.8Å; Y134-F138 HydrophobicContact CD2-CD1 3.8Å; Y134-F138 AromaticContact CD2-CE1 3.72Å; Y134-F138 HydrophobicContact CD2-CE1 3.72Å; Y134-F138 HydrophobicContact CD2-CG 4.37Å; Y134-F138 HydrophobicContact CD2-CZ 4.22Å; Y134-F138 HydrophobicContact CE2-CE1 4.33Å; Y134-F138 HydrophobicContact CG-CD1 4.31Å
135	T	90.2	Very high	89.8	Confident	78 Å²	78	57 Å²	57	48%	0.479	28%	0.275	S	S	.	.			trans	-155.3	154.6	-174.6	53.4	0	0	0	0	109	I137 F138 C139	T135-I137 PolarHBondContact O-N 3.13Å; T135-I137 WeakPolarHBondContact OG1-CG2 3.34Å; T135-F138 WeakPolarHBondContact O-CB 3.29Å; T135-F138 PolarHBondContact O-N 3.21Å; T135-F138 WeakPolarHBondContact OG1-CB 3.39Å; T135-F138 PolarHBondContact OG1-N 3.09Å; T135-C139 PolarHBondContact O-N 3.25Å; T135-C139 VanDerWaalsContact O-N 3.09Å
136	D	89.7	Confident	89.9	Confident	77 Å²	77	52.6 Å²	52.6	41%	0.412	25%	0.252	S	S	.	.	H	α-helix	trans	-54	-40.6	173	-179.4	52	0	0	0	111.3	F138 C139 R140 C211	D136-F138 PolarHBondContact O-N 3.38Å; D136-C139 WeakPolarHBondContact O-CB 3.45Å; D136-C139 PolarHBondContact O-N 3.47Å; D136-R140 WeakPolarHBondContact O-CG 3.19Å; D136-R140 PolarHBondContact O-N 3.38Å; D136-R140 IonicContact OD1-CZ 2.66Å; D136-R140 IonicContact OD1-NE 2.67Å; D136-R140 PolarHBondContact OD1-NE 3.33Å; D136-R140 IonicContact OD1-NH2 2.95Å; D136-R140 IonicContact OD2-CZ 3.37Å; D136-R140 IonicContact OD2-NE 3.25Å; D136-R140 PolarHBondContact OD2-NE 3.19Å; D136-R140 IonicContact OD2-NH2 2.78Å; D136-R140 PolarHBondContact OD2-NH2 3.44Å; D136-C211 PolarHBondContact OD1-SG 3.45Å
137	I	92.2	Very high	90.1	Very high	98 Å²	98	46.1 Å²	46.1	50%	0.503	22%	0.224	S	C	.	.	H	α-helix	trans	-63.7	-38.3	177.4	-170.4	61.2	0	0	0	112.8	T135 R140 L141	T135-I137 PolarHBondContact O-N 3.13Å; T135-I137 WeakPolarHBondContact OG1-CG2 3.34Å; I137-R140 PolarHBondContact O-N 3.23Å; I137-L141 HydrophobicContact CD1-CG 4.38Å; I137-L141 HydrophobicContact CG1-CD1 4.07Å; I137-L141 HydrophobicContact CG1-CG 4.38Å; I137-L141 WeakPolarHBondContact O-CB 3.32Å; I137-L141 VanDerWaalsContact O-CG 3.28Å; I137-L141 WeakPolarHBondContact O-CG 3.24Å; I137-L141 PolarHBondContact O-N 2.89Å
138	F	92.4	Very high	90.7	Very high	76 Å²	76	46.3 Å²	46.3	33%	0.333	23%	0.226	S	C	.	.	H	α-helix	trans	-65.3	-45.1	176.3	178.3	-98.2	0	0	0	111.2	Y134 T135 D136 R140 L141 Q142	Y134-F138 AromaticContact CD2-CD1 3.8Å; Y134-F138 HydrophobicContact CD2-CD1 3.8Å; Y134-F138 AromaticContact CD2-CE1 3.72Å; Y134-F138 HydrophobicContact CD2-CE1 3.72Å; Y134-F138 HydrophobicContact CD2-CG 4.37Å; Y134-F138 HydrophobicContact CD2-CZ 4.22Å; Y134-F138 HydrophobicContact CE2-CE1 4.33Å; Y134-F138 HydrophobicContact CG-CD1 4.31Å; T135-F138 WeakPolarHBondContact O-CB 3.29Å; T135-F138 PolarHBondContact O-N 3.21Å; T135-F138 WeakPolarHBondContact OG1-CB 3.39Å; T135-F138 PolarHBondContact OG1-N 3.09Å; D136-F138 PolarHBondContact O-N 3.38Å; F138-R140 PolarHBondContact O-N 2.84Å; F138-L141 PolarHBondContact O-N 3.3Å; F138-Q142 WeakPolarHBondContact O-CB 3.3Å; F138-Q142 PolarHBondContact O-N 3.47Å
139	C	92.4	Very high	91.3	Very high	1 Å²	1	45 Å²	45	1%	0.007	22%	0.223	C	C	.	.	H	α-helix	trans	-56.3	-49.3	174.6	165.4	0	0	0	0	111.6	R131 T135 D136 Q142 L143 C211	R131-C139 HydrophobicContact CB-CB 4.01Å; R131-C139 WeakPolarHBondContact O-CB 3.28Å; T135-C139 PolarHBondContact O-N 3.25Å; T135-C139 VanDerWaalsContact O-N 3.09Å; D136-C139 WeakPolarHBondContact O-CB 3.45Å; D136-C139 PolarHBondContact O-N 3.47Å; C139-Q142 PolarHBondContact O-N 3.35Å; C139-L143 WeakPolarHBondContact O-CB 3.48Å; C139-L143 PolarHBondContact O-N 3.49Å; C139-C211 HydrophobicContact CB-CB 4.02Å; C139-C211 WeakPolarHBondContact CB-SG 3.46Å; C139-C211 WeakPolarHBondContact SG-CB 3.23Å; C139-C211 CovalentContact SG-SG 2.04Å; C139-C211 PolarHBondContact SG-SG 2.91Å
140	R	94.2	Very high	91.8	Very high	11 Å²	11	45.1 Å²	45.1	4%	0.042	22%	0.224	C	C	.	.	H	α-helix	trans	-61.3	-45.1	177.8	-70.6	177.1	-171.6	-85.3	-3.4	113	D136 I137 F138 Q142 L143 F144 L204 A205 Q208 V210	D136-R140 WeakPolarHBondContact O-CG 3.19Å; D136-R140 PolarHBondContact O-N 3.38Å; D136-R140 IonicContact OD1-CZ 2.66Å; D136-R140 IonicContact OD1-NE 2.67Å; D136-R140 PolarHBondContact OD1-NE 3.33Å; D136-R140 IonicContact OD1-NH2 2.95Å; D136-R140 IonicContact OD2-CZ 3.37Å; D136-R140 IonicContact OD2-NE 3.25Å; D136-R140 PolarHBondContact OD2-NE 3.19Å; D136-R140 IonicContact OD2-NH2 2.78Å; D136-R140 PolarHBondContact OD2-NH2 3.44Å; I137-R140 PolarHBondContact O-N 3.23Å; F138-R140 PolarHBondContact O-N 2.84Å; R140-Q142 VanDerWaalsContact C-N 3.33Å; R140-Q142 PolarHBondContact O-N 3.43Å; R140-L143 PolarHBondContact O-N 2.9Å; R140-F144 VanDerWaalsContact O-CB 3.24Å; R140-F144 WeakPolarHBondContact O-CB 3.44Å; R140-F144 PolarHBondContact O-N 3.19Å; R140-L204 HydrophobicContact CB-CD2 4.3Å; R140-A205 PolarHBondContact NH1-O 2.85Å; R140-Q208 VanDerWaalsContact CZ-O 3.25Å; R140-Q208 PolarHBondContact NH1-O 3.42Å; R140-Q208 PolarHBondContact NH2-O 3.48Å; R140-V210 HydrophobicContact CG-CG2 3.71Å
141	L	94.9	Very high	92.3	Very high	89 Å²	89	43.4 Å²	43.4	47%	0.466	22%	0.215	S	C	.	.	H	α-helix	trans	-63.4	-40.8	177.9	-76.4	171.6	0	0	0	111.5	I137 F138 A145 L204	I137-L141 HydrophobicContact CD1-CG 4.38Å; I137-L141 HydrophobicContact CG1-CD1 4.07Å; I137-L141 HydrophobicContact CG1-CG 4.38Å; I137-L141 WeakPolarHBondContact O-CB 3.32Å; I137-L141 VanDerWaalsContact O-CG 3.28Å; I137-L141 WeakPolarHBondContact O-CG 3.24Å; I137-L141 PolarHBondContact O-N 2.89Å; F138-L141 PolarHBondContact O-N 3.3Å; L141-A145 VanDerWaalsContact O-CB 3.28Å; L141-A145 WeakPolarHBondContact O-CB 3.06Å; L141-A145 PolarHBondContact O-N 2.92Å; L141-L204 HydrophobicContact CD2-CD2 4.04Å
142	Q	94.4	Very high	92.9	Very high	16 Å²	16	44 Å²	44	8%	0.075	22%	0.219	C	C	.	.	H	α-helix	trans	-68.7	-40.8	177.7	-163.5	-166.8	-22.7	0	0	111.8	I115 R131 F138 C139 R140 A145 E146	I115-Q142 HydrophobicContact CG2-CG 4.05Å; R131-Q142 HydrophobicContact CG-CB 4.37Å; R131-Q142 HydrophobicContact CG-CG 4.5Å; F138-Q142 WeakPolarHBondContact O-CB 3.3Å; F138-Q142 PolarHBondContact O-N 3.47Å; C139-Q142 PolarHBondContact O-N 3.35Å; R140-Q142 VanDerWaalsContact C-N 3.33Å; R140-Q142 PolarHBondContact O-N 3.43Å; Q142-A145 PolarHBondContact O-N 2.92Å; Q142-E146 WeakPolarHBondContact O-CB 3.24Å; Q142-E146 PolarHBondContact O-N 3.47Å
143	L	93.3	Very high	93.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-58.5	-54.2	171.9	-86.1	165.6	0	0	0	110.6	C139 R140 A145 E146 Y147 V210 L323 T324	C139-L143 WeakPolarHBondContact O-CB 3.48Å; C139-L143 PolarHBondContact O-N 3.49Å; R140-L143 PolarHBondContact O-N 2.9Å; L143-A145 VanDerWaalsContact C-N 3.29Å; L143-A145 PolarHBondContact O-N 3.45Å; L143-E146 PolarHBondContact O-N 3.45Å; L143-Y147 HydrophobicContact CD2-CD2 4.45Å; L143-Y147 HydrophobicContact CD2-CE2 4.02Å; L143-Y147 WeakPolarHBondContact O-CD2 3.15Å; L143-Y147 PolarHBondContact O-N 3.29Å; L143-V210 HydrophobicContact CD1-CG2 4.08Å; L143-L323 HydrophobicContact CD2-CB 3.93Å; L143-L323 HydrophobicContact CD2-CD2 4.43Å; L143-T324 HydrophobicContact CD1-CG2 4.38Å
144	F	96.1	Very high	94.2	Very high	39 Å²	39	35.1 Å²	35.1	17%	0.171	18%	0.177	C	C	.	.	H	α-helix	trans	-52.7	-48.2	177.4	174.2	-98.8	0	0	0	111.6	R140 C148 I197 N200 L204	R140-F144 VanDerWaalsContact O-CB 3.24Å; R140-F144 WeakPolarHBondContact O-CB 3.44Å; R140-F144 PolarHBondContact O-N 3.19Å; F144-C148 VanDerWaalsContact CZ-SG 3.54Å; F144-C148 VanDerWaalsContact O-CB 3.27Å; F144-C148 WeakPolarHBondContact O-CB 3.46Å; F144-C148 PolarHBondContact O-N 3.09Å; F144-C148 PolarHBondContact O-SG 2.72Å; F144-I197 HydrophobicContact CZ-CG1 4.49Å; F144-I197 HydrophobicContact CZ-CG2 4.33Å; F144-N200 HydrophobicContact CD2-CB 3.76Å; F144-N200 WeakPolarHBondContact CD2-O 3.38Å; F144-N200 HydrophobicContact CE2-CB 3.79Å; F144-L204 HydrophobicContact CB-CD2 3.71Å; F144-L204 HydrophobicContact CB-CG 4.11Å; F144-L204 HydrophobicContact CD1-CD1 4.27Å; F144-L204 HydrophobicContact CD2-CD1 3.8Å; F144-L204 HydrophobicContact CD2-CD2 4.35Å; F144-L204 HydrophobicContact CD2-CG 3.83Å; F144-L204 HydrophobicContact CE1-CD1 4.43Å; F144-L204 HydrophobicContact CE2-CD1 3.98Å; F144-L204 HydrophobicContact CE2-CG 4.45Å; F144-L204 HydrophobicContact CG-CD1 3.96Å; F144-L204 HydrophobicContact CG-CD2 3.97Å; F144-L204 HydrophobicContact CG-CG 3.96Å; F144-L204 HydrophobicContact CZ-CD1 4.29Å
145	A	96.9	Very high	94.9	Very high	27 Å²	27	29.1 Å²	29.1	22%	0.223	15%	0.153	C	C	.	.	H	α-helix	trans	-68.4	-40.5	-179	0	0	0	0	0	113.1	I115 L141 Q142 L143 C149	I115-A145 HydrophobicContact CD1-CB 3.89Å; I115-A145 HydrophobicContact CG2-CB 4.47Å; L141-A145 VanDerWaalsContact O-CB 3.28Å; L141-A145 WeakPolarHBondContact O-CB 3.06Å; L141-A145 PolarHBondContact O-N 2.92Å; Q142-A145 PolarHBondContact O-N 2.92Å; L143-A145 VanDerWaalsContact C-N 3.29Å; L143-A145 PolarHBondContact O-N 3.45Å; A145-C149 WeakPolarHBondContact O-CB 3.42Å; A145-C149 PolarHBondContact O-N 2.91Å; A145-C149 PolarHBondContact O-SG 3.49Å
146	E	95.2	Very high	95.2	Very high	3 Å²	3	25.6 Å²	25.6	1%	0.014	13%	0.131	C	C	.	.	H	α-helix	trans	-58.1	-53.1	174.5	167.7	169	-165.6	0	0	110.6	I115 S116 R119 Y120 R131 Q142 L143 C149 Q150	I115-E146 HydrophobicContact CG2-CB 4.45Å; S116-E146 WeakPolarHBondContact OG-CG 3.33Å; R119-E146 IonicContact NH1-OE2 3.47Å; R119-E146 PolarHBondContact NH1-OE2 3.26Å; Y120-E146 PolarHBondContact OH-OE1 2.85Å; R131-E146 IonicContact CZ-OE2 3.88Å; R131-E146 VanDerWaalsContact CZ-OE2 3.32Å; R131-E146 IonicContact NH1-OE2 3.63Å; R131-E146 PolarHBondContact NH1-OE2 3.46Å; R131-E146 IonicContact NH2-OE2 3.25Å; R131-E146 PolarHBondContact NH2-OE2 3.31Å; Q142-E146 WeakPolarHBondContact O-CB 3.24Å; Q142-E146 PolarHBondContact O-N 3.47Å; L143-E146 PolarHBondContact O-N 3.45Å; E146-C149 PolarHBondContact O-N 2.87Å; E146-Q150 VanDerWaalsContact CG-NE2 3.34Å; E146-Q150 WeakPolarHBondContact O-CG 3.46Å; E146-Q150 PolarHBondContact O-N 2.87Å; E146-Q150 PolarHBondContact OE1-NE2 3.3Å
147	Y	95.2	Very high	95.5	Very high	8 Å²	8	22 Å²	22	3%	0.031	11%	0.112	C	C	.	.	H	α-helix	trans	-65.7	-41	-178.4	-82.7	-95.2	0	0	0	111.8	L143 C149 Q150 D151 N200 L203 F220 D224 L323	L143-Y147 HydrophobicContact CD2-CD2 4.45Å; L143-Y147 HydrophobicContact CD2-CE2 4.02Å; L143-Y147 WeakPolarHBondContact O-CD2 3.15Å; L143-Y147 PolarHBondContact O-N 3.29Å; Y147-C149 VanDerWaalsContact C-N 3.31Å; Y147-C149 PolarHBondContact O-N 3.47Å; Y147-Q150 PolarHBondContact O-N 2.97Å; Y147-D151 WeakPolarHBondContact O-CB 3.3Å; Y147-D151 VanDerWaalsContact O-CG 3.27Å; Y147-D151 PolarHBondContact O-N 2.66Å; Y147-N200 VanDerWaalsContact CB-OD1 3.3Å; Y147-N200 WeakPolarHBondContact CB-OD1 3.14Å; Y147-L203 HydrophobicContact CD2-CD1 4.01Å; Y147-L203 HydrophobicContact CG-CD1 4.16Å; Y147-F220 HydrophobicContact CD1-CZ 4.1Å; Y147-F220 AromaticContact CE1-CE1 3.98Å; Y147-F220 HydrophobicContact CE1-CE1 3.98Å; Y147-F220 HydrophobicContact CE1-CZ 4.02Å; Y147-D224 WeakPolarHBondContact CD1-OD1 3.22Å; Y147-D224 WeakPolarHBondContact CE1-OD2 3.29Å; Y147-L323 HydrophobicContact CE2-CD2 3.84Å; Y147-L323 WeakPolarHBondContact OH-CD2 3.45Å
148	C	97.8	Very high	95.8	Very high	16 Å²	16	17.8 Å²	17.8	11%	0.108	9%	0.091	C	C	.	.	H	α-helix	trans	-59.7	-41.3	175	-74.3	0	0	0	0	112.2	F144 S152 I196	F144-C148 VanDerWaalsContact CZ-SG 3.54Å; F144-C148 VanDerWaalsContact O-CB 3.27Å; F144-C148 WeakPolarHBondContact O-CB 3.46Å; F144-C148 PolarHBondContact O-N 3.09Å; F144-C148 PolarHBondContact O-SG 2.72Å; C148-S152 WeakPolarHBondContact O-CB 3.49Å; C148-S152 PolarHBondContact O-N 3.04Å; C148-S152 PolarHBondContact O-OG 3.47Å; C148-I196 HydrophobicContact CB-CG2 4.12Å
149	C	97.4	Very high	96	Very high	12 Å²	12	14.9 Å²	14.9	8%	0.081	8%	0.081	C	C	.	.	H	α-helix	trans	-69.3	-42.1	178.7	-67.8	0	0	0	0	111.9	V108 G112 A145 E146 Y147 S152 S153	V108-C149 HydrophobicContact CG1-CB 4.43Å; V108-C149 VanDerWaalsContact CG1-O 3.27Å; V108-C149 WeakPolarHBondContact CG1-O 3.24Å; G112-C149 VanDerWaalsContact CA-CB 3.47Å; A145-C149 WeakPolarHBondContact O-CB 3.42Å; A145-C149 PolarHBondContact O-N 2.91Å; A145-C149 PolarHBondContact O-SG 3.49Å; E146-C149 PolarHBondContact O-N 2.87Å; Y147-C149 VanDerWaalsContact C-N 3.31Å; Y147-C149 PolarHBondContact O-N 3.47Å; C149-S152 PolarHBondContact O-N 2.82Å; C149-S153 WeakPolarHBondContact O-CB 3.47Å; C149-S153 PolarHBondContact O-N 2.97Å
150	Q	95	Very high	96.1	Very high	4 Å²	4	15 Å²	15	2%	0.019	8%	0.082	C	C	.	.	H	α-helix	trans	-63.6	-46.7	178.2	-71.6	174.9	4.7	0	0	111.8	E146 Y147 S153 A154 F343 W344	E146-Q150 VanDerWaalsContact CG-NE2 3.34Å; E146-Q150 WeakPolarHBondContact O-CG 3.46Å; E146-Q150 PolarHBondContact O-N 2.87Å; E146-Q150 PolarHBondContact OE1-NE2 3.3Å; Y147-Q150 PolarHBondContact O-N 2.97Å; Q150-S153 PolarHBondContact O-N 2.64Å; Q150-A154 PolarHBondContact O-N 2.95Å; Q150-F343 HydrophobicContact CG-CE1 4.5Å; Q150-W344 HydrophobicContact CG-CH2 4.04Å; Q150-W344 HydrophobicContact CG-CZ2 3.67Å
151	D	97	Very high	96.1	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.9	-46.4	175.5	-71.7	-20.5	0	0	0	111.2	Y147 S153 A154 W155 I196 K199 N200 F227	Y147-D151 WeakPolarHBondContact O-CB 3.3Å; Y147-D151 VanDerWaalsContact O-CG 3.27Å; Y147-D151 PolarHBondContact O-N 2.66Å; D151-S153 VanDerWaalsContact C-N 3.28Å; D151-S153 PolarHBondContact O-N 2.85Å; D151-A154 WeakPolarHBondContact O-CB 3.32Å; D151-A154 PolarHBondContact O-N 3.22Å; D151-A154 VanDerWaalsContact O-N 3.12Å; D151-W155 VanDerWaalsContact O-CD1 3.23Å; D151-W155 PolarHBondContact O-N 3.3Å; D151-I196 HydrophobicContact CB-CD1 4.18Å; D151-I196 HydrophobicContact CB-CG1 3.99Å; D151-I196 HydrophobicContact CB-CG2 3.83Å; D151-K199 IonicContact OD1-NZ 3.21Å; D151-K199 PolarHBondContact OD1-NZ 3.46Å; D151-K199 WeakPolarHBondContact OD2-CE 3.3Å; D151-K199 IonicContact OD2-NZ 3.9Å; D151-K199 PolarHBondContact OD2-NZ 3.07Å; D151-N200 PolarHBondContact OD2-ND2 2.83Å; D151-F227 HydrophobicContact CB-CE1 4.1Å
152	S	97.7	Very high	96.2	Very high	12 Å²	12	11.3 Å²	11.3	8%	0.084	7%	0.069	C	C	.	.	H	α-helix	trans	-61.3	-39.4	-179.9	-64.3	0	0	0	0	111.4	V108 C148 C149 A154 W155 F156 I196	V108-S152 VanDerWaalsContact CG1-CB 3.45Å; C148-S152 WeakPolarHBondContact O-CB 3.49Å; C148-S152 PolarHBondContact O-N 3.04Å; C148-S152 PolarHBondContact O-OG 3.47Å; C149-S152 PolarHBondContact O-N 2.82Å; S152-A154 PolarHBondContact O-N 3.38Å; S152-W155 PolarHBondContact O-N 2.91Å; S152-F156 WeakPolarHBondContact O-CB 3.5Å; S152-F156 WeakPolarHBondContact O-CD1 3.3Å; S152-F156 WeakPolarHBondContact O-CG 3.1Å; S152-F156 PolarHBondContact O-N 2.96Å; S152-I196 WeakPolarHBondContact OG-CD1 3.42Å
153	S	96.3	Very high	96.2	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-59.7	-45.2	174.6	-168.2	0	0	0	0	111.8	D109 C149 Q150 D151 M157 R350	D109-S153 WeakPolarHBondContact OD1-CB 3.47Å; D109-S153 PolarHBondContact OD1-OG 3.46Å; C149-S153 WeakPolarHBondContact O-CB 3.47Å; C149-S153 PolarHBondContact O-N 2.97Å; Q150-S153 PolarHBondContact O-N 2.64Å; D151-S153 VanDerWaalsContact C-N 3.28Å; D151-S153 PolarHBondContact O-N 2.85Å; S153-M157 WeakPolarHBondContact O-CB 3.44Å; S153-M157 PolarHBondContact O-N 3.45Å; S153-R350 PolarHBondContact OG-NH2 3.04Å
154	A	96.1	Very high	96.2	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-62	-53.2	178.1	0	0	0	0	0	111.8	Q150 D151 S152 M157 C158 P232 Y302	Q150-A154 PolarHBondContact O-N 2.95Å; D151-A154 WeakPolarHBondContact O-CB 3.32Å; D151-A154 PolarHBondContact O-N 3.22Å; D151-A154 VanDerWaalsContact O-N 3.12Å; S152-A154 PolarHBondContact O-N 3.38Å; A154-M157 WeakPolarHBondContact O-CB 3.37Å; A154-M157 PolarHBondContact O-N 2.88Å; A154-C158 PolarHBondContact O-N 2.93Å; A154-C158 PolarHBondContact O-SG 2.49Å; A154-P232 HydrophobicContact CB-CB 4.2Å; A154-P232 HydrophobicContact CB-CG 4.07Å; A154-Y302 WeakPolarHBondContact CA-OH 3.46Å; A154-Y302 HydrophobicContact CB-CE1 4.36Å; A154-Y302 WeakPolarHBondContact CB-OH 3.3Å
155	W	98.3	Very high	96.1	Very high	44 Å²	44	13.7 Å²	13.7	17%	0.167	8%	0.078	C	C	.	.	H	α-helix	trans	-73.7	-33.9	-173.2	-78.2	98	0	0	0	112.8	D151 S152 M157 C158 A159 I196 F227 I231 L235	D151-W155 VanDerWaalsContact O-CD1 3.23Å; D151-W155 PolarHBondContact O-N 3.3Å; S152-W155 PolarHBondContact O-N 2.91Å; W155-M157 VanDerWaalsContact C-N 3.31Å; W155-C158 WeakPolarHBondContact O-CB 3.34Å; W155-C158 PolarHBondContact O-N 2.83Å; W155-A159 WeakPolarHBondContact O-CB 3.48Å; W155-A159 PolarHBondContact O-N 3.07Å; W155-I196 HydrophobicContact CB-CD1 4.21Å; W155-I196 HydrophobicContact CG-CD1 4.46Å; W155-F227 AromaticContact CD1-CE1 3.55Å; W155-F227 AromaticContact CD1-CZ 3.76Å; W155-F227 HydrophobicContact CD2-CZ 4.41Å; W155-F227 AromaticContact CE2-CE1 3.94Å; W155-F227 AromaticContact CE2-CE2 3.64Å; W155-F227 AromaticContact CE2-CZ 3.57Å; W155-F227 HydrophobicContact CH2-CE2 4.44Å; W155-F227 AromaticContact CZ2-CD2 3.69Å; W155-F227 HydrophobicContact CZ2-CD2 3.69Å; W155-F227 AromaticContact CZ2-CE2 3.48Å; W155-F227 HydrophobicContact CZ2-CE2 3.48Å; W155-F227 VanDerWaalsContact CZ2-CE2 3.48Å; W155-F227 HydrophobicContact CZ2-CG 4.3Å; W155-F227 AromaticContact CZ2-CZ 3.94Å; W155-F227 HydrophobicContact CZ2-CZ 3.94Å; W155-F227 AromaticContact NE1-CD1 3.4Å; W155-F227 AromaticContact NE1-CD2 3.94Å; W155-F227 AromaticContact NE1-CE1 3.04Å; W155-F227 AromaticContact NE1-CE2 3.61Å; W155-F227 AromaticContact NE1-CG 3.85Å; W155-F227 AromaticContact NE1-CZ 3.15Å; W155-F227 PolarHBondContact NE1-O 3.31Å; W155-I231 HydrophobicContact CH2-CG2 3.57Å; W155-I231 HydrophobicContact CZ2-CB 4.47Å; W155-I231 HydrophobicContact CZ2-CG2 3.98Å; W155-I231 HydrophobicContact CZ3-CG2 4.44Å; W155-L235 HydrophobicContact CH2-CD1 4.47Å; W155-L235 HydrophobicContact CZ3-CD1 4.05Å
156	F	97.6	Very high	96	Very high	5 Å²	5	17.8 Å²	17.8	2%	0.022	9%	0.088	C	C	.	.	H	α-helix	trans	-69.1	-33.3	173.5	-68.5	1.8	0	0	0	111.2	C104 L105 V108 S152 A159 M160 L189 C192 I193	C104-F156 HydrophobicContact CB-CD2 4Å; C104-F156 HydrophobicContact CB-CE2 3.8Å; L105-F156 HydrophobicContact CB-CB 4.4Å; L105-F156 HydrophobicContact CD1-CB 4.08Å; V108-F156 HydrophobicContact CB-CE2 4.46Å; V108-F156 HydrophobicContact CG2-CD2 4.12Å; V108-F156 HydrophobicContact CG2-CE2 3.57Å; V108-F156 HydrophobicContact CG2-CZ 4.43Å; S152-F156 WeakPolarHBondContact O-CB 3.5Å; S152-F156 WeakPolarHBondContact O-CD1 3.3Å; S152-F156 WeakPolarHBondContact O-CG 3.1Å; S152-F156 PolarHBondContact O-N 2.96Å; F156-A159 PolarHBondContact O-N 2.92Å; F156-M160 VanDerWaalsContact O-CB 3.3Å; F156-M160 WeakPolarHBondContact O-CB 3.39Å; F156-M160 PolarHBondContact O-N 3.4Å; F156-L189 HydrophobicContact CD1-CD2 3.43Å; F156-L189 VanDerWaalsContact CD1-CD2 3.43Å; F156-L189 HydrophobicContact CD2-CD2 4.04Å; F156-L189 HydrophobicContact CE1-CD2 3.4Å; F156-L189 HydrophobicContact CE2-CD2 3.99Å; F156-L189 HydrophobicContact CG-CD2 3.77Å; F156-L189 HydrophobicContact CZ-CD2 3.69Å; F156-C192 HydrophobicContact CD1-CB 4.45Å; F156-C192 HydrophobicContact CE1-CB 4.08Å; F156-I193 HydrophobicContact CE1-CG1 4.1Å; F156-I193 HydrophobicContact CZ-CD1 4.03Å; F156-I193 HydrophobicContact CZ-CG1 3.75Å
157	M	95.4	Very high	95.9	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-66.3	-40.6	171.5	-164.4	67	-139.4	0	0	111.6	L105 S153 A154 W155 M160 T161 L236 M295	L105-M157 HydrophobicContact CD2-SD 4Å; S153-M157 WeakPolarHBondContact O-CB 3.44Å; S153-M157 PolarHBondContact O-N 3.45Å; A154-M157 WeakPolarHBondContact O-CB 3.37Å; A154-M157 PolarHBondContact O-N 2.88Å; W155-M157 VanDerWaalsContact C-N 3.31Å; M157-M160 PolarHBondContact O-N 3.37Å; M157-T161 HydrophobicContact CE-CG2 3.62Å; M157-T161 WeakPolarHBondContact O-CG2 3.46Å; M157-T161 PolarHBondContact O-N 3.48Å; M157-T161 PolarHBondContact O-OG1 3.35Å; M157-L236 HydrophobicContact CB-CD2 4.31Å; M157-L236 HydrophobicContact CG-CD2 3.84Å; M157-M295 HydrophobicContact CE-SD 3.93Å
158	C	97.4	Very high	95.7	Very high	10 Å²	10	19 Å²	19	7%	0.068	10%	0.095	C	C	.	.	H	α-helix	trans	-62.3	-45.2	172.9	-64.8	0	0	0	0	111.7	A154 W155 M160 T161 G162 P232 L235	A154-C158 PolarHBondContact O-N 2.93Å; A154-C158 PolarHBondContact O-SG 2.49Å; W155-C158 WeakPolarHBondContact O-CB 3.34Å; W155-C158 PolarHBondContact O-N 2.83Å; C158-M160 VanDerWaalsContact C-N 3.31Å; C158-M160 PolarHBondContact O-N 3.36Å; C158-T161 WeakPolarHBondContact CA-OG1 3.39Å; C158-T161 PolarHBondContact O-N 3.47Å; C158-T161 PolarHBondContact O-OG1 3.46Å; C158-T161 VanDerWaalsContact O-OG1 3.04Å; C158-G162 WeakPolarHBondContact O-CA 3.44Å; C158-G162 PolarHBondContact O-N 3.22Å; C158-P232 VanDerWaalsContact SG-CA 3.53Å; C158-L235 HydrophobicContact CB-CD1 4.37Å
159	A	97.3	Very high	95.4	Very high	16 Å²	16	21.5 Å²	21.5	13%	0.132	11%	0.11	C	C	.	.	H	α-helix	trans	-61.4	-40.6	177.1	0	0	0	0	0	111.6	L101 W155 F156 E163 V188	L101-A159 HydrophobicContact CD2-CB 4.16Å; W155-A159 WeakPolarHBondContact O-CB 3.48Å; W155-A159 PolarHBondContact O-N 3.07Å; F156-A159 PolarHBondContact O-N 2.92Å; A159-E163 VanDerWaalsContact O-CB 3.3Å; A159-E163 WeakPolarHBondContact O-CB 3.08Å; A159-E163 PolarHBondContact O-N 3Å; A159-V188 HydrophobicContact CB-CG1 3.8Å
160	M	94.6	Very high	95.2	Very high	3 Å²	3	25.5 Å²	25.5	2%	0.015	13%	0.126	C	C	.	.	H	α-helix	trans	-68.8	-44.8	179.6	-164.5	-177.4	-52	0	0	112.8	L101 M102 L105 F156 M157 C158 R164 M295	L101-M160 HydrophobicContact CB-CE 4.2Å; L101-M160 HydrophobicContact CB-CG 4.46Å; M102-M160 HydrophobicContact CB-CE 4.17Å; M102-M160 HydrophobicContact CG-CE 3.5Å; M102-M160 HydrophobicContact CG-SD 3.46Å; M102-M160 WeakPolarHBondContact CG-SD 3.39Å; M102-M160 HydrophobicContact SD-SD 4.36Å; L105-M160 HydrophobicContact CB-CE 4Å; L105-M160 HydrophobicContact CD2-CE 3.52Å; L105-M160 HydrophobicContact CG-CE 4.41Å; F156-M160 VanDerWaalsContact O-CB 3.3Å; F156-M160 WeakPolarHBondContact O-CB 3.39Å; F156-M160 PolarHBondContact O-N 3.4Å; M157-M160 PolarHBondContact O-N 3.37Å; C158-M160 VanDerWaalsContact C-N 3.31Å; C158-M160 PolarHBondContact O-N 3.36Å; M160-R164 WeakPolarHBondContact O-CG 3.28Å; M160-R164 PolarHBondContact O-N 3.24Å; M160-M295 HydrophobicContact CB-SD 4.41Å; M160-M295 HydrophobicContact CG-SD 3.51Å; M160-M295 VanDerWaalsContact CG-SD 3.51Å; M160-M295 HydrophobicContact SD-CE 3.71Å; M160-M295 HydrophobicContact SD-SD 3.22Å
161	T	95.1	Very high	94.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-69.4	-39.5	176.6	48.8	0	0	0	0	112.2	M157 C158 R164 F165 L236 T239 M295 S299	M157-T161 HydrophobicContact CE-CG2 3.62Å; M157-T161 WeakPolarHBondContact O-CG2 3.46Å; M157-T161 PolarHBondContact O-N 3.48Å; M157-T161 PolarHBondContact O-OG1 3.35Å; C158-T161 WeakPolarHBondContact CA-OG1 3.39Å; C158-T161 PolarHBondContact O-N 3.47Å; C158-T161 PolarHBondContact O-OG1 3.46Å; C158-T161 VanDerWaalsContact O-OG1 3.04Å; T161-R164 PolarHBondContact O-N 3.32Å; T161-F165 WeakPolarHBondContact O-CB 3.41Å; T161-F165 PolarHBondContact O-N 3.26Å; T161-L236 HydrophobicContact CG2-CD2 3.95Å; T161-L236 WeakPolarHBondContact OG1-CD2 3.44Å; T161-T239 PolarHBondContact OG1-OG1 3.49Å; T161-M295 HydrophobicContact CG2-CB 4.15Å; T161-S299 WeakPolarHBondContact CG2-OG 3.36Å
162	G	96	Very high	94.3	Very high	23 Å²	23	34.4 Å²	34.4	24%	0.237	18%	0.182	C	C	.	.	H	α-helix	trans	-62.7	-41.8	172.7	0	0	0	0	0	113	C158 R164 F165 W166	C158-G162 WeakPolarHBondContact O-CA 3.44Å; C158-G162 PolarHBondContact O-N 3.22Å; G162-R164 VanDerWaalsContact C-N 3.33Å; G162-R164 PolarHBondContact O-N 3.14Å; G162-F165 PolarHBondContact O-N 2.93Å; G162-W166 WeakPolarHBondContact O-CB 3.46Å; G162-W166 PolarHBondContact O-N 3.03Å
163	E	95.3	Very high	94	Very high	15 Å²	15	35.5 Å²	35.5	7%	0.07	19%	0.19	C	C	.	.	H	α-helix	trans	-56.7	-48.4	172.8	-176.9	-164	-150.3	0	0	110.4	R95 S97 T98 L101 A159 W166 L167 Y175	R95-E163 IonicContact NE-OE1 3.57Å; S97-E163 WeakPolarHBondContact CB-OE1 3.47Å; S97-E163 PolarHBondContact OG-OE1 2.96Å; T98-E163 WeakPolarHBondContact CB-OE2 3.3Å; T98-E163 PolarHBondContact OG1-OE2 2.79Å; L101-E163 HydrophobicContact CD1-CB 4.16Å; L101-E163 HydrophobicContact CD1-CG 4.4Å; L101-E163 WeakPolarHBondContact CD1-OE2 3.28Å; A159-E163 VanDerWaalsContact O-CB 3.3Å; A159-E163 WeakPolarHBondContact O-CB 3.08Å; A159-E163 PolarHBondContact O-N 3Å; E163-W166 PolarHBondContact O-N 2.99Å; E163-L167 HydrophobicContact CG-CD1 4.05Å; E163-L167 HydrophobicContact CG-CG 4.48Å; E163-L167 WeakPolarHBondContact O-CB 3.27Å; E163-L167 VanDerWaalsContact O-CG 3.24Å; E163-L167 WeakPolarHBondContact O-CG 3.29Å; E163-L167 PolarHBondContact O-N 3.41Å; E163-Y175 HydrophobicContact CG-CE1 4.41Å; E163-Y175 WeakPolarHBondContact CG-OH 3.5Å; E163-Y175 PolarHBondContact OE1-OH 2.9Å
164	R	92.6	Very high	93.6	Very high	21 Å²	21	40 Å²	40	8%	0.079	22%	0.221	C	C	.	.	H	α-helix	trans	-64.3	-43.1	-179.8	-67.4	-50.2	-174.3	170.3	-0.3	112.8	T98 M160 T161 G162 L167 L168 M295	T98-R164 VanDerWaalsContact OG1-CZ 3.26Å; T98-R164 PolarHBondContact OG1-NH2 3.29Å; M160-R164 WeakPolarHBondContact O-CG 3.28Å; M160-R164 PolarHBondContact O-N 3.24Å; T161-R164 PolarHBondContact O-N 3.32Å; G162-R164 VanDerWaalsContact C-N 3.33Å; G162-R164 PolarHBondContact O-N 3.14Å; R164-L167 PolarHBondContact O-N 3.29Å; R164-L168 PolarHBondContact O-N 2.96Å; R164-M295 HydrophobicContact CG-CG 3.98Å
165	F	94.8	Very high	93.2	Very high	68 Å²	68	41.2 Å²	41.2	30%	0.298	23%	0.226	S	C	.	.	H	α-helix	trans	-60.1	-47.7	175.6	179.6	-110.9	0	0	0	111.3	T161 G162 L167 L168 V169 T239 N243 L246	T161-F165 WeakPolarHBondContact O-CB 3.41Å; T161-F165 PolarHBondContact O-N 3.26Å; G162-F165 PolarHBondContact O-N 2.93Å; F165-L167 VanDerWaalsContact C-N 3.34Å; F165-L167 PolarHBondContact O-N 2.72Å; F165-L168 PolarHBondContact O-N 2.84Å; F165-L168 VanDerWaalsContact O-N 3.16Å; F165-V169 HydrophobicContact CD1-CG2 4.3Å; F165-V169 HydrophobicContact CD2-CG2 4.13Å; F165-V169 HydrophobicContact CE1-CG2 3.89Å; F165-V169 HydrophobicContact CE2-CG2 3.69Å; F165-V169 HydrophobicContact CG-CG2 4.42Å; F165-V169 HydrophobicContact CZ-CG2 3.57Å; F165-V169 WeakPolarHBondContact O-CG2 3.42Å; F165-V169 PolarHBondContact O-N 3.32Å; F165-T239 HydrophobicContact CB-CG2 4.19Å; F165-T239 HydrophobicContact CD1-CG2 4.4Å; F165-T239 HydrophobicContact CG-CG2 4.4Å; F165-N243 WeakPolarHBondContact CA-OD1 3.31Å; F165-N243 PolarHBondContact N-OD1 3.49Å; F165-L246 HydrophobicContact CD2-CD1 3.98Å; F165-L246 HydrophobicContact CE2-CD1 3.74Å
166	W	94.6	Very high	92.6	Very high	113 Å²	113	40 Å²	40	43%	0.428	22%	0.224	S	C	.	.	H	α-helix	trans	-59.3	-42.7	177.5	-177.7	-96.4	0	0	0	112.9	G162 E163 L168 V169 K170 Y175	G162-W166 WeakPolarHBondContact O-CB 3.46Å; G162-W166 PolarHBondContact O-N 3.03Å; E163-W166 PolarHBondContact O-N 2.99Å; W166-L168 VanDerWaalsContact C-N 3.31Å; W166-L168 PolarHBondContact O-N 3.41Å; W166-V169 PolarHBondContact O-N 3.29Å; W166-K170 HydrophobicContact CH2-CD 3.87Å; W166-K170 HydrophobicContact CZ2-CD 3.69Å; W166-K170 HydrophobicContact CZ3-CD 4.35Å; W166-K170 PolarHBondContact O-N 2.96Å; W166-Y175 AromaticContact CD1-CD1 3.98Å
167	L	91.9	Very high	91.9	Very high	23 Å²	23	46 Å²	46	12%	0.12	25%	0.253	C	S	.	.	H	α-helix	trans	-64.5	-34.1	177.9	-70.4	174.6	0	0	0	112.8	R95 E163 R164 F165 Y175	R95-L167 VanDerWaalsContact NH1-CD2 3.27Å; E163-L167 HydrophobicContact CG-CD1 4.05Å; E163-L167 HydrophobicContact CG-CG 4.48Å; E163-L167 WeakPolarHBondContact O-CB 3.27Å; E163-L167 VanDerWaalsContact O-CG 3.24Å; E163-L167 WeakPolarHBondContact O-CG 3.29Å; E163-L167 PolarHBondContact O-N 3.41Å; R164-L167 PolarHBondContact O-N 3.29Å; F165-L167 VanDerWaalsContact C-N 3.34Å; F165-L167 PolarHBondContact O-N 2.72Å; L167-Y175 HydrophobicContact CD2-CD1 3.84Å; L167-Y175 HydrophobicContact CD2-CE1 3.75Å; L167-Y175 HydrophobicContact CG-CE1 4.3Å
168	L	90.7	Very high	91.6	Very high	13 Å²	13	49.6 Å²	49.6	7%	0.068	27%	0.273	C	S	.	.	H	α-helix	trans	-74.7	-38	175.2	-73.8	179.7	0	0	0	112.7	R164 F165 W166 N243 L246 V288	R164-L168 PolarHBondContact O-N 2.96Å; F165-L168 PolarHBondContact O-N 2.84Å; F165-L168 VanDerWaalsContact O-N 3.16Å; W166-L168 VanDerWaalsContact C-N 3.31Å; W166-L168 PolarHBondContact O-N 3.41Å; L168-N243 HydrophobicContact CD1-CB 4.46Å; L168-N243 WeakPolarHBondContact CD1-OD1 3.35Å; L168-L246 HydrophobicContact CB-CB 4.29Å; L168-L246 HydrophobicContact CB-CD1 3.68Å; L168-L246 HydrophobicContact CD1-CB 4.12Å; L168-V288 HydrophobicContact CD2-CG1 3.57Å; L168-V288 HydrophobicContact CG-CG1 4.45Å
169	V	92.7	Very high	91.1	Very high	69 Å²	69	54 Å²	54	42%	0.418	29%	0.291	S	S	.	.	H	α-helix	trans	-71.2	-39.1	179.2	175.4	0	0	0	0	111.4	F165 W166 P171 L246	F165-V169 HydrophobicContact CD1-CG2 4.3Å; F165-V169 HydrophobicContact CD2-CG2 4.13Å; F165-V169 HydrophobicContact CE1-CG2 3.89Å; F165-V169 HydrophobicContact CE2-CG2 3.69Å; F165-V169 HydrophobicContact CG-CG2 4.42Å; F165-V169 HydrophobicContact CZ-CG2 3.57Å; F165-V169 WeakPolarHBondContact O-CG2 3.42Å; F165-V169 PolarHBondContact O-N 3.32Å; W166-V169 PolarHBondContact O-N 3.29Å; V169-P171 VanDerWaalsContact C-CD 3.46Å; V169-P171 WeakPolarHBondContact O-CD 3.49Å; V169-L246 HydrophobicContact CG2-CD1 3.54Å
170	K	92.3	Very high	90.7	Very high	96 Å²	96	60.7 Å²	60.7	42%	0.417	32%	0.317	S	S	.	.			trans	-123.4	67.6	-175.4	-63.6	-168.5	177.6	178.4	0	112.4	W166 T172 S173 S176	W166-K170 HydrophobicContact CH2-CD 3.87Å; W166-K170 HydrophobicContact CZ2-CD 3.69Å; W166-K170 HydrophobicContact CZ3-CD 4.35Å; W166-K170 PolarHBondContact O-N 2.96Å; K170-T172 PolarHBondContact O-N 3.49Å; K170-S173 WeakPolarHBondContact O-CB 3.44Å; K170-S173 PolarHBondContact O-N 3.33Å; K170-S173 VanDerWaalsContact O-N 3.14Å; K170-S176 WeakPolarHBondContact O-CB 3.25Å
171	P	86.1	Confident	90.5	Very high	68 Å²	68	63.1 Å²	63.1	44%	0.442	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-27	-177.4	26.1	-34.9	0	0	0	113	V169 S176 M177	V169-P171 VanDerWaalsContact C-CD 3.46Å; V169-P171 WeakPolarHBondContact O-CD 3.49Å; P171-S176 WeakPolarHBondContact CA-OG 3.48Å; P171-S176 WeakPolarHBondContact O-CB 3.27Å; P171-S176 PolarHBondContact O-OG 2.96Å; P171-M177 WeakPolarHBondContact O-CE 3.25Å
172	T	88.2	Confident	90.4	Very high	124 Å²	124	64.8 Å²	64.8	76%	0.761	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-2	-179.1	54.7	0	0	0	0	114.2	K170	K170-T172 PolarHBondContact O-N 3.49Å
173	S	90.1	Very high	90.3	Very high	34 Å²	34	71.9 Å²	71.9	24%	0.238	36%	0.361	C	S	.	.	S	Bend	trans	-59.4	144	176.3	178.8	0	0	0	0	110.6	K170 Y175 S176 M177	K170-S173 WeakPolarHBondContact O-CB 3.44Å; K170-S173 PolarHBondContact O-N 3.33Å; K170-S173 VanDerWaalsContact O-N 3.14Å; S173-Y175 CarbonylContact O-C 3.59Å; S173-Y175 PolarHBondContact O-N 3.37Å; S173-Y175 VanDerWaalsContact O-N 3.13Å; S173-Y175 PolarHBondContact OG-N 2.88Å; S173-S176 WeakPolarHBondContact O-CA 3.44Å; S173-S176 WeakPolarHBondContact O-CB 3.41Å; S173-S176 PolarHBondContact O-N 3.46Å; S173-M177 PolarHBondContact O-N 2.87Å
174	S	88.9	Confident	90.3	Very high	94 Å²	94	73.2 Å²	73.2	66%	0.657	37%	0.371	S	S	*	.	H	α-helix	trans	-50.1	-39.7	173.7	176.4	0	0	0	0	111.9	M177 N178	S174-M177 PolarHBondContact O-N 3.5Å; S174-N178 WeakPolarHBondContact O-CB 3.49Å; S174-N178 PolarHBondContact O-N 3.33Å
175	Y	88.1	Confident	90.4	Very high	27 Å²	27	72.4 Å²	72.4	11%	0.106	37%	0.369	C	S	.	.	H	α-helix	trans	-61.5	-48.9	172.2	177.2	-115.2	0	0	0	112	R95 S97 E163 W166 L167 S173 M177 N178 Q181 P184	R95-Y175 VanDerWaalsContact CZ-O 3.23Å; R95-Y175 PolarHBondContact NH1-O 3.19Å; R95-Y175 VanDerWaalsContact NH2-CZ 3.33Å; R95-Y175 PolarHBondContact NH2-O 3.48Å; S97-Y175 PolarHBondContact OG-OH 3.26Å; E163-Y175 HydrophobicContact CG-CE1 4.41Å; E163-Y175 WeakPolarHBondContact CG-OH 3.5Å; E163-Y175 PolarHBondContact OE1-OH 2.9Å; W166-Y175 AromaticContact CD1-CD1 3.98Å; L167-Y175 HydrophobicContact CD2-CD1 3.84Å; L167-Y175 HydrophobicContact CD2-CE1 3.75Å; L167-Y175 HydrophobicContact CG-CE1 4.3Å; S173-Y175 CarbonylContact O-C 3.59Å; S173-Y175 PolarHBondContact O-N 3.37Å; S173-Y175 VanDerWaalsContact O-N 3.13Å; S173-Y175 PolarHBondContact OG-N 2.88Å; Y175-M177 VanDerWaalsContact C-N 3.33Å; Y175-M177 PolarHBondContact O-N 3.28Å; Y175-N178 PolarHBondContact O-N 3.3Å; Y175-Q181 HydrophobicContact CD2-CB 4.44Å; Y175-Q181 HydrophobicContact CD2-CG 4.46Å; Y175-P184 HydrophobicContact CD2-CB 4.14Å; Y175-P184 HydrophobicContact CD2-CG 3.6Å; Y175-P184 HydrophobicContact CE2-CB 3.82Å; Y175-P184 HydrophobicContact CE2-CG 3.67Å
176	S	84.3	Confident	90.6	Very high	19 Å²	19	71 Å²	71	13%	0.133	37%	0.37	C	S	.	.	H	α-helix	trans	-59.6	-42.6	178.9	179.7	0	0	0	0	112.5	R95 K170 P171 S173	R95-S176 PolarHBondContact NH1-O 3.22Å; K170-S176 WeakPolarHBondContact O-CB 3.25Å; P171-S176 WeakPolarHBondContact CA-OG 3.48Å; P171-S176 WeakPolarHBondContact O-CB 3.27Å; P171-S176 PolarHBondContact O-OG 2.96Å; S173-S176 WeakPolarHBondContact O-CA 3.44Å; S173-S176 WeakPolarHBondContact O-CB 3.41Å; S173-S176 PolarHBondContact O-N 3.46Å
177	M	84.2	Confident	90.7	Very high	129 Å²	129	70.4 Å²	70.4	64%	0.635	38%	0.375	S	S	*	.	H	α-helix	trans	-68.3	-37.5	-179.2	-64.4	-71.9	80.3	0	0	113	P171 S173 S174 Y175 K179	P171-M177 WeakPolarHBondContact O-CE 3.25Å; S173-M177 PolarHBondContact O-N 2.87Å; S174-M177 PolarHBondContact O-N 3.5Å; Y175-M177 VanDerWaalsContact C-N 3.33Å; Y175-M177 PolarHBondContact O-N 3.28Å; M177-K179 PolarHBondContact O-N 3.48Å
178	N	88.5	Confident	91	Very high	76 Å²	76	72.4 Å²	72.4	41%	0.406	39%	0.387	S	S	.	.			trans	-89.4	90	-178.9	-167.2	-12.3	0	0	0	112.6	R95 S174 Y175 K180 Q181	R95-N178 PolarHBondContact NH2-O 3.21Å; S174-N178 WeakPolarHBondContact O-CB 3.49Å; S174-N178 PolarHBondContact O-N 3.33Å; Y175-N178 PolarHBondContact O-N 3.3Å; N178-K180 PolarHBondContact O-N 3.35Å; N178-K180 VanDerWaalsContact O-N 3.08Å; N178-K180 PolarHBondContact OD1-N 3.29Å; N178-Q181 HydrophobicContact CB-CB 4.04Å; N178-Q181 WeakPolarHBondContact O-CB 3Å; N178-Q181 PolarHBondContact O-N 2.85Å
179	K	86.2	Confident	91.3	Very high	103 Å²	103	72.1 Å²	72.1	45%	0.448	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-19.7	178.2	-67.9	-173.4	176.6	-175	0	114.8	S92 R95 E96 M177	S92-K179 PolarHBondContact OG-NZ 3.33Å; S92-K179 VanDerWaalsContact OG-NZ 3.17Å; R95-K179 WeakPolarHBondContact CG-O 3.38Å; E96-K179 PolarHBondContact N-O 3.01Å; M177-K179 PolarHBondContact O-N 3.48Å
180	K	89	Confident	91.6	Very high	156 Å²	156	73.3 Å²	73.3	68%	0.678	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-4.1	179.8	-61.5	-176.5	179.2	179.9	0	113	N178 I182	N178-K180 PolarHBondContact O-N 3.35Å; N178-K180 VanDerWaalsContact O-N 3.08Å; N178-K180 PolarHBondContact OD1-N 3.29Å; K180-I182 PolarHBondContact O-N 3.49Å; K180-I182 VanDerWaalsContact O-N 3.07Å
181	Q	91.2	Very high	91.9	Very high	54 Å²	54	73.1 Å²	73.1	25%	0.252	39%	0.392	S	S	.	.			trans	-78.2	100.2	-176.8	-165.5	177.8	6.4	0	0	111.1	Y175 N178 P184	Y175-Q181 HydrophobicContact CD2-CB 4.44Å; Y175-Q181 HydrophobicContact CD2-CG 4.46Å; N178-Q181 HydrophobicContact CB-CB 4.04Å; N178-Q181 WeakPolarHBondContact O-CB 3Å; N178-Q181 PolarHBondContact O-N 2.85Å; Q181-P184 HydrophobicContact CG-CG 4.42Å
182	I	92	Very high	92.5	Very high	35 Å²	35	70.7 Å²	70.7	18%	0.179	38%	0.377	C	S	.	.			trans	-85.4	-28.4	178.4	-64.4	159.7	0	0	0	112.4	E96 L100 K180 A185 A186	E96-I182 HydrophobicContact CB-CD1 3.95Å; E96-I182 HydrophobicContact CB-CG1 3.59Å; E96-I182 WeakPolarHBondContact OE2-CD1 3.25Å; L100-I182 HydrophobicContact CD2-CG2 3.55Å; K180-I182 PolarHBondContact O-N 3.49Å; K180-I182 VanDerWaalsContact O-N 3.07Å; I182-A185 PolarHBondContact O-N 3.45Å; I182-A185 VanDerWaalsContact O-N 3.09Å; I182-A186 HydrophobicContact CG2-CB 4.25Å; I182-A186 PolarHBondContact O-N 3.43Å
183	K	95	Very high	93	Very high	173 Å²	173	68 Å²	68	75%	0.752	36%	0.357	S	S	*	.	H	α-helix	trans	-49.3	-47.2	-167.8	-65.4	-176.4	178	-176.2	0	114.2	A185 A186 L187	K183-A185 PolarHBondContact O-N 3.33Å; K183-A186 PolarHBondContact O-N 3.37Å; K183-L187 WeakPolarHBondContact O-CB 3.03Å; K183-L187 PolarHBondContact O-N 2.98Å
184	P	95	Very high	93.4	Very high	42 Å²	42	71.4 Å²	71.4	27%	0.273	37%	0.372	S	S	.	.	H	α-helix	trans	-64	-41.4	-178.4	-26.2	38.7	0	0	0	113.3	Y175 Q181 L187 V188	Y175-P184 HydrophobicContact CD2-CB 4.14Å; Y175-P184 HydrophobicContact CD2-CG 3.6Å; Y175-P184 HydrophobicContact CE2-CB 3.82Å; Y175-P184 HydrophobicContact CE2-CG 3.67Å; Q181-P184 HydrophobicContact CG-CG 4.42Å; P184-L187 PolarHBondContact O-N 3.01Å; P184-V188 WeakPolarHBondContact O-CG2 3.13Å; P184-V188 PolarHBondContact O-N 3.32Å
185	A	95.5	Very high	93.8	Very high	4 Å²	4	70.5 Å²	70.5	3%	0.033	36%	0.362	C	S	.	.	H	α-helix	trans	-68.4	-39.6	177.9	0	0	0	0	0	111.8	L101 I182 K183 L187 V188 L189	L101-A185 HydrophobicContact CD1-CB 4.19Å; L101-A185 HydrophobicContact CD2-CB 4.44Å; L101-A185 HydrophobicContact CG-CB 4.17Å; I182-A185 PolarHBondContact O-N 3.45Å; I182-A185 VanDerWaalsContact O-N 3.09Å; K183-A185 PolarHBondContact O-N 3.33Å; A185-L187 VanDerWaalsContact C-N 3.33Å; A185-L187 PolarHBondContact O-N 3.37Å; A185-V188 PolarHBondContact O-N 3.42Å; A185-L189 WeakPolarHBondContact O-CB 3.32Å; A185-L189 WeakPolarHBondContact O-CG 3.29Å; A185-L189 PolarHBondContact O-N 2.8Å
186	A	97.2	Very high	94.3	Very high	39 Å²	39	69.3 Å²	69.3	32%	0.322	36%	0.358	S	S	.	.	H	α-helix	trans	-63.2	-39.5	174.4	0	0	0	0	0	112.1	L100 I182 K183 L189 L190	L100-A186 HydrophobicContact CD2-CB 4Å; I182-A186 HydrophobicContact CG2-CB 4.25Å; I182-A186 PolarHBondContact O-N 3.43Å; K183-A186 PolarHBondContact O-N 3.37Å; A186-L189 PolarHBondContact O-N 2.88Å; A186-L190 WeakPolarHBondContact O-CB 3.46Å; A186-L190 PolarHBondContact O-N 3.37Å
187	L	97.6	Very high	95	Very high	101 Å²	101	72.3 Å²	72.3	53%	0.529	37%	0.371	S	S	.	.	H	α-helix	trans	-64.8	-45.3	175.9	-178.3	64.7	0	0	0	111.6	K183 P184 A185 L189 L190 I191	K183-L187 WeakPolarHBondContact O-CB 3.03Å; K183-L187 PolarHBondContact O-N 2.98Å; P184-L187 PolarHBondContact O-N 3.01Å; A185-L187 VanDerWaalsContact C-N 3.33Å; A185-L187 PolarHBondContact O-N 3.37Å; L187-L189 PolarHBondContact O-N 3.24Å; L187-L190 PolarHBondContact O-N 3.03Å; L187-I191 HydrophobicContact CD1-CD1 4.19Å; L187-I191 HydrophobicContact CD1-CG1 4.46Å; L187-I191 HydrophobicContact CG-CD1 3.97Å; L187-I191 VanDerWaalsContact O-CG1 3.3Å; L187-I191 WeakPolarHBondContact O-CG1 3.42Å; L187-I191 PolarHBondContact O-N 2.82Å
188	V	97.9	Very high	95.6	Very high	64 Å²	64	68.2 Å²	68.2	39%	0.388	36%	0.362	S	S	.	.	H	α-helix	trans	-60	-46.3	175.5	170.7	0	0	0	0	110.8	A159 P184 A185 L190 I191 C192	A159-V188 HydrophobicContact CB-CG1 3.8Å; P184-V188 WeakPolarHBondContact O-CG2 3.13Å; P184-V188 PolarHBondContact O-N 3.32Å; A185-V188 PolarHBondContact O-N 3.42Å; V188-L190 PolarHBondContact O-N 2.85Å; V188-I191 PolarHBondContact O-N 3.43Å; V188-C192 WeakPolarHBondContact O-CB 3.46Å; V188-C192 PolarHBondContact O-N 3.27Å; V188-C192 PolarHBondContact O-SG 2.97Å
189	L	98.2	Very high	95.9	Very high	8 Å²	8	66.1 Å²	66.1	4%	0.042	35%	0.349	C	S	.	.	H	α-helix	trans	-59.6	-45.1	176.2	-75.4	170.3	0	0	0	112	L100 L101 C104 F156 A185 A186 L187 C192 I193	L100-L189 HydrophobicContact CD2-CD1 3.98Å; L100-L189 HydrophobicContact CG-CD1 3.85Å; L101-L189 HydrophobicContact CD2-CD1 3.77Å; L101-L189 HydrophobicContact CD2-CD2 3.66Å; L101-L189 HydrophobicContact CD2-CG 3.59Å; C104-L189 HydrophobicContact CB-CD1 4.22Å; C104-L189 HydrophobicContact CB-CD2 4.3Å; F156-L189 HydrophobicContact CD1-CD2 3.43Å; F156-L189 VanDerWaalsContact CD1-CD2 3.43Å; F156-L189 HydrophobicContact CD2-CD2 4.04Å; F156-L189 HydrophobicContact CE1-CD2 3.4Å; F156-L189 HydrophobicContact CE2-CD2 3.99Å; F156-L189 HydrophobicContact CG-CD2 3.77Å; F156-L189 HydrophobicContact CZ-CD2 3.69Å; A185-L189 WeakPolarHBondContact O-CB 3.32Å; A185-L189 WeakPolarHBondContact O-CG 3.29Å; A185-L189 PolarHBondContact O-N 2.8Å; A186-L189 PolarHBondContact O-N 2.88Å; L187-L189 PolarHBondContact O-N 3.24Å; L189-C192 PolarHBondContact O-N 3Å; L189-I193 WeakPolarHBondContact O-CB 3.26Å; L189-I193 WeakPolarHBondContact O-CD1 3.16Å; L189-I193 WeakPolarHBondContact O-CG1 3.42Å; L189-I193 PolarHBondContact O-N 3.29Å
190	L	98.3	Very high	96.4	Very high	94 Å²	94	61.2 Å²	61.2	49%	0.492	33%	0.328	S	S	.	.	H	α-helix	trans	-60.2	-47.1	177.8	179.9	64.6	0	0	0	111.2	A186 L187 V188 I193 L194	A186-L190 WeakPolarHBondContact O-CB 3.46Å; A186-L190 PolarHBondContact O-N 3.37Å; L187-L190 PolarHBondContact O-N 3.03Å; V188-L190 PolarHBondContact O-N 2.85Å; L190-I193 PolarHBondContact O-N 3.4Å; L190-L194 HydrophobicContact CD1-CD1 4.3Å; L190-L194 HydrophobicContact CD1-CG 4.37Å; L190-L194 HydrophobicContact CG-CD1 4.15Å; L190-L194 VanDerWaalsContact O-CG 3.31Å; L190-L194 WeakPolarHBondContact O-CG 3.36Å; L190-L194 PolarHBondContact O-N 3.27Å
191	I	98.6	Very high	96.7	Very high	91 Å²	91	56.6 Å²	56.6	47%	0.467	32%	0.315	S	S	.	.	H	α-helix	trans	-60.8	-47.8	177.3	-68	166.6	0	0	0	110.3	L187 V188 I193 L194 V195	L187-I191 HydrophobicContact CD1-CD1 4.19Å; L187-I191 HydrophobicContact CD1-CG1 4.46Å; L187-I191 HydrophobicContact CG-CD1 3.97Å; L187-I191 VanDerWaalsContact O-CG1 3.3Å; L187-I191 WeakPolarHBondContact O-CG1 3.42Å; L187-I191 PolarHBondContact O-N 2.82Å; V188-I191 PolarHBondContact O-N 3.43Å; I191-I193 PolarHBondContact O-N 3.21Å; I191-L194 PolarHBondContact O-N 3.41Å; I191-V195 HydrophobicContact CG2-CG2 4.38Å; I191-V195 VanDerWaalsContact O-CG2 3.31Å; I191-V195 WeakPolarHBondContact O-CG2 3.16Å; I191-V195 PolarHBondContact O-N 3.01Å
192	C	98.4	Very high	96.8	Very high	17 Å²	17	56.6 Å²	56.6	12%	0.115	32%	0.319	C	S	.	.	H	α-helix	trans	-57.3	-48	176.8	-71.7	0	0	0	0	111.5	F156 V188 L189 L194 V195 I196	F156-C192 HydrophobicContact CD1-CB 4.45Å; F156-C192 HydrophobicContact CE1-CB 4.08Å; V188-C192 WeakPolarHBondContact O-CB 3.46Å; V188-C192 PolarHBondContact O-N 3.27Å; V188-C192 PolarHBondContact O-SG 2.97Å; L189-C192 PolarHBondContact O-N 3Å; C192-L194 PolarHBondContact O-N 3.3Å; C192-V195 PolarHBondContact O-N 2.84Å; C192-I196 HydrophobicContact CB-CD1 4.47Å; C192-I196 WeakPolarHBondContact O-CB 3.35Å; C192-I196 VanDerWaalsContact O-CD1 3.31Å; C192-I196 WeakPolarHBondContact O-CD1 2.95Å; C192-I196 WeakPolarHBondContact O-CG1 3.41Å; C192-I196 PolarHBondContact O-N 3.34Å
193	I	98.6	Very high	96.9	Very high	67 Å²	67	54.9 Å²	54.9	34%	0.344	31%	0.31	S	S	.	.	H	α-helix	trans	-60	-46.3	179.6	-70.2	164.4	0	0	0	110.9	F156 L189 L190 I191 V195 I196 I197	F156-I193 HydrophobicContact CE1-CG1 4.1Å; F156-I193 HydrophobicContact CZ-CD1 4.03Å; F156-I193 HydrophobicContact CZ-CG1 3.75Å; L189-I193 WeakPolarHBondContact O-CB 3.26Å; L189-I193 WeakPolarHBondContact O-CD1 3.16Å; L189-I193 WeakPolarHBondContact O-CG1 3.42Å; L189-I193 PolarHBondContact O-N 3.29Å; L190-I193 PolarHBondContact O-N 3.4Å; I191-I193 PolarHBondContact O-N 3.21Å; I193-V195 PolarHBondContact O-N 3.18Å; I193-I196 PolarHBondContact O-N 3.07Å; I193-I197 HydrophobicContact CG2-CD1 3.63Å; I193-I197 HydrophobicContact CG2-CG1 4.32Å; I193-I197 WeakPolarHBondContact O-CB 3.33Å; I193-I197 VanDerWaalsContact O-CG1 3.29Å; I193-I197 WeakPolarHBondContact O-CG1 3.26Å; I193-I197 PolarHBondContact O-N 3.35Å
194	L	98.6	Very high	96.8	Very high	107 Å²	107	49.8 Å²	49.8	56%	0.56	29%	0.291	S	S	*	.	H	α-helix	trans	-62.9	-42.8	179.4	-70	173.8	0	0	0	112	L190 I191 C192 G198	L190-L194 HydrophobicContact CD1-CD1 4.3Å; L190-L194 HydrophobicContact CD1-CG 4.37Å; L190-L194 HydrophobicContact CG-CD1 4.15Å; L190-L194 VanDerWaalsContact O-CG 3.31Å; L190-L194 WeakPolarHBondContact O-CG 3.36Å; L190-L194 PolarHBondContact O-N 3.27Å; I191-L194 PolarHBondContact O-N 3.41Å; C192-L194 PolarHBondContact O-N 3.3Å; L194-G198 PolarHBondContact O-N 3.49Å
195	V	98.3	Very high	96.6	Very high	74 Å²	74	49.6 Å²	49.6	45%	0.448	29%	0.293	S	S	.	.	H	α-helix	trans	-64.7	-41.5	176.7	173.7	0	0	0	0	111.1	I191 C192 I193 G198 K199 F227	I191-V195 HydrophobicContact CG2-CG2 4.38Å; I191-V195 VanDerWaalsContact O-CG2 3.31Å; I191-V195 WeakPolarHBondContact O-CG2 3.16Å; I191-V195 PolarHBondContact O-N 3.01Å; C192-V195 PolarHBondContact O-N 2.84Å; I193-V195 PolarHBondContact O-N 3.18Å; V195-G198 PolarHBondContact O-N 3.46Å; V195-K199 WeakPolarHBondContact O-CB 3.48Å; V195-K199 PolarHBondContact O-N 2.9Å; V195-F227 HydrophobicContact CG1-CE2 3.76Å; V195-F227 HydrophobicContact CG1-CZ 3.8Å
196	I	98.4	Very high	96.1	Very high	3 Å²	3	52.7 Å²	52.7	2%	0.015	33%	0.325	C	S	.	.	H	α-helix	trans	-66.6	-44.9	179.4	-69.3	164.5	0	0	0	111.2	C148 D151 S152 W155 C192 I193 G198 K199 N200 F227	C148-I196 HydrophobicContact CB-CG2 4.12Å; D151-I196 HydrophobicContact CB-CD1 4.18Å; D151-I196 HydrophobicContact CB-CG1 3.99Å; D151-I196 HydrophobicContact CB-CG2 3.83Å; S152-I196 WeakPolarHBondContact OG-CD1 3.42Å; W155-I196 HydrophobicContact CB-CD1 4.21Å; W155-I196 HydrophobicContact CG-CD1 4.46Å; C192-I196 HydrophobicContact CB-CD1 4.47Å; C192-I196 WeakPolarHBondContact O-CB 3.35Å; C192-I196 VanDerWaalsContact O-CD1 3.31Å; C192-I196 WeakPolarHBondContact O-CD1 2.95Å; C192-I196 WeakPolarHBondContact O-CG1 3.41Å; C192-I196 PolarHBondContact O-N 3.34Å; I193-I196 PolarHBondContact O-N 3.07Å; I196-G198 VanDerWaalsContact C-N 3.33Å; I196-K199 PolarHBondContact O-N 3.35Å; I196-N200 WeakPolarHBondContact O-CB 3.42Å; I196-N200 PolarHBondContact O-N 2.87Å; I196-N200 PolarHBondContact O-ND2 3.41Å; I196-F227 HydrophobicContact CG1-CE1 4Å; I196-F227 HydrophobicContact CG1-CZ 4.06Å
197	I	98	Very high	95.5	Very high	81 Å²	81	56 Å²	56	42%	0.415	35%	0.346	S	S	.	.	H	α-helix	trans	-61.8	-45.1	174.9	-70.1	171.6	0	0	0	109.6	F144 I193 N200 S201	F144-I197 HydrophobicContact CZ-CG1 4.49Å; F144-I197 HydrophobicContact CZ-CG2 4.33Å; I193-I197 HydrophobicContact CG2-CD1 3.63Å; I193-I197 HydrophobicContact CG2-CG1 4.32Å; I193-I197 WeakPolarHBondContact O-CB 3.33Å; I193-I197 VanDerWaalsContact O-CG1 3.29Å; I193-I197 WeakPolarHBondContact O-CG1 3.26Å; I193-I197 PolarHBondContact O-N 3.35Å; I197-N200 PolarHBondContact O-N 3.2Å; I197-S201 VanDerWaalsContact O-CB 3.31Å; I197-S201 WeakPolarHBondContact O-CB 3.34Å; I197-S201 PolarHBondContact O-N 2.95Å
198	G	97.2	Very high	94.9	Very high	43 Å²	43	54 Å²	54	44%	0.443	33%	0.334	S	S	.	.	H	α-helix	trans	-57.6	-51.2	176.8	0	0	0	0	0	112.4	L194 V195 I196 N200 S201	L194-G198 PolarHBondContact O-N 3.49Å; V195-G198 PolarHBondContact O-N 3.46Å; I196-G198 VanDerWaalsContact C-N 3.33Å; G198-N200 VanDerWaalsContact C-N 3.34Å; G198-N200 PolarHBondContact O-N 2.89Å; G198-S201 PolarHBondContact O-N 3.09Å; G198-S201 PolarHBondContact O-OG 3.39Å
199	K	95.5	Very high	94.4	Very high	32 Å²	32	56 Å²	56	14%	0.139	34%	0.343	C	S	.	.	H	α-helix	trans	-57.4	-46.1	178.4	-167	-145.7	79.3	169.4	0	111.7	D151 V195 I196 V202 V223 D224 F227	D151-K199 IonicContact OD1-NZ 3.21Å; D151-K199 PolarHBondContact OD1-NZ 3.46Å; D151-K199 WeakPolarHBondContact OD2-CE 3.3Å; D151-K199 IonicContact OD2-NZ 3.9Å; D151-K199 PolarHBondContact OD2-NZ 3.07Å; V195-K199 WeakPolarHBondContact O-CB 3.48Å; V195-K199 PolarHBondContact O-N 2.9Å; I196-K199 PolarHBondContact O-N 3.35Å; K199-V202 WeakPolarHBondContact O-CG1 3.29Å; K199-V223 HydrophobicContact CD-CG1 4.37Å; K199-V223 HydrophobicContact CG-CG1 4.21Å; K199-D224 IonicContact NZ-OD1 2.9Å; K199-D224 PolarHBondContact NZ-OD1 3.44Å; K199-F227 HydrophobicContact CD-CB 4.25Å; K199-F227 HydrophobicContact CD-CD1 3.54Å; K199-F227 HydrophobicContact CD-CE1 3.97Å; K199-F227 HydrophobicContact CD-CG 3.91Å
200	N	96.1	Very high	93.9	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-86	-12.9	-174	-67.5	-60.5	0	0	0	113.6	F144 Y147 D151 I196 I197 G198 V202 L203	F144-N200 HydrophobicContact CD2-CB 3.76Å; F144-N200 WeakPolarHBondContact CD2-O 3.38Å; F144-N200 HydrophobicContact CE2-CB 3.79Å; Y147-N200 VanDerWaalsContact CB-OD1 3.3Å; Y147-N200 WeakPolarHBondContact CB-OD1 3.14Å; D151-N200 PolarHBondContact OD2-ND2 2.83Å; I196-N200 WeakPolarHBondContact O-CB 3.42Å; I196-N200 PolarHBondContact O-N 2.87Å; I196-N200 PolarHBondContact O-ND2 3.41Å; I197-N200 PolarHBondContact O-N 3.2Å; G198-N200 VanDerWaalsContact C-N 3.34Å; G198-N200 PolarHBondContact O-N 2.89Å; N200-V202 PolarHBondContact O-N 3.33Å; N200-V202 VanDerWaalsContact O-N 3.08Å; N200-L203 WeakPolarHBondContact O-CB 3.34Å; N200-L203 PolarHBondContact O-N 2.92Å
201	S	95.9	Very high	93.4	Very high	59 Å²	59	51.8 Å²	51.8	41%	0.413	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-58	-24.7	178.4	67.9	0	0	0	0	113.4	I197 G198 L203 L204	I197-S201 VanDerWaalsContact O-CB 3.31Å; I197-S201 WeakPolarHBondContact O-CB 3.34Å; I197-S201 PolarHBondContact O-N 2.95Å; G198-S201 PolarHBondContact O-N 3.09Å; G198-S201 PolarHBondContact O-OG 3.39Å; S201-L203 PolarHBondContact O-N 3.34Å; S201-L204 WeakPolarHBondContact O-CB 3.39Å; S201-L204 PolarHBondContact O-N 3.38Å
202	V	93.6	Very high	92.7	Very high	54 Å²	54	48.3 Å²	48.3	33%	0.327	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-57.5	-31.3	173.3	71.6	0	0	0	0	112.9	K199 N200 L204 A205 F220	K199-V202 WeakPolarHBondContact O-CG1 3.29Å; N200-V202 PolarHBondContact O-N 3.33Å; N200-V202 VanDerWaalsContact O-N 3.08Å; V202-L204 PolarHBondContact O-N 3.34Å; V202-A205 WeakPolarHBondContact O-CB 3.32Å; V202-A205 PolarHBondContact O-N 2.69Å; V202-A205 VanDerWaalsContact O-N 3.16Å; V202-F220 HydrophobicContact CG1-CD2 3.77Å; V202-F220 HydrophobicContact CG1-CE2 3.89Å
203	L	92.3	Very high	91.3	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-70.1	-21.7	177.3	-62.1	175.3	0	0	0	112.7	Y147 N200 S201 V210 F220 L323	Y147-L203 HydrophobicContact CD2-CD1 4.01Å; Y147-L203 HydrophobicContact CG-CD1 4.16Å; N200-L203 WeakPolarHBondContact O-CB 3.34Å; N200-L203 PolarHBondContact O-N 2.92Å; S201-L203 PolarHBondContact O-N 3.34Å; L203-V210 HydrophobicContact CD2-CG1 4.42Å; L203-F220 HydrophobicContact CD1-CE2 4.21Å; L203-F220 HydrophobicContact CD1-CZ 3.91Å; L203-F220 HydrophobicContact CD2-CD2 4.37Å; L203-F220 HydrophobicContact CD2-CE1 4.26Å; L203-F220 HydrophobicContact CD2-CE2 3.78Å; L203-F220 HydrophobicContact CD2-CZ 3.73Å; L203-F220 HydrophobicContact CG-CE2 3.94Å; L203-F220 HydrophobicContact CG-CZ 4.04Å; L203-L323 HydrophobicContact CD2-CD1 4.08Å
204	L	94	Very high	90	Very high	66 Å²	66	52 Å²	52	35%	0.346	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-86.7	-11.5	175.8	-59.6	177.9	0	0	0	112.4	R140 L141 F144 S201 V202 G206	R140-L204 HydrophobicContact CB-CD2 4.3Å; L141-L204 HydrophobicContact CD2-CD2 4.04Å; F144-L204 HydrophobicContact CB-CD2 3.71Å; F144-L204 HydrophobicContact CB-CG 4.11Å; F144-L204 HydrophobicContact CD1-CD1 4.27Å; F144-L204 HydrophobicContact CD2-CD1 3.8Å; F144-L204 HydrophobicContact CD2-CD2 4.35Å; F144-L204 HydrophobicContact CD2-CG 3.83Å; F144-L204 HydrophobicContact CE1-CD1 4.43Å; F144-L204 HydrophobicContact CE2-CD1 3.98Å; F144-L204 HydrophobicContact CE2-CG 4.45Å; F144-L204 HydrophobicContact CG-CD1 3.96Å; F144-L204 HydrophobicContact CG-CD2 3.97Å; F144-L204 HydrophobicContact CG-CG 3.96Å; F144-L204 HydrophobicContact CZ-CD1 4.29Å; S201-L204 WeakPolarHBondContact O-CB 3.39Å; S201-L204 PolarHBondContact O-N 3.38Å; V202-L204 PolarHBondContact O-N 3.34Å; L204-G206 PolarHBondContact O-N 2.89Å
205	A	90.7	Very high	89.1	Confident	38 Å²	38	48 Å²	48	31%	0.314	32%	0.315	S	S	.	.			trans	-70.8	121.4	-179.7	0	0	0	0	0	110.7	R140 V202 S207	R140-A205 PolarHBondContact NH1-O 2.85Å; V202-A205 WeakPolarHBondContact O-CB 3.32Å; V202-A205 PolarHBondContact O-N 2.69Å; V202-A205 VanDerWaalsContact O-N 3.16Å; A205-S207 PolarHBondContact O-N 3.36Å; A205-S207 VanDerWaalsContact O-N 3.11Å
206	G	84.1	Confident	88.1	Confident	68 Å²	68	48.7 Å²	48.7	70%	0.701	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-2.7	-178	0	0	0	0	0	115.5	L204 Q208	L204-G206 PolarHBondContact O-N 2.89Å; G206-Q208 VanDerWaalsContact C-N 3.33Å
207	S	86.1	Confident	87.5	Confident	110 Å²	110	50.2 Å²	50.2	77%	0.769	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-20.8	-178.9	54.6	0	0	0	0	113.9	A205	A205-S207 PolarHBondContact O-N 3.36Å; A205-S207 VanDerWaalsContact O-N 3.11Å
208	Q	85.2	Confident	86.9	Confident	58 Å²	58	53.6 Å²	53.6	27%	0.271	34%	0.339	S	S	.	.	S	Bend	trans	-116.6	132.8	-178.3	-67.2	-173.1	-16.4	0	0	110.3	R140 G206 V210 Y215 D217	R140-Q208 VanDerWaalsContact CZ-O 3.25Å; R140-Q208 PolarHBondContact NH1-O 3.42Å; R140-Q208 PolarHBondContact NH2-O 3.48Å; G206-Q208 VanDerWaalsContact C-N 3.33Å; Q208-V210 VanDerWaalsContact C-N 3.25Å; Q208-V210 HydrophobicContact CB-CG1 4.09Å; Q208-V210 PolarHBondContact O-N 2.91Å; Q208-Y215 HydrophobicContact CB-CE2 3.93Å; Q208-Y215 HydrophobicContact CG-CE2 4.44Å; Q208-Y215 PolarHBondContact OE1-OH 2.88Å; Q208-D217 PolarHBondContact NE2-OD2 3.39Å
209	D	87.4	Confident	86.6	Confident	107 Å²	107	56.1 Å²	56.1	57%	0.572	35%	0.346	S	S	*	.			trans	-77.4	74.5	173.4	-176.7	15.4	0	0	0	110.6	C211 G212 Y215	D209-C211 PolarHBondContact O-N 3.38Å; D209-G212 PolarHBondContact OD1-N 3.21Å; D209-Y215 WeakPolarHBondContact O-CB 3.32Å
210	V	87.3	Confident	86.3	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	34%	0.343	C	S	.	.	S	Bend	trans	-71	-12.9	-179.4	-56.6	0	0	0	0	113.3	R140 L143 L203 Q208 Y215 L323	R140-V210 HydrophobicContact CG-CG2 3.71Å; L143-V210 HydrophobicContact CD1-CG2 4.08Å; L203-V210 HydrophobicContact CD2-CG1 4.42Å; Q208-V210 VanDerWaalsContact C-N 3.25Å; Q208-V210 HydrophobicContact CB-CG1 4.09Å; Q208-V210 PolarHBondContact O-N 2.91Å; V210-Y215 HydrophobicContact CB-CD2 4.41Å; V210-Y215 HydrophobicContact CB-CG 4.48Å; V210-Y215 HydrophobicContact CG1-CD2 4.12Å; V210-Y215 HydrophobicContact CG1-CE1 4.43Å; V210-Y215 HydrophobicContact CG1-CE2 3.8Å; V210-L323 HydrophobicContact CB-CD1 4.15Å
211	C	87.4	Confident	85.8	Confident	12 Å²	12	56.3 Å²	56.3	8%	0.081	35%	0.347	C	S	.	.	S	Bend	trans	-97.9	-17.6	-177.2	-68.9	0	0	0	0	112.7	D136 C139 D209 T324	D136-C211 PolarHBondContact OD1-SG 3.45Å; C139-C211 HydrophobicContact CB-CB 4.02Å; C139-C211 WeakPolarHBondContact CB-SG 3.46Å; C139-C211 WeakPolarHBondContact SG-CB 3.23Å; C139-C211 CovalentContact SG-SG 2.04Å; C139-C211 PolarHBondContact SG-SG 2.91Å; D209-C211 PolarHBondContact O-N 3.38Å; C211-T324 PolarHBondContact O-OG1 3Å
212	G	83.9	Confident	85.5	Confident	18 Å²	18	58.3 Å²	58.3	19%	0.186	35%	0.352	C	S	.	.	S	Bend	trans	-65.9	150.8	173	0	0	0	0	0	114.3	D209 G214 Y215	D209-G212 PolarHBondContact OD1-N 3.21Å; G212-G214 PolarHBondContact O-N 2.88Å; G212-Y215 PolarHBondContact O-N 2.9Å
213	E	69.1	Low	85.5	Confident	104 Å²	104	58.9 Å²	58.9	49%	0.486	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-12.3	-176	-86.7	152.8	-118.1	0	0	115.8	R326	E213-R326 VanDerWaalsContact CD-NH1 3.34Å; E213-R326 HydrophobicContact CG-CB 4.02Å; E213-R326 WeakPolarHBondContact OE1-CD 3.37Å; E213-R326 IonicContact OE1-CZ 3.32Å; E213-R326 IonicContact OE1-NE 3.37Å; E213-R326 PolarHBondContact OE1-NE 3.21Å; E213-R326 IonicContact OE1-NH1 3.27Å; E213-R326 PolarHBondContact OE1-NH1 3.38Å; E213-R326 IonicContact OE1-NH2 2.77Å; E213-R326 IonicContact OE2-NH1 2.59Å; E213-R326 PolarHBondContact OE2-NH1 3.4Å
214	G	70.4	Confident	85.4	Confident	57 Å²	57	59.1 Å²	59.1	59%	0.588	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.5	16.5	-175	0	0	0	0	0	114.4	G212 T216	G212-G214 PolarHBondContact O-N 2.88Å; G214-T216 WeakPolarHBondContact O-CG2 3.46Å; G214-T216 PolarHBondContact O-N 3.38Å; G214-T216 PolarHBondContact O-OG1 2.97Å
215	Y	79.4	Confident	85.2	Confident	24 Å²	24	58.1 Å²	58.1	9%	0.094	35%	0.352	C	S	.	.			trans	-58.1	114.6	177.9	178.3	-99.9	0	0	0	109.8	Q208 D209 V210 G212 D217 L323	Q208-Y215 HydrophobicContact CB-CE2 3.93Å; Q208-Y215 HydrophobicContact CG-CE2 4.44Å; Q208-Y215 PolarHBondContact OE1-OH 2.88Å; D209-Y215 WeakPolarHBondContact O-CB 3.32Å; V210-Y215 HydrophobicContact CB-CD2 4.41Å; V210-Y215 HydrophobicContact CB-CG 4.48Å; V210-Y215 HydrophobicContact CG1-CD2 4.12Å; V210-Y215 HydrophobicContact CG1-CE1 4.43Å; V210-Y215 HydrophobicContact CG1-CE2 3.8Å; G212-Y215 PolarHBondContact O-N 2.9Å; Y215-D217 HydrophobicContact CE1-CB 3.77Å; Y215-D217 HydrophobicContact CE2-CB 4.14Å; Y215-D217 VanDerWaalsContact CZ-CB 3.44Å; Y215-D217 WeakPolarHBondContact OH-CB 3.46Å; Y215-L323 HydrophobicContact CD1-CD1 3.32Å; Y215-L323 HydrophobicContact CD1-CG 3.88Å; Y215-L323 HydrophobicContact CE1-CD1 3.51Å; Y215-L323 HydrophobicContact CE1-CG 4.29Å; Y215-L323 HydrophobicContact CG-CD1 4.24Å
216	T	78.3	Confident	85.4	Confident	88 Å²	88	59.4 Å²	59.4	54%	0.54	35%	0.353	S	S	.	.			trans	-133.1	73.9	-175.6	54.7	0	0	0	0	112.5	G214 K218 N321	G214-T216 WeakPolarHBondContact O-CG2 3.46Å; G214-T216 PolarHBondContact O-N 3.38Å; G214-T216 PolarHBondContact O-OG1 2.97Å; T216-K218 PolarHBondContact O-N 2.89Å; T216-N321 HydrophobicContact CG2-CB 3.41Å; T216-N321 VanDerWaalsContact CG2-CB 3.41Å
217	D	85.7	Confident	85.9	Confident	35 Å²	35	57.5 Å²	57.5	19%	0.187	33%	0.325	C	S	.	.			trans	-93.6	94.7	172.5	-166.6	-34.5	0	0	0	111.5	Q208 Y215 T219 F220 F221	Q208-D217 PolarHBondContact NE2-OD2 3.39Å; Y215-D217 HydrophobicContact CE1-CB 3.77Å; Y215-D217 HydrophobicContact CE2-CB 4.14Å; Y215-D217 VanDerWaalsContact CZ-CB 3.44Å; Y215-D217 WeakPolarHBondContact OH-CB 3.46Å; D217-T219 PolarHBondContact O-N 3.19Å; D217-T219 VanDerWaalsContact O-N 3.15Å; D217-T219 WeakPolarHBondContact OD1-CA 3.44Å; D217-T219 WeakPolarHBondContact OD1-CB 3.37Å; D217-T219 PolarHBondContact OD1-N 2.99Å; D217-F220 HydrophobicContact CB-CB 3.92Å; D217-F220 PolarHBondContact O-N 2.77Å; D217-F220 VanDerWaalsContact O-N 3.15Å; D217-F220 PolarHBondContact OD1-N 2.82Å; D217-F221 WeakPolarHBondContact O-CD2 3.41Å; D217-F221 PolarHBondContact O-N 2.97Å; D217-F221 VanDerWaalsContact O-N 3.1Å
218	K	86.3	Confident	86.1	Confident	152 Å²	152	52.5 Å²	52.5	66%	0.661	29%	0.29	S	S	*	.	H	α-helix	trans	-55.3	-32	177.7	-66.8	-179.5	-176.4	172.9	0	112.6	T216 L222	T216-K218 PolarHBondContact O-N 2.89Å; K218-L222 VanDerWaalsContact O-CB 3.31Å; K218-L222 WeakPolarHBondContact O-CB 3.5Å; K218-L222 PolarHBondContact O-N 2.95Å
219	T	89.8	Confident	86.4	Confident	96 Å²	96	50.8 Å²	50.8	59%	0.589	28%	0.284	S	S	*	.	H	α-helix	trans	-70.4	-47.1	-179.5	-49.9	0	0	0	0	109.8	D217 F221 L222 V223	D217-T219 PolarHBondContact O-N 3.19Å; D217-T219 VanDerWaalsContact O-N 3.15Å; D217-T219 WeakPolarHBondContact OD1-CA 3.44Å; D217-T219 WeakPolarHBondContact OD1-CB 3.37Å; D217-T219 PolarHBondContact OD1-N 2.99Å; T219-F221 VanDerWaalsContact C-N 3.33Å; T219-F221 PolarHBondContact O-N 3.41Å; T219-L222 PolarHBondContact O-N 2.94Å; T219-V223 WeakPolarHBondContact O-CB 3.13Å; T219-V223 VanDerWaalsContact O-CG2 3.31Å; T219-V223 WeakPolarHBondContact O-CG2 3.09Å; T219-V223 PolarHBondContact O-N 2.87Å
220	F	89.1	Confident	86.6	Confident	16 Å²	16	50 Å²	50	7%	0.07	28%	0.279	C	S	.	.	H	α-helix	trans	-56	-48.4	174.7	177.7	-95.3	0	0	0	111.2	Y147 V202 L203 D217 L222 V223 D224 L323	Y147-F220 HydrophobicContact CD1-CZ 4.1Å; Y147-F220 AromaticContact CE1-CE1 3.98Å; Y147-F220 HydrophobicContact CE1-CE1 3.98Å; Y147-F220 HydrophobicContact CE1-CZ 4.02Å; V202-F220 HydrophobicContact CG1-CD2 3.77Å; V202-F220 HydrophobicContact CG1-CE2 3.89Å; L203-F220 HydrophobicContact CD1-CE2 4.21Å; L203-F220 HydrophobicContact CD1-CZ 3.91Å; L203-F220 HydrophobicContact CD2-CD2 4.37Å; L203-F220 HydrophobicContact CD2-CE1 4.26Å; L203-F220 HydrophobicContact CD2-CE2 3.78Å; L203-F220 HydrophobicContact CD2-CZ 3.73Å; L203-F220 HydrophobicContact CG-CE2 3.94Å; L203-F220 HydrophobicContact CG-CZ 4.04Å; D217-F220 HydrophobicContact CB-CB 3.92Å; D217-F220 PolarHBondContact O-N 2.77Å; D217-F220 VanDerWaalsContact O-N 3.15Å; D217-F220 PolarHBondContact OD1-N 2.82Å; F220-L222 PolarHBondContact O-N 3.19Å; F220-V223 PolarHBondContact O-N 3.46Å; F220-D224 WeakPolarHBondContact O-CB 3.43Å; F220-D224 PolarHBondContact O-N 2.85Å; F220-L323 HydrophobicContact CE1-CD2 3.94Å
221	F	85.8	Confident	87.1	Confident	20 Å²	20	53 Å²	53	9%	0.088	30%	0.295	C	S	.	.	H	α-helix	trans	-65.8	-38.1	179.9	-72.4	-69	0	0	0	113.5	D217 T219 D224 L225 N321 L323	D217-F221 WeakPolarHBondContact O-CD2 3.41Å; D217-F221 PolarHBondContact O-N 2.97Å; D217-F221 VanDerWaalsContact O-N 3.1Å; T219-F221 VanDerWaalsContact C-N 3.33Å; T219-F221 PolarHBondContact O-N 3.41Å; F221-D224 PolarHBondContact O-N 2.9Å; F221-L225 VanDerWaalsContact O-CB 3.3Å; F221-L225 WeakPolarHBondContact O-CB 3.5Å; F221-L225 PolarHBondContact O-N 3.16Å; F221-N321 HydrophobicContact CD2-CB 4.01Å; F221-N321 VanDerWaalsContact CD2-OD1 3.31Å; F221-N321 WeakPolarHBondContact CD2-OD1 3.09Å; F221-N321 VanDerWaalsContact CE2-C 3.46Å; F221-N321 HydrophobicContact CE2-CB 3.68Å; F221-N321 WeakPolarHBondContact CE2-O 3.43Å; F221-N321 VanDerWaalsContact CZ-CA 3.42Å; F221-N321 HydrophobicContact CZ-CB 4.33Å; F221-N321 WeakPolarHBondContact CZ-O 3.42Å; F221-L323 HydrophobicContact CE1-CD2 3.92Å; F221-L323 HydrophobicContact CZ-CD2 3.77Å; F221-L323 HydrophobicContact CZ-CG 3.91Å
222	L	90.3	Very high	87.5	Confident	101 Å²	101	52.4 Å²	52.4	53%	0.529	29%	0.291	S	S	.	.	H	α-helix	trans	-64.6	-45.9	175.6	179.8	63.2	0	0	0	111	K218 T219 F220 D224 L225 I226	K218-L222 VanDerWaalsContact O-CB 3.31Å; K218-L222 WeakPolarHBondContact O-CB 3.5Å; K218-L222 PolarHBondContact O-N 2.95Å; T219-L222 PolarHBondContact O-N 2.94Å; F220-L222 PolarHBondContact O-N 3.19Å; L222-D224 VanDerWaalsContact C-N 3.34Å; L222-L225 PolarHBondContact O-N 3.21Å; L222-I226 HydrophobicContact CD1-CD1 3.94Å; L222-I226 HydrophobicContact CD1-CG1 4.39Å; L222-I226 HydrophobicContact CG-CD1 3.96Å; L222-I226 WeakPolarHBondContact O-CB 3.5Å; L222-I226 VanDerWaalsContact O-CG1 3.28Å; L222-I226 WeakPolarHBondContact O-CG1 3.39Å; L222-I226 PolarHBondContact O-N 3.32Å
223	V	92.7	Very high	87.9	Confident	66 Å²	66	55.3 Å²	55.3	40%	0.4	30%	0.298	S	S	.	.	H	α-helix	trans	-62	-44	175.9	171.9	0	0	0	0	110.3	K199 T219 F220 I226 F227	K199-V223 HydrophobicContact CD-CG1 4.37Å; K199-V223 HydrophobicContact CG-CG1 4.21Å; T219-V223 WeakPolarHBondContact O-CB 3.13Å; T219-V223 VanDerWaalsContact O-CG2 3.31Å; T219-V223 WeakPolarHBondContact O-CG2 3.09Å; T219-V223 PolarHBondContact O-N 2.87Å; F220-V223 PolarHBondContact O-N 3.46Å; V223-I226 PolarHBondContact O-N 3.5Å; V223-F227 WeakPolarHBondContact O-CB 3.31Å; V223-F227 PolarHBondContact O-N 3.19Å
224	D	90.9	Very high	89.2	Confident	5 Å²	5	54.5 Å²	54.5	3%	0.027	30%	0.296	C	S	.	.	H	α-helix	trans	-60.8	-49	177.4	-167.4	62.8	0	0	0	111.4	Y147 K199 F220 F221 L222 I226 F227 K228	Y147-D224 WeakPolarHBondContact CD1-OD1 3.22Å; Y147-D224 WeakPolarHBondContact CE1-OD2 3.29Å; K199-D224 IonicContact NZ-OD1 2.9Å; K199-D224 PolarHBondContact NZ-OD1 3.44Å; F220-D224 WeakPolarHBondContact O-CB 3.43Å; F220-D224 PolarHBondContact O-N 2.85Å; F221-D224 PolarHBondContact O-N 2.9Å; L222-D224 VanDerWaalsContact C-N 3.34Å; D224-I226 VanDerWaalsContact C-N 3.34Å; D224-I226 PolarHBondContact O-N 3.29Å; D224-F227 PolarHBondContact O-N 3.48Å; D224-K228 WeakPolarHBondContact O-CA 3.42Å; D224-K228 WeakPolarHBondContact O-CB 3.16Å; D224-K228 PolarHBondContact O-N 3.06Å
225	L	90.3	Very high	90.4	Very high	46 Å²	46	55 Å²	55	24%	0.241	29%	0.285	C	S	.	.	I	π-helix	trans	-57.8	-45.8	177.4	-179.5	69.4	0	0	0	111.9	F221 L222 C229 L230 N310 L314	F221-L225 VanDerWaalsContact O-CB 3.3Å; F221-L225 WeakPolarHBondContact O-CB 3.5Å; F221-L225 PolarHBondContact O-N 3.16Å; L222-L225 PolarHBondContact O-N 3.21Å; L225-C229 HydrophobicContact CD1-CB 4.23Å; L225-C229 WeakPolarHBondContact O-CA 3.38Å; L225-C229 WeakPolarHBondContact O-CB 3.33Å; L225-C229 PolarHBondContact O-N 3.12Å; L225-L230 PolarHBondContact O-N 3.47Å; L225-N310 HydrophobicContact CD1-CB 4.11Å; L225-L314 HydrophobicContact CD1-CD1 4.33Å; L225-L314 HydrophobicContact CD2-CD1 4.31Å; L225-L314 HydrophobicContact CD2-CD2 3.86Å; L225-L314 HydrophobicContact CD2-CG 4.43Å
226	I	94.1	Very high	91.2	Very high	64 Å²	64	53.8 Å²	53.8	33%	0.328	28%	0.28	S	S	.	.	I	π-helix	trans	-66.5	-48.2	179.9	-68.5	169	0	0	0	110.6	L222 V223 D224 L230 I231	L222-I226 HydrophobicContact CD1-CD1 3.94Å; L222-I226 HydrophobicContact CD1-CG1 4.39Å; L222-I226 HydrophobicContact CG-CD1 3.96Å; L222-I226 WeakPolarHBondContact O-CB 3.5Å; L222-I226 VanDerWaalsContact O-CG1 3.28Å; L222-I226 WeakPolarHBondContact O-CG1 3.39Å; L222-I226 PolarHBondContact O-N 3.32Å; V223-I226 PolarHBondContact O-N 3.5Å; D224-I226 VanDerWaalsContact C-N 3.34Å; D224-I226 PolarHBondContact O-N 3.29Å; I226-L230 PolarHBondContact O-N 2.9Å; I226-I231 HydrophobicContact CG2-CD1 3.7Å; I226-I231 HydrophobicContact CG2-CG1 3.96Å; I226-I231 PolarHBondContact O-N 2.91Å
227	F	94.6	Very high	91.9	Very high	28 Å²	28	53.1 Å²	53.1	12%	0.123	27%	0.272	C	S	.	.	I	π-helix	trans	-75.2	-35.5	-172.3	-173.7	-97.3	0	0	0	113.4	D151 W155 V195 I196 K199 V223 D224 P232	D151-F227 HydrophobicContact CB-CE1 4.1Å; W155-F227 AromaticContact CD1-CE1 3.55Å; W155-F227 AromaticContact CD1-CZ 3.76Å; W155-F227 HydrophobicContact CD2-CZ 4.41Å; W155-F227 AromaticContact CE2-CE1 3.94Å; W155-F227 AromaticContact CE2-CE2 3.64Å; W155-F227 AromaticContact CE2-CZ 3.57Å; W155-F227 HydrophobicContact CH2-CE2 4.44Å; W155-F227 AromaticContact CZ2-CD2 3.69Å; W155-F227 HydrophobicContact CZ2-CD2 3.69Å; W155-F227 AromaticContact CZ2-CE2 3.48Å; W155-F227 HydrophobicContact CZ2-CE2 3.48Å; W155-F227 VanDerWaalsContact CZ2-CE2 3.48Å; W155-F227 HydrophobicContact CZ2-CG 4.3Å; W155-F227 AromaticContact CZ2-CZ 3.94Å; W155-F227 HydrophobicContact CZ2-CZ 3.94Å; W155-F227 AromaticContact NE1-CD1 3.4Å; W155-F227 AromaticContact NE1-CD2 3.94Å; W155-F227 AromaticContact NE1-CE1 3.04Å; W155-F227 AromaticContact NE1-CE2 3.61Å; W155-F227 AromaticContact NE1-CG 3.85Å; W155-F227 AromaticContact NE1-CZ 3.15Å; W155-F227 PolarHBondContact NE1-O 3.31Å; V195-F227 HydrophobicContact CG1-CE2 3.76Å; V195-F227 HydrophobicContact CG1-CZ 3.8Å; I196-F227 HydrophobicContact CG1-CE1 4Å; I196-F227 HydrophobicContact CG1-CZ 4.06Å; K199-F227 HydrophobicContact CD-CB 4.25Å; K199-F227 HydrophobicContact CD-CD1 3.54Å; K199-F227 HydrophobicContact CD-CE1 3.97Å; K199-F227 HydrophobicContact CD-CG 3.91Å; V223-F227 WeakPolarHBondContact O-CB 3.31Å; V223-F227 PolarHBondContact O-N 3.19Å; D224-F227 PolarHBondContact O-N 3.48Å; F227-P232 WeakPolarHBondContact O-CD 3.48Å; F227-P232 WeakPolarHBondContact O-CG 3.03Å
228	K	91.2	Very high	92.4	Very high	6 Å²	6	55.1 Å²	55.1	3%	0.026	29%	0.285	C	S	.	.	I	π-helix	trans	-91.7	-35.1	-177.3	-177.2	179.8	163	-174.9	0	112.8	D224 P232	D224-K228 WeakPolarHBondContact O-CA 3.42Å; D224-K228 WeakPolarHBondContact O-CB 3.16Å; D224-K228 PolarHBondContact O-N 3.06Å; K228-P232 WeakPolarHBondContact O-CG 3.37Å
229	C	90.4	Very high	92.9	Very high	22 Å²	22	48.5 Å²	48.5	15%	0.149	26%	0.258	C	S	.	.	I	π-helix	trans	-109.8	-63.6	-174.9	-170.4	0	0	0	0	112.1	L225 F233 N310	L225-C229 HydrophobicContact CD1-CB 4.23Å; L225-C229 WeakPolarHBondContact O-CA 3.38Å; L225-C229 WeakPolarHBondContact O-CB 3.33Å; L225-C229 PolarHBondContact O-N 3.12Å; C229-F233 WeakPolarHBondContact O-CB 3.3Å; C229-F233 PolarHBondContact O-N 3.46Å; C229-N310 HydrophobicContact CB-CB 4.37Å; C229-N310 PolarHBondContact SG-ND2 3.31Å
230	L	92.7	Very high	93	Very high	90 Å²	90	44.5 Å²	44.5	47%	0.471	23%	0.234	S	C	.	.	I	π-helix	trans	-65	-51.8	-166.3	-173.1	62.5	0	0	0	112.9	L225 I226 F233 I234	L225-L230 PolarHBondContact O-N 3.47Å; I226-L230 PolarHBondContact O-N 2.9Å; L230-F233 PolarHBondContact O-N 2.9Å; L230-I234 HydrophobicContact CD1-CD1 4.13Å; L230-I234 HydrophobicContact CG-CD1 4.1Å; L230-I234 VanDerWaalsContact O-CG1 3.32Å; L230-I234 WeakPolarHBondContact O-CG1 3.25Å; L230-I234 PolarHBondContact O-N 3.33Å
231	I	96	Very high	93.3	Very high	63 Å²	63	48.3 Å²	48.3	32%	0.323	25%	0.254	S	S	.	.	H	α-helix	trans	-65.6	-51.5	-179.3	-65.1	169.7	0	0	0	110.8	W155 I226 F233 I234 L235	W155-I231 HydrophobicContact CH2-CG2 3.57Å; W155-I231 HydrophobicContact CZ2-CB 4.47Å; W155-I231 HydrophobicContact CZ2-CG2 3.98Å; W155-I231 HydrophobicContact CZ3-CG2 4.44Å; I226-I231 HydrophobicContact CG2-CD1 3.7Å; I226-I231 HydrophobicContact CG2-CG1 3.96Å; I226-I231 PolarHBondContact O-N 2.91Å; I231-F233 VanDerWaalsContact C-N 3.28Å; I231-F233 PolarHBondContact O-N 3.17Å; I231-I234 PolarHBondContact O-N 3.38Å; I231-L235 HydrophobicContact CG2-CD1 3.87Å; I231-L235 HydrophobicContact CG2-CG 4.31Å; I231-L235 WeakPolarHBondContact O-CG 3.2Å; I231-L235 PolarHBondContact O-N 3.33Å
232	P	96.1	Very high	93.7	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-56.7	-40.6	175.4	-31	40.1	0	0	0	113.1	A154 C158 F227 K228 L235 L236	A154-P232 HydrophobicContact CB-CB 4.2Å; A154-P232 HydrophobicContact CB-CG 4.07Å; C158-P232 VanDerWaalsContact SG-CA 3.53Å; F227-P232 WeakPolarHBondContact O-CD 3.48Å; F227-P232 WeakPolarHBondContact O-CG 3.03Å; K228-P232 WeakPolarHBondContact O-CG 3.37Å; P232-L235 PolarHBondContact O-N 2.8Å; P232-L236 VanDerWaalsContact O-CB 3.26Å; P232-L236 WeakPolarHBondContact O-CB 3.42Å; P232-L236 WeakPolarHBondContact O-CG 3.2Å; P232-L236 PolarHBondContact O-N 3.35Å
233	F	93.2	Very high	93.8	Very high	78 Å²	78	43.2 Å²	43.2	34%	0.342	23%	0.232	S	C	.	.	H	α-helix	trans	-59.8	-50	177	177.9	-94.5	0	0	0	111.9	C229 L230 I231 L235 L236 M237 I303	C229-F233 WeakPolarHBondContact O-CB 3.3Å; C229-F233 PolarHBondContact O-N 3.46Å; L230-F233 PolarHBondContact O-N 2.9Å; I231-F233 VanDerWaalsContact C-N 3.28Å; I231-F233 PolarHBondContact O-N 3.17Å; F233-L235 VanDerWaalsContact C-N 3.34Å; F233-L235 PolarHBondContact O-N 3.06Å; F233-L236 PolarHBondContact O-N 2.89Å; F233-M237 HydrophobicContact CD1-CG 4.23Å; F233-M237 HydrophobicContact CD2-CG 4.26Å; F233-M237 HydrophobicContact CE1-CG 3.91Å; F233-M237 HydrophobicContact CE2-CG 3.95Å; F233-M237 HydrophobicContact CE2-SD 4.39Å; F233-M237 HydrophobicContact CG-CG 4.4Å; F233-M237 HydrophobicContact CZ-CG 3.76Å; F233-M237 HydrophobicContact CZ-SD 4.37Å; F233-M237 VanDerWaalsContact O-CB 3.3Å; F233-M237 WeakPolarHBondContact O-CB 3.36Å; F233-M237 VanDerWaalsContact O-CG 3.24Å; F233-M237 WeakPolarHBondContact O-CG 3.21Å; F233-M237 PolarHBondContact O-N 3.46Å; F233-I303 HydrophobicContact CD2-CD1 4.04Å; F233-I303 HydrophobicContact CD2-CG1 4.08Å; F233-I303 HydrophobicContact CD2-CG2 3.91Å; F233-I303 HydrophobicContact CE2-CD1 4.21Å; F233-I303 HydrophobicContact CE2-CG1 4.5Å; F233-I303 HydrophobicContact CE2-CG2 3.71Å
234	I	96	Very high	93.8	Very high	87 Å²	87	44.5 Å²	44.5	45%	0.446	24%	0.236	S	C	.	.	H	α-helix	trans	-60.7	-44.7	178.8	-67.2	166.7	0	0	0	110.5	L230 I231 M237 T238	L230-I234 HydrophobicContact CD1-CD1 4.13Å; L230-I234 HydrophobicContact CG-CD1 4.1Å; L230-I234 VanDerWaalsContact O-CG1 3.32Å; L230-I234 WeakPolarHBondContact O-CG1 3.25Å; L230-I234 PolarHBondContact O-N 3.33Å; I231-I234 PolarHBondContact O-N 3.38Å; I234-M237 PolarHBondContact O-N 3.29Å; I234-T238 HydrophobicContact CG2-CG2 4.22Å; I234-T238 WeakPolarHBondContact O-CB 3.45Å; I234-T238 WeakPolarHBondContact O-CG2 3.47Å; I234-T238 PolarHBondContact O-N 3.5Å; I234-T238 PolarHBondContact O-OG1 3.19Å
235	L	96.4	Very high	94	Very high	67 Å²	67	47.6 Å²	47.6	35%	0.351	26%	0.255	S	S	.	.	H	α-helix	trans	-64.9	-45.7	178.7	-70.3	176.9	0	0	0	112.2	W155 C158 I231 P232 F233 T238 T239	W155-L235 HydrophobicContact CH2-CD1 4.47Å; W155-L235 HydrophobicContact CZ3-CD1 4.05Å; C158-L235 HydrophobicContact CB-CD1 4.37Å; I231-L235 HydrophobicContact CG2-CD1 3.87Å; I231-L235 HydrophobicContact CG2-CG 4.31Å; I231-L235 WeakPolarHBondContact O-CG 3.2Å; I231-L235 PolarHBondContact O-N 3.33Å; P232-L235 PolarHBondContact O-N 2.8Å; F233-L235 VanDerWaalsContact C-N 3.34Å; F233-L235 PolarHBondContact O-N 3.06Å; L235-T238 WeakPolarHBondContact CA-OG1 3.27Å; L235-T238 PolarHBondContact O-OG1 3.47Å; L235-T238 VanDerWaalsContact O-OG1 3.09Å; L235-T239 VanDerWaalsContact O-CB 3.3Å; L235-T239 WeakPolarHBondContact O-CB 3.48Å; L235-T239 VanDerWaalsContact O-CG2 3.24Å; L235-T239 WeakPolarHBondContact O-CG2 3.12Å; L235-T239 PolarHBondContact O-N 3.12Å; L235-T239 PolarHBondContact O-OG1 3.31Å
236	L	95.2	Very high	94.1	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.8	-41.2	178.6	-69.8	174.8	0	0	0	111.3	M157 T161 P232 F233 T239 S240 Y302 I303	M157-L236 HydrophobicContact CB-CD2 4.31Å; M157-L236 HydrophobicContact CG-CD2 3.84Å; T161-L236 HydrophobicContact CG2-CD2 3.95Å; T161-L236 WeakPolarHBondContact OG1-CD2 3.44Å; P232-L236 VanDerWaalsContact O-CB 3.26Å; P232-L236 WeakPolarHBondContact O-CB 3.42Å; P232-L236 WeakPolarHBondContact O-CG 3.2Å; P232-L236 PolarHBondContact O-N 3.35Å; F233-L236 PolarHBondContact O-N 2.89Å; L236-T239 PolarHBondContact O-OG1 3.32Å; L236-S240 WeakPolarHBondContact O-CB 3.46Å; L236-S240 PolarHBondContact O-N 2.9Å; L236-S240 PolarHBondContact O-OG 2.93Å; L236-Y302 HydrophobicContact CD1-CD1 3.62Å; L236-Y302 HydrophobicContact CD1-CE1 4.07Å; L236-I303 HydrophobicContact CB-CD1 4.23Å; L236-I303 HydrophobicContact CD1-CG1 4.34Å
237	M	93.6	Very high	93.9	Very high	73 Å²	73	45.9 Å²	45.9	36%	0.36	25%	0.246	S	C	.	.	H	α-helix	trans	-66.5	-51.6	177.9	-74.2	-61.8	-68.1	0	0	111.5	F233 I234 T239 S240 I241 I303	F233-M237 HydrophobicContact CD1-CG 4.23Å; F233-M237 HydrophobicContact CD2-CG 4.26Å; F233-M237 HydrophobicContact CE1-CG 3.91Å; F233-M237 HydrophobicContact CE2-CG 3.95Å; F233-M237 HydrophobicContact CE2-SD 4.39Å; F233-M237 HydrophobicContact CG-CG 4.4Å; F233-M237 HydrophobicContact CZ-CG 3.76Å; F233-M237 HydrophobicContact CZ-SD 4.37Å; F233-M237 VanDerWaalsContact O-CB 3.3Å; F233-M237 WeakPolarHBondContact O-CB 3.36Å; F233-M237 VanDerWaalsContact O-CG 3.24Å; F233-M237 WeakPolarHBondContact O-CG 3.21Å; F233-M237 PolarHBondContact O-N 3.46Å; I234-M237 PolarHBondContact O-N 3.29Å; M237-T239 PolarHBondContact O-N 3.42Å; M237-S240 PolarHBondContact O-N 3.35Å; M237-I241 HydrophobicContact CE-CD1 4.31Å; M237-I241 WeakPolarHBondContact O-CB 3.38Å; M237-I241 VanDerWaalsContact O-CG1 3.24Å; M237-I241 WeakPolarHBondContact O-CG1 3.35Å; M237-I241 PolarHBondContact O-N 2.91Å; M237-I303 HydrophobicContact CG-CD1 4.23Å; M237-I303 HydrophobicContact SD-CD1 3.93Å
238	T	96.3	Very high	93.7	Very high	77 Å²	77	50.2 Å²	50.2	47%	0.472	27%	0.266	S	S	.	.	H	α-helix	trans	-61.7	-45.6	-179.1	52.5	0	0	0	0	111.8	I234 L235 G242	I234-T238 HydrophobicContact CG2-CG2 4.22Å; I234-T238 WeakPolarHBondContact O-CB 3.45Å; I234-T238 WeakPolarHBondContact O-CG2 3.47Å; I234-T238 PolarHBondContact O-N 3.5Å; I234-T238 PolarHBondContact O-OG1 3.19Å; L235-T238 WeakPolarHBondContact CA-OG1 3.27Å; L235-T238 PolarHBondContact O-OG1 3.47Å; L235-T238 VanDerWaalsContact O-OG1 3.09Å; T238-G242 PolarHBondContact O-N 3.46Å
239	T	95.6	Very high	93.7	Very high	13 Å²	13	58.2 Å²	58.2	8%	0.08	30%	0.296	C	S	.	.	H	α-helix	trans	-69.1	-36.3	177.4	57.9	0	0	0	0	112.5	T161 F165 L235 L236 M237 G242 N243	T161-T239 PolarHBondContact OG1-OG1 3.49Å; F165-T239 HydrophobicContact CB-CG2 4.19Å; F165-T239 HydrophobicContact CD1-CG2 4.4Å; F165-T239 HydrophobicContact CG-CG2 4.4Å; L235-T239 VanDerWaalsContact O-CB 3.3Å; L235-T239 WeakPolarHBondContact O-CB 3.48Å; L235-T239 VanDerWaalsContact O-CG2 3.24Å; L235-T239 WeakPolarHBondContact O-CG2 3.12Å; L235-T239 PolarHBondContact O-N 3.12Å; L235-T239 PolarHBondContact O-OG1 3.31Å; L236-T239 PolarHBondContact O-OG1 3.32Å; M237-T239 PolarHBondContact O-N 3.42Å; T239-G242 PolarHBondContact O-N 3.39Å; T239-N243 VanDerWaalsContact O-CB 3.27Å; T239-N243 WeakPolarHBondContact O-CB 3.47Å; T239-N243 PolarHBondContact O-N 2.85Å; T239-N243 PolarHBondContact O-ND2 2.85Å
240	S	92.7	Very high	93.6	Very high	12 Å²	12	59.5 Å²	59.5	8%	0.084	30%	0.3	C	S	.	.	H	α-helix	trans	-69.1	-43.7	177.3	-62.7	0	0	0	0	112.1	L236 M237 G242 N243 L244	L236-S240 WeakPolarHBondContact O-CB 3.46Å; L236-S240 PolarHBondContact O-N 2.9Å; L236-S240 PolarHBondContact O-OG 2.93Å; M237-S240 PolarHBondContact O-N 3.35Å; S240-G242 VanDerWaalsContact C-N 3.35Å; S240-N243 PolarHBondContact O-N 2.92Å; S240-L244 WeakPolarHBondContact O-CB 3.17Å; S240-L244 PolarHBondContact O-N 3.24Å
241	I	95	Very high	93.2	Very high	96 Å²	96	58.8 Å²	58.8	49%	0.492	30%	0.296	S	S	.	.	H	α-helix	trans	-62	-45.9	173.6	-67.7	167.1	0	0	0	109.7	M237 N243 L244 V245	M237-I241 HydrophobicContact CE-CD1 4.31Å; M237-I241 WeakPolarHBondContact O-CB 3.38Å; M237-I241 VanDerWaalsContact O-CG1 3.24Å; M237-I241 WeakPolarHBondContact O-CG1 3.35Å; M237-I241 PolarHBondContact O-N 2.91Å; I241-N243 PolarHBondContact O-N 2.88Å; I241-L244 WeakPolarHBondContact O-CB 3.4Å; I241-L244 PolarHBondContact O-N 3.02Å; I241-V245 HydrophobicContact CG2-CG2 4.39Å; I241-V245 WeakPolarHBondContact O-CG2 3.43Å; I241-V245 PolarHBondContact O-N 3.4Å
242	G	95.3	Very high	92.8	Very high	15 Å²	15	59.4 Å²	59.4	16%	0.155	30%	0.302	C	S	.	.	H	α-helix	trans	-58.1	-46.4	175.8	0	0	0	0	0	112.7	T238 T239 S240 L244 V245 L246	T238-G242 PolarHBondContact O-N 3.46Å; T239-G242 PolarHBondContact O-N 3.39Å; S240-G242 VanDerWaalsContact C-N 3.35Å; G242-L244 VanDerWaalsContact C-N 3.34Å; G242-L244 PolarHBondContact O-N 2.95Å; G242-V245 PolarHBondContact O-N 3.33Å; G242-L246 WeakPolarHBondContact O-CB 3.27Å; G242-L246 VanDerWaalsContact O-CG 3.24Å; G242-L246 WeakPolarHBondContact O-CG 3.17Å; G242-L246 PolarHBondContact O-N 3.37Å
243	N	92.4	Very high	92.4	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-59.9	-42.8	174.8	-76.2	-33.5	0	0	0	111.6	F165 L168 T239 S240 I241 M247 I296	F165-N243 WeakPolarHBondContact CA-OD1 3.31Å; F165-N243 PolarHBondContact N-OD1 3.49Å; L168-N243 HydrophobicContact CD1-CB 4.46Å; L168-N243 WeakPolarHBondContact CD1-OD1 3.35Å; T239-N243 VanDerWaalsContact O-CB 3.27Å; T239-N243 WeakPolarHBondContact O-CB 3.47Å; T239-N243 PolarHBondContact O-N 2.85Å; T239-N243 PolarHBondContact O-ND2 2.85Å; S240-N243 PolarHBondContact O-N 2.92Å; I241-N243 PolarHBondContact O-N 2.88Å; N243-M247 WeakPolarHBondContact O-CB 3.34Å; N243-M247 PolarHBondContact O-N 3.42Å; N243-I296 HydrophobicContact CB-CD1 4.16Å; N243-I296 HydrophobicContact CB-CG1 4.43Å
244	L	92.2	Very high	91.7	Very high	93 Å²	93	63.4 Å²	63.4	49%	0.487	32%	0.32	S	S	.	.	H	α-helix	trans	-63.2	-47.4	178.5	-174	70.5	0	0	0	111.7	S240 I241 G242 M247 H248 I296	S240-L244 WeakPolarHBondContact O-CB 3.17Å; S240-L244 PolarHBondContact O-N 3.24Å; I241-L244 WeakPolarHBondContact O-CB 3.4Å; I241-L244 PolarHBondContact O-N 3.02Å; G242-L244 VanDerWaalsContact C-N 3.34Å; G242-L244 PolarHBondContact O-N 2.95Å; L244-M247 HydrophobicContact CD1-CE 3.84Å; L244-M247 PolarHBondContact O-N 2.54Å; L244-H248 WeakPolarHBondContact O-CB 3.47Å; L244-H248 PolarHBondContact O-N 2.96Å; L244-I296 HydrophobicContact CB-CD1 4.33Å
245	V	95.2	Very high	90.9	Very high	70 Å²	70	62 Å²	62	42%	0.424	31%	0.312	S	S	.	.	H	α-helix	trans	-63.7	-46.2	179	172	0	0	0	0	111	I241 G242 H248 R249	I241-V245 HydrophobicContact CG2-CG2 4.39Å; I241-V245 WeakPolarHBondContact O-CG2 3.43Å; I241-V245 PolarHBondContact O-N 3.4Å; G242-V245 PolarHBondContact O-N 3.33Å; V245-H248 PolarHBondContact O-N 3.35Å; V245-R249 WeakPolarHBondContact O-CG 3.25Å; V245-R249 PolarHBondContact O-N 3.22Å
246	L	92.5	Very high	90.2	Very high	37 Å²	37	62 Å²	62	19%	0.194	32%	0.321	C	S	.	.	H	α-helix	trans	-65.6	-42.4	178.9	-69.4	172.2	0	0	0	111.6	F165 L168 V169 G242 R249 Q250	F165-L246 HydrophobicContact CD2-CD1 3.98Å; F165-L246 HydrophobicContact CE2-CD1 3.74Å; L168-L246 HydrophobicContact CB-CB 4.29Å; L168-L246 HydrophobicContact CB-CD1 3.68Å; L168-L246 HydrophobicContact CD1-CB 4.12Å; V169-L246 HydrophobicContact CG2-CD1 3.54Å; G242-L246 WeakPolarHBondContact O-CB 3.27Å; G242-L246 VanDerWaalsContact O-CG 3.24Å; G242-L246 WeakPolarHBondContact O-CG 3.17Å; G242-L246 PolarHBondContact O-N 3.37Å; L246-R249 PolarHBondContact O-N 2.86Å; L246-Q250 VanDerWaalsContact O-CB 3.22Å; L246-Q250 WeakPolarHBondContact O-CB 3.47Å; L246-Q250 VanDerWaalsContact O-CG 3.3Å; L246-Q250 WeakPolarHBondContact O-CG 3.44Å; L246-Q250 PolarHBondContact O-N 3.47Å
247	M	89.2	Confident	89.2	Confident	37 Å²	37	66.9 Å²	66.9	18%	0.182	35%	0.347	C	S	.	.	H	α-helix	trans	-61.6	-42.8	175	-177.7	-172.4	75.5	0	0	111.4	N243 L244 Q250 L251 I289	N243-M247 WeakPolarHBondContact O-CB 3.34Å; N243-M247 PolarHBondContact O-N 3.42Å; L244-M247 HydrophobicContact CD1-CE 3.84Å; L244-M247 PolarHBondContact O-N 2.54Å; M247-Q250 WeakPolarHBondContact O-CB 3.41Å; M247-Q250 PolarHBondContact O-N 2.71Å; M247-L251 WeakPolarHBondContact O-CB 3.37Å; M247-L251 PolarHBondContact O-N 3.39Å; M247-I289 HydrophobicContact CG-CB 4.48Å; M247-I289 HydrophobicContact CG-CG1 4.12Å; M247-I289 HydrophobicContact CG-CG2 4.04Å; M247-I289 HydrophobicContact SD-CG2 3.83Å
248	H	91.2	Very high	87.8	Confident	118 Å²	118	65.4 Å²	65.4	55%	0.546	34%	0.34	S	S	.	.	H	α-helix	trans	-63.6	-48.5	177.2	-177.6	70.1	0	0	0	111.5	L244 V245 Q250 L251 V252	L244-H248 WeakPolarHBondContact O-CB 3.47Å; L244-H248 PolarHBondContact O-N 2.96Å; V245-H248 PolarHBondContact O-N 3.35Å; H248-Q250 VanDerWaalsContact C-N 3.26Å; H248-Q250 PolarHBondContact O-N 2.96Å; H248-L251 PolarHBondContact O-N 2.81Å; H248-L251 VanDerWaalsContact O-N 3.12Å; H248-V252 WeakPolarHBondContact O-CG2 3.28Å; H248-V252 PolarHBondContact O-N 2.84Å
249	R	91.3	Very high	85.7	Confident	175 Å²	175	67.4 Å²	67.4	66%	0.66	35%	0.345	S	S	*	.	H	α-helix	trans	-56.1	-43	174.8	-75.5	-179.3	173.4	-169.9	-1.8	112.1	V245 L246 V252 K253	V245-R249 WeakPolarHBondContact O-CG 3.25Å; V245-R249 PolarHBondContact O-N 3.22Å; L246-R249 PolarHBondContact O-N 2.86Å; R249-V252 PolarHBondContact O-N 2.99Å; R249-K253 WeakPolarHBondContact O-CB 3.31Å; R249-K253 PolarHBondContact O-N 3.47Å
250	Q	87.2	Confident	83.7	Confident	49 Å²	49	72.3 Å²	72.3	23%	0.229	38%	0.375	C	S	.	.	H	α-helix	trans	-63.4	-42.1	176.9	-87.9	-174.1	4.6	0	0	112.7	L246 M247 H248 K253 M254 M285	L246-Q250 VanDerWaalsContact O-CB 3.22Å; L246-Q250 WeakPolarHBondContact O-CB 3.47Å; L246-Q250 VanDerWaalsContact O-CG 3.3Å; L246-Q250 WeakPolarHBondContact O-CG 3.44Å; L246-Q250 PolarHBondContact O-N 3.47Å; M247-Q250 WeakPolarHBondContact O-CB 3.41Å; M247-Q250 PolarHBondContact O-N 2.71Å; H248-Q250 VanDerWaalsContact C-N 3.26Å; H248-Q250 PolarHBondContact O-N 2.96Å; Q250-K253 PolarHBondContact O-N 3.29Å; Q250-M254 WeakPolarHBondContact O-CG 3.3Å; Q250-M254 PolarHBondContact O-N 2.99Å; Q250-M285 HydrophobicContact CB-CE 3.29Å; Q250-M285 HydrophobicContact CG-CE 3.62Å; Q250-M285 VanDerWaalsContact O-CE 3.3Å; Q250-M285 WeakPolarHBondContact O-CE 3.23Å
251	L	85.5	Confident	81.8	Confident	75 Å²	75	76.7 Å²	76.7	39%	0.393	40%	0.397	S	S	.	.	H	α-helix	trans	-67.9	-41.5	177.2	-172.1	131.2	0	0	0	111.9	M247 H248 M254 H255	M247-L251 WeakPolarHBondContact O-CB 3.37Å; M247-L251 PolarHBondContact O-N 3.39Å; H248-L251 PolarHBondContact O-N 2.81Å; H248-L251 VanDerWaalsContact O-N 3.12Å; L251-M254 HydrophobicContact CB-CE 4.47Å; L251-M254 PolarHBondContact O-N 3.33Å; L251-H255 WeakPolarHBondContact O-CB 2.99Å; L251-H255 PolarHBondContact O-N 2.96Å
252	V	87.9	Confident	79.7	Confident	75 Å²	75	80 Å²	80	46%	0.455	42%	0.415	S	S	.	.	H	α-helix	trans	-61.2	-44.6	174.3	172.1	0	0	0	0	110.8	H248 R249 H255 A256	H248-V252 WeakPolarHBondContact O-CG2 3.28Å; H248-V252 PolarHBondContact O-N 2.84Å; R249-V252 PolarHBondContact O-N 2.99Å; V252-H255 PolarHBondContact O-N 2.88Å; V252-H255 VanDerWaalsContact O-N 3.16Å; V252-A256 PolarHBondContact O-N 3.48Å
253	K	86.2	Confident	77.7	Confident	142 Å²	142	86.8 Å²	86.8	62%	0.617	44%	0.44	S	S	*	.	H	α-helix	trans	-61	-47.4	176.5	-172.6	176.6	-179.7	178.4	0	112.1	R249 Q250 H255 A256 D257	R249-K253 WeakPolarHBondContact O-CB 3.31Å; R249-K253 PolarHBondContact O-N 3.47Å; Q250-K253 PolarHBondContact O-N 3.29Å; K253-H255 PolarHBondContact O-N 2.8Å; K253-A256 PolarHBondContact O-N 3.14Å; K253-D257 VanDerWaalsContact O-CG 3.28Å; K253-D257 PolarHBondContact O-N 2.85Å
254	M	78.8	Confident	75.6	Confident	20 Å²	20	89.8 Å²	89.8	10%	0.099	47%	0.472	C	S	.	.	H	α-helix	trans	-59.5	-37.7	174.6	-76.5	-168.3	-62.3	0	0	112.2	Q250 L251 D257 H258 T282 M285 I289	Q250-M254 WeakPolarHBondContact O-CG 3.3Å; Q250-M254 PolarHBondContact O-N 2.99Å; L251-M254 HydrophobicContact CB-CE 4.47Å; L251-M254 PolarHBondContact O-N 3.33Å; M254-D257 PolarHBondContact O-N 3.4Å; M254-H258 VanDerWaalsContact O-CB 3.31Å; M254-H258 WeakPolarHBondContact O-CB 3.12Å; M254-H258 PolarHBondContact O-CD2 3.42Å; M254-H258 PolarHBondContact O-N 3.44Å; M254-T282 HydrophobicContact SD-CG2 4.06Å; M254-M285 HydrophobicContact CE-CE 3.94Å; M254-M285 HydrophobicContact CE-CG 4.31Å; M254-M285 HydrophobicContact CE-SD 4.21Å; M254-M285 HydrophobicContact CG-CE 3.55Å; M254-M285 HydrophobicContact CG-SD 3.52Å; M254-M285 VanDerWaalsContact CG-SD 3.52Å; M254-M285 HydrophobicContact SD-CB 4.29Å; M254-M285 HydrophobicContact SD-CE 3.75Å; M254-M285 HydrophobicContact SD-CG 3.81Å; M254-M285 HydrophobicContact SD-SD 3.32Å; M254-I289 HydrophobicContact CE-CD1 3.44Å; M254-I289 VanDerWaalsContact CE-CD1 3.44Å
255	H	79.1	Confident	73.3	Confident	58 Å²	58	92.6 Å²	92.6	27%	0.269	49%	0.486	S	S	.	.	H	α-helix	trans	-69.6	-40.9	-179.6	-155.5	47	0	0	0	111.4	L251 V252 K253 H258 M259	L251-H255 WeakPolarHBondContact O-CB 2.99Å; L251-H255 PolarHBondContact O-N 2.96Å; V252-H255 PolarHBondContact O-N 2.88Å; V252-H255 VanDerWaalsContact O-N 3.16Å; K253-H255 PolarHBondContact O-N 2.8Å; H255-H258 PolarHBondContact O-N 3.28Å; H255-M259 VanDerWaalsContact CD2-CE 3.5Å; H255-M259 WeakPolarHBondContact CD2-CE 3.34Å; H255-M259 WeakPolarHBondContact NE2-CE 3.21Å; H255-M259 WeakPolarHBondContact O-CA 3.43Å; H255-M259 WeakPolarHBondContact O-CB 3.28Å; H255-M259 VanDerWaalsContact O-CG 3.29Å; H255-M259 WeakPolarHBondContact O-CG 3.3Å; H255-M259 PolarHBondContact O-N 3Å
256	A	81.6	Confident	71.1	Confident	67 Å²	67	92.1 Å²	92.1	55%	0.554	49%	0.486	S	S	*	.	H	α-helix	trans	-61.3	-43.8	173.8	0	0	0	0	0	111.8	V252 K253	V252-A256 PolarHBondContact O-N 3.48Å; K253-A256 PolarHBondContact O-N 3.14Å
257	D	74.4	Confident	69.1	Low	102 Å²	102	92.8 Å²	92.8	55%	0.545	49%	0.49	S	S	.	.	H	α-helix	trans	-68.6	-36.8	-179.8	-64.8	-19.1	0	0	0	112	K253 M254 T260	K253-D257 VanDerWaalsContact O-CG 3.28Å; K253-D257 PolarHBondContact O-N 2.85Å; M254-D257 PolarHBondContact O-N 3.4Å; D257-T260 PolarHBondContact O-OG1 2.9Å; D257-T260 VanDerWaalsContact O-OG1 3.09Å
258	H	65.1	Low	67.3	Low	43 Å²	43	98.6 Å²	98.6	20%	0.199	52%	0.52	C	S	.	.	H	α-helix	trans	-97.3	-12.1	-176.4	-75.6	-66.3	0	0	0	115.6	M254 H255 T260 I261 T282	M254-H258 VanDerWaalsContact O-CB 3.31Å; M254-H258 WeakPolarHBondContact O-CB 3.12Å; M254-H258 PolarHBondContact O-CD2 3.42Å; M254-H258 PolarHBondContact O-N 3.44Å; H255-H258 PolarHBondContact O-N 3.28Å; H258-T260 PolarHBondContact O-N 3.22Å; H258-T260 VanDerWaalsContact O-N 3.14Å; H258-I261 VanDerWaalsContact O-CB 3.3Å; H258-I261 WeakPolarHBondContact O-CB 3.35Å; H258-I261 PolarHBondContact O-N 3.42Å; H258-T282 PolarHBondContact NE2-OG1 3.31Å
259	M	52	Low	65.6	Low	118 Å²	118	97.8 Å²	97.8	58%	0.581	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-11.4	175.1	-95.7	-172.7	154.8	0	0	113.1	H255 I261	H255-M259 VanDerWaalsContact CD2-CE 3.5Å; H255-M259 WeakPolarHBondContact CD2-CE 3.34Å; H255-M259 WeakPolarHBondContact NE2-CE 3.21Å; H255-M259 WeakPolarHBondContact O-CA 3.43Å; H255-M259 WeakPolarHBondContact O-CB 3.28Å; H255-M259 VanDerWaalsContact O-CG 3.29Å; H255-M259 WeakPolarHBondContact O-CG 3.3Å; H255-M259 PolarHBondContact O-N 3Å; M259-I261 PolarHBondContact O-N 3.33Å
260	T	52.3	Low	64.2	Low	117 Å²	117	91.8 Å²	91.8	72%	0.718	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-16	164.9	51.5	0	0	0	0	112.9	D257 H258	D257-T260 PolarHBondContact O-OG1 2.9Å; D257-T260 VanDerWaalsContact O-OG1 3.09Å; H258-T260 PolarHBondContact O-N 3.22Å; H258-T260 VanDerWaalsContact O-N 3.14Å
261	I	52.7	Low	63.3	Low	104 Å²	104	92.4 Å²	92.4	53%	0.533	51%	0.513	S	S	.	.	S	Bend	trans	-93.9	102.7	172.8	-51.1	174.3	0	0	0	106.8	H258 M259 K263	H258-I261 VanDerWaalsContact O-CB 3.3Å; H258-I261 WeakPolarHBondContact O-CB 3.35Å; H258-I261 PolarHBondContact O-N 3.42Å; M259-I261 PolarHBondContact O-N 3.33Å; I261-K263 PolarHBondContact O-N 2.91Å
262	N	51.1	Low	62.4	Low	164 Å²	164	95.7 Å²	95.7	88%	0.877	52%	0.52	S	S	*	.	S	Bend	trans	-53.8	37.8	-176.9	-87	-26.6	0	0	0	117.6
263	K	54.4	Low	61.7	Low	158 Å²	158	99.5 Å²	99.5	69%	0.687	53%	0.531	S	S	*	.			trans	-125	77.9	175.4	-67.5	-170.9	176.9	-172.6	0	108.9	I261	I261-K263 PolarHBondContact O-N 2.91Å
264	G	46.9	Very low	60.9	Low	64 Å²	64	96 Å²	96	66%	0.66	52%	0.516	S	S	*	.			trans	-52.2	137.7	175.8	0	0	0	0	0	113	S266	G264-S266 VanDerWaalsContact C-N 3.34Å; G264-S266 PolarHBondContact O-N 3.46Å
265	L	44.6	Very low	60.3	Low	151 Å²	151	100.7 Å²	100.7	79%	0.791	54%	0.536	S	S	*	.	S	Bend	trans	61.6	0.3	154.3	-130.1	76.2	0	0	0	121.7
266	S	48.3	Very low	59.8	Low	61 Å²	61	102.7 Å²	102.7	43%	0.427	55%	0.546	S	S	.	.			trans	-95.8	21.8	177.3	-175.2	0	0	0	0	114.2	G264 I268 T269 M270	G264-S266 VanDerWaalsContact C-N 3.34Å; G264-S266 PolarHBondContact O-N 3.46Å; S266-I268 VanDerWaalsContact C-N 3.28Å; S266-I268 PolarHBondContact O-N 2.93Å; S266-T269 WeakPolarHBondContact CA-OG1 3.42Å; S266-T269 CarbonylContact O-C 3.4Å; S266-T269 PolarHBondContact O-N 2.71Å; S266-T269 VanDerWaalsContact O-N 3.12Å; S266-T269 PolarHBondContact O-OG1 3.47Å; S266-T269 PolarHBondContact OG-OG1 2.86Å; S266-M270 PolarHBondContact O-N 3.11Å
267	I	50.5	Low	59.3	Low	51 Å²	51	108.3 Å²	108.3	26%	0.262	56%	0.558	S	S	.	*	S	Bend	trans	-66.2	-33.5	-178.8	-60.3	173	0	0	0	111.5	T269 M270 W286	I267-T269 PolarHBondContact O-N 3.26Å; I267-M270 HydrophobicContact CB-SD 4.43Å; I267-M270 HydrophobicContact CG1-CE 4.16Å; I267-M270 HydrophobicContact CG1-SD 4.31Å; I267-M270 HydrophobicContact CG2-SD 4.07Å; I267-M270 PolarHBondContact O-N 3.03Å; I267-W286 HydrophobicContact CG2-CH2 4.31Å; I267-W286 HydrophobicContact CG2-CZ2 3.49Å; I267-W286 VanDerWaalsContact CG2-CZ2 3.49Å
268	I	52.3	Low	59	Low	159 Å²	159	105 Å²	105	82%	0.815	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-31.9	176.3	-60.9	176.2	0	0	0	110.8	S266	S266-I268 VanDerWaalsContact C-N 3.28Å; S266-I268 PolarHBondContact O-N 2.93Å
269	T	56.1	Low	59.3	Low	101 Å²	101	105.6 Å²	105.6	62%	0.62	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	5.6	-179.3	30.1	0	0	0	0	114.5	S266 I267 S271	S266-T269 WeakPolarHBondContact CA-OG1 3.42Å; S266-T269 CarbonylContact O-C 3.4Å; S266-T269 PolarHBondContact O-N 2.71Å; S266-T269 VanDerWaalsContact O-N 3.12Å; S266-T269 PolarHBondContact O-OG1 3.47Å; S266-T269 PolarHBondContact OG-OG1 2.86Å; I267-T269 PolarHBondContact O-N 3.26Å; T269-S271 PolarHBondContact O-N 3.37Å
270	M	62.1	Low	60.2	Low	49 Å²	49	105.2 Å²	105.2	24%	0.241	55%	0.554	C	S	.	*			trans	-53.6	125.3	-179.7	-95.8	-179.4	170.2	0	0	111.3	S266 I267 E274 K275 L278	S266-M270 PolarHBondContact O-N 3.11Å; I267-M270 HydrophobicContact CB-SD 4.43Å; I267-M270 HydrophobicContact CG1-CE 4.16Å; I267-M270 HydrophobicContact CG1-SD 4.31Å; I267-M270 HydrophobicContact CG2-SD 4.07Å; I267-M270 PolarHBondContact O-N 3.03Å; M270-E274 WeakPolarHBondContact CA-OE2 3.05Å; M270-E274 HydrophobicContact CB-CB 4.25Å; M270-E274 HydrophobicContact CG-CB 4.06Å; M270-E274 HydrophobicContact SD-CB 4.47Å; M270-K275 HydrophobicContact CB-CG 4.18Å; M270-K275 WeakPolarHBondContact O-CE 3.3Å; M270-L278 HydrophobicContact SD-CD1 4.14Å
271	S	67.2	Low	61.1	Low	62 Å²	62	104.6 Å²	104.6	43%	0.434	55%	0.55	S	S	.	.			trans	-59.5	153.8	176.1	172.3	0	0	0	0	110.4	T269 K273 E274 K275	T269-S271 PolarHBondContact O-N 3.37Å; S271-K273 PolarHBondContact O-N 3.3Å; S271-K273 VanDerWaalsContact O-N 3.13Å; S271-K273 PolarHBondContact OG-N 3.36Å; S271-E274 PolarHBondContact N-OE2 3.47Å; S271-E274 VanDerWaalsContact N-OE2 3.09Å; S271-E274 WeakPolarHBondContact O-CA 3.5Å; S271-E274 WeakPolarHBondContact O-CB 3.44Å; S271-E274 PolarHBondContact O-N 3.05Å; S271-K275 PolarHBondContact O-N 3.45Å
272	R	67.5	Low	62.1	Low	143 Å²	143	100.1 Å²	100.1	54%	0.54	53%	0.527	S	S	.	.	H	α-helix	trans	-52.9	-35.8	175.3	-172.3	177.7	178.6	-173.8	-3.7	112	E274 K275 Q276	R272-E274 VanDerWaalsContact C-N 3.33Å; R272-K275 PolarHBondContact O-N 3.48Å; R272-Q276 WeakPolarHBondContact O-CG 3.1Å; R272-Q276 PolarHBondContact O-N 2.74Å; R272-Q276 VanDerWaalsContact O-N 3.17Å
273	K	71.7	Confident	63.1	Low	155 Å²	155	94.4 Å²	94.4	67%	0.674	50%	0.503	S	S	*	.	H	α-helix	trans	-66.5	-33.6	176.4	-68	-174.1	177.9	-177.5	0	112.3	S271 K277	S271-K273 PolarHBondContact O-N 3.3Å; S271-K273 VanDerWaalsContact O-N 3.13Å; S271-K273 PolarHBondContact OG-N 3.36Å; K273-K277 WeakPolarHBondContact O-CG 3.16Å
274	E	69.5	Low	64.1	Low	69 Å²	69	88.8 Å²	88.8	32%	0.322	49%	0.486	S	S	.	.	H	α-helix	trans	-77.1	-37.8	176.6	-66.5	176.8	142.2	0	0	111.4	M270 S271 R272 Q276 K277 L278	M270-E274 WeakPolarHBondContact CA-OE2 3.05Å; M270-E274 HydrophobicContact CB-CB 4.25Å; M270-E274 HydrophobicContact CG-CB 4.06Å; M270-E274 HydrophobicContact SD-CB 4.47Å; S271-E274 PolarHBondContact N-OE2 3.47Å; S271-E274 VanDerWaalsContact N-OE2 3.09Å; S271-E274 WeakPolarHBondContact O-CA 3.5Å; S271-E274 WeakPolarHBondContact O-CB 3.44Å; S271-E274 PolarHBondContact O-N 3.05Å; R272-E274 VanDerWaalsContact C-N 3.33Å; E274-Q276 PolarHBondContact O-N 3.04Å; E274-K277 WeakPolarHBondContact O-CB 3.49Å; E274-K277 PolarHBondContact O-N 3.23Å; E274-L278 PolarHBondContact O-N 3.14Å
275	K	66.6	Low	65.7	Low	119 Å²	119	87.9 Å²	87.9	52%	0.517	47%	0.465	S	S	.	.	H	α-helix	trans	-61.4	-30.3	173.5	-69.4	-174.6	-178.4	179.7	0	113.1	M270 S271 R272 K277	M270-K275 HydrophobicContact CB-CG 4.18Å; M270-K275 WeakPolarHBondContact O-CE 3.3Å; S271-K275 PolarHBondContact O-N 3.45Å; R272-K275 PolarHBondContact O-N 3.48Å; K275-K277 VanDerWaalsContact C-N 3.32Å
276	Q	68.8	Low	67.3	Low	100 Å²	100	84.9 Å²	84.9	47%	0.467	44%	0.443	S	S	.	.	H	α-helix	trans	-73	-23.7	173.6	-75.5	174.5	-37.2	0	0	113.2	R272 E274	R272-Q276 WeakPolarHBondContact O-CG 3.1Å; R272-Q276 PolarHBondContact O-N 2.74Å; R272-Q276 VanDerWaalsContact O-N 3.17Å; E274-Q276 PolarHBondContact O-N 3.04Å
277	K	70.5	Confident	68.8	Low	184 Å²	184	84.8 Å²	84.8	80%	0.8	44%	0.436	S	S	*	.	H	α-helix	trans	-83.3	-14.2	176.1	-68.1	179.9	179.7	-171	0	112.9	K273 E274 K275	K273-K277 WeakPolarHBondContact O-CG 3.16Å; E274-K277 WeakPolarHBondContact O-CB 3.49Å; E274-K277 PolarHBondContact O-N 3.23Å; K275-K277 VanDerWaalsContact C-N 3.32Å
278	L	67.9	Low	70.3	Confident	33 Å²	33	84.8 Å²	84.8	17%	0.173	44%	0.439	C	S	.	.	S	Bend	trans	-66.2	143.5	176.6	-73.6	167.1	0	0	0	110.2	M270 E274 T282	M270-L278 HydrophobicContact SD-CD1 4.14Å; E274-L278 PolarHBondContact O-N 3.14Å; L278-T282 HydrophobicContact CD1-CG2 4.38Å; L278-T282 HydrophobicContact CD2-CG2 4.19Å
279	P	72.8	Confident	71.8	Confident	56 Å²	56	77.9 Å²	77.9	36%	0.364	40%	0.403	S	S	.	.			trans	-58.1	146.1	173.8	20.3	-26.2	0	0	0	109.9	T281 T282 A283	P279-T281 PolarHBondContact O-N 3.22Å; P279-T282 WeakPolarHBondContact CG-OG1 3.31Å; P279-T282 PolarHBondContact O-N 3.45Å; P279-A283 PolarHBondContact O-N 2.71Å
280	P	69.6	Low	73.2	Confident	110 Å²	110	76.4 Å²	76.4	71%	0.714	39%	0.388	S	S	*	.	H	α-helix	trans	-58.4	-25.9	-173	21.7	-33.4	0	0	0	113.2	A284	P280-A284 PolarHBondContact O-N 3.05Å
281	T	72.7	Confident	74.3	Confident	103 Å²	103	74.6 Å²	74.6	63%	0.632	38%	0.381	S	S	*	.	H	α-helix	trans	-62.2	-45.6	173.8	49.7	0	0	0	0	112.1	P279 A284 M285	P279-T281 PolarHBondContact O-N 3.22Å; T281-A284 PolarHBondContact O-N 3.46Å; T281-M285 PolarHBondContact O-N 3.16Å; T281-M285 VanDerWaalsContact O-N 3.12Å
282	T	73.5	Confident	75.3	Confident	10 Å²	10	71.7 Å²	71.7	6%	0.061	36%	0.361	C	S	.	.	H	α-helix	trans	-67.9	-38.6	179.9	-47.7	0	0	0	0	111.3	M254 H258 L278 P279 M285 W286	M254-T282 HydrophobicContact SD-CG2 4.06Å; H258-T282 PolarHBondContact NE2-OG1 3.31Å; L278-T282 HydrophobicContact CD1-CG2 4.38Å; L278-T282 HydrophobicContact CD2-CG2 4.19Å; P279-T282 WeakPolarHBondContact CG-OG1 3.31Å; P279-T282 PolarHBondContact O-N 3.45Å; T282-M285 WeakPolarHBondContact O-CB 3.11Å; T282-M285 PolarHBondContact O-N 3.25Å; T282-W286 PolarHBondContact O-N 2.85Å
283	A	71.9	Confident	76.3	Confident	44 Å²	44	73.1 Å²	73.1	36%	0.364	37%	0.366	S	S	.	.	H	α-helix	trans	-62.7	-44.1	176.9	0	0	0	0	0	112.4	P279 M285 W286 E287	P279-A283 PolarHBondContact O-N 2.71Å; A283-M285 VanDerWaalsContact C-N 3.31Å; A283-M285 PolarHBondContact O-N 3.37Å; A283-W286 PolarHBondContact O-N 3.01Å; A283-E287 PolarHBondContact O-N 3.26Å
284	A	74.8	Confident	77.1	Confident	40 Å²	40	66.6 Å²	66.6	33%	0.331	34%	0.338	S	S	.	.	H	α-helix	trans	-63.3	-38.3	176	0	0	0	0	0	112	P280 T281 E287 V288	P280-A284 PolarHBondContact O-N 3.05Å; T281-A284 PolarHBondContact O-N 3.46Å; A284-E287 PolarHBondContact O-N 2.99Å; A284-V288 WeakPolarHBondContact O-CG2 3.31Å; A284-V288 PolarHBondContact O-N 2.87Å
285	M	80.3	Confident	78	Confident	46 Å²	46	63.9 Å²	63.9	23%	0.227	33%	0.326	C	S	.	.	H	α-helix	trans	-64.2	-40.3	177.5	-167.9	162.8	177.4	0	0	112.2	Q250 M254 T281 T282 A283 E287 V288 I289	Q250-M285 HydrophobicContact CB-CE 3.29Å; Q250-M285 HydrophobicContact CG-CE 3.62Å; Q250-M285 VanDerWaalsContact O-CE 3.3Å; Q250-M285 WeakPolarHBondContact O-CE 3.23Å; M254-M285 HydrophobicContact CE-CE 3.94Å; M254-M285 HydrophobicContact CE-CG 4.31Å; M254-M285 HydrophobicContact CE-SD 4.21Å; M254-M285 HydrophobicContact CG-CE 3.55Å; M254-M285 HydrophobicContact CG-SD 3.52Å; M254-M285 VanDerWaalsContact CG-SD 3.52Å; M254-M285 HydrophobicContact SD-CB 4.29Å; M254-M285 HydrophobicContact SD-CE 3.75Å; M254-M285 HydrophobicContact SD-CG 3.81Å; M254-M285 HydrophobicContact SD-SD 3.32Å; T281-M285 PolarHBondContact O-N 3.16Å; T281-M285 VanDerWaalsContact O-N 3.12Å; T282-M285 WeakPolarHBondContact O-CB 3.11Å; T282-M285 PolarHBondContact O-N 3.25Å; A283-M285 VanDerWaalsContact C-N 3.31Å; A283-M285 PolarHBondContact O-N 3.37Å; M285-E287 VanDerWaalsContact C-N 3.33Å; M285-E287 PolarHBondContact O-N 3.37Å; M285-V288 WeakPolarHBondContact O-CB 3.37Å; M285-V288 PolarHBondContact O-N 2.84Å; M285-V288 VanDerWaalsContact O-N 3.13Å; M285-I289 HydrophobicContact CG-CD1 4.27Å; M285-I289 WeakPolarHBondContact O-CG1 3.47Å; M285-I289 PolarHBondContact O-N 3.06Å
286	W	78.9	Confident	79.2	Confident	87 Å²	87	59.3 Å²	59.3	33%	0.33	31%	0.307	S	S	.	.	H	α-helix	trans	-62	-37.1	174	-85.4	108.5	0	0	0	113.5	I267 T282 A283 V288 I289 F290	I267-W286 HydrophobicContact CG2-CH2 4.31Å; I267-W286 HydrophobicContact CG2-CZ2 3.49Å; I267-W286 VanDerWaalsContact CG2-CZ2 3.49Å; T282-W286 PolarHBondContact O-N 2.85Å; A283-W286 PolarHBondContact O-N 3.01Å; W286-V288 VanDerWaalsContact C-N 3.28Å; W286-V288 PolarHBondContact O-N 3.33Å; W286-I289 HydrophobicContact CE3-CD1 4.49Å; W286-I289 HydrophobicContact CE3-CG2 4.34Å; W286-I289 HydrophobicContact CZ3-CG2 4.31Å; W286-I289 PolarHBondContact O-N 2.97Å; W286-F290 VanDerWaalsContact O-CB 3.25Å; W286-F290 WeakPolarHBondContact O-CB 3.37Å; W286-F290 PolarHBondContact O-N 3.43Å
287	E	79.4	Confident	80.3	Confident	59 Å²	59	57 Å²	57	28%	0.276	30%	0.299	S	S	.	.	H	α-helix	trans	-62.3	-39.1	174.1	-66.3	-175	159.4	0	0	111.2	S92 A283 A284 M285 A291 R360	S92-E287 PolarHBondContact OG-OE2 3.42Å; A283-E287 PolarHBondContact O-N 3.26Å; A284-E287 PolarHBondContact O-N 2.99Å; M285-E287 VanDerWaalsContact C-N 3.33Å; M285-E287 PolarHBondContact O-N 3.37Å; E287-A291 WeakPolarHBondContact O-CB 3.44Å; E287-A291 PolarHBondContact O-N 3.37Å; E287-R360 IonicContact OE1-CZ 3.59Å; E287-R360 IonicContact OE1-NH1 3.03Å; E287-R360 IonicContact OE1-NH2 2.72Å; E287-R360 PolarHBondContact OE1-NH2 3.13Å
288	V	82.1	Confident	81.3	Confident	51 Å²	51	48.9 Å²	48.9	31%	0.309	27%	0.266	S	S	.	.	H	α-helix	trans	-66.8	-48.3	176.6	176.6	0	0	0	0	111	L168 A284 M285 W286 F290 A291 C292	L168-V288 HydrophobicContact CD2-CG1 3.57Å; L168-V288 HydrophobicContact CG-CG1 4.45Å; A284-V288 WeakPolarHBondContact O-CG2 3.31Å; A284-V288 PolarHBondContact O-N 2.87Å; M285-V288 WeakPolarHBondContact O-CB 3.37Å; M285-V288 PolarHBondContact O-N 2.84Å; M285-V288 VanDerWaalsContact O-N 3.13Å; W286-V288 VanDerWaalsContact C-N 3.28Å; W286-V288 PolarHBondContact O-N 3.33Å; V288-F290 VanDerWaalsContact C-N 3.32Å; V288-F290 PolarHBondContact O-N 2.79Å; V288-A291 PolarHBondContact O-N 3.4Å; V288-C292 PolarHBondContact O-N 2.82Å; V288-C292 PolarHBondContact O-SG 3.31Å
289	I	84.2	Confident	82.4	Confident	14 Å²	14	47.3 Å²	47.3	7%	0.072	26%	0.258	C	S	.	.	H	α-helix	trans	-57.7	-47.5	177.8	-69.4	171.1	0	0	0	110.4	M247 M254 M285 W286 A291 C292 R293	M247-I289 HydrophobicContact CG-CB 4.48Å; M247-I289 HydrophobicContact CG-CG1 4.12Å; M247-I289 HydrophobicContact CG-CG2 4.04Å; M247-I289 HydrophobicContact SD-CG2 3.83Å; M254-I289 HydrophobicContact CE-CD1 3.44Å; M254-I289 VanDerWaalsContact CE-CD1 3.44Å; M285-I289 HydrophobicContact CG-CD1 4.27Å; M285-I289 WeakPolarHBondContact O-CG1 3.47Å; M285-I289 PolarHBondContact O-N 3.06Å; W286-I289 HydrophobicContact CE3-CD1 4.49Å; W286-I289 HydrophobicContact CE3-CG2 4.34Å; W286-I289 HydrophobicContact CZ3-CG2 4.31Å; W286-I289 PolarHBondContact O-N 2.97Å; I289-A291 PolarHBondContact O-N 3.48Å; I289-C292 PolarHBondContact O-N 2.66Å; I289-R293 PolarHBondContact O-N 3.33Å
290	F	84.7	Confident	83.4	Confident	71 Å²	71	48.7 Å²	48.7	31%	0.311	26%	0.261	S	S	.	.	H	α-helix	trans	-60.2	-46.9	178.3	176.2	-95	0	0	0	111.7	W286 V288 C292 R293 M294 S357	W286-F290 VanDerWaalsContact O-CB 3.25Å; W286-F290 WeakPolarHBondContact O-CB 3.37Å; W286-F290 PolarHBondContact O-N 3.43Å; V288-F290 VanDerWaalsContact C-N 3.32Å; V288-F290 PolarHBondContact O-N 2.79Å; F290-C292 PolarHBondContact O-N 2.9Å; F290-R293 PolarHBondContact O-N 3.49Å; F290-M294 HydrophobicContact CE1-CG 4.01Å; F290-M294 HydrophobicContact CE2-CG 4.32Å; F290-M294 HydrophobicContact CZ-CG 3.88Å; F290-M294 HydrophobicContact CZ-SD 4.44Å; F290-M294 WeakPolarHBondContact O-CG 3.29Å; F290-M294 PolarHBondContact O-N 2.98Å; F290-S357 WeakPolarHBondContact CE2-O 3.47Å; F290-S357 VanDerWaalsContact CZ-O 3.25Å; F290-S357 WeakPolarHBondContact CZ-O 3.11Å; F290-S357 WeakPolarHBondContact CZ-OG 3.29Å
291	A	85.4	Confident	84.5	Confident	11 Å²	11	44.8 Å²	44.8	9%	0.091	24%	0.235	C	C	.	.	H	α-helix	trans	-61.3	-42.5	176.7	0	0	0	0	0	112.1	E287 V288 I289 M294 M295	E287-A291 WeakPolarHBondContact O-CB 3.44Å; E287-A291 PolarHBondContact O-N 3.37Å; V288-A291 PolarHBondContact O-N 3.4Å; I289-A291 PolarHBondContact O-N 3.48Å; A291-M294 PolarHBondContact O-N 3.45Å; A291-M295 WeakPolarHBondContact O-CG 3.49Å; A291-M295 PolarHBondContact O-N 2.9Å
292	C	87.7	Confident	85.4	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.007	21%	0.207	C	C	.	.	H	α-helix	trans	-64.6	-42.9	178.5	-64.8	0	0	0	0	111.9	V288 I289 F290 M294 M295 I296	V288-C292 PolarHBondContact O-N 2.82Å; V288-C292 PolarHBondContact O-SG 3.31Å; I289-C292 PolarHBondContact O-N 2.66Å; F290-C292 PolarHBondContact O-N 2.9Å; C292-M294 VanDerWaalsContact C-N 3.29Å; C292-M294 PolarHBondContact O-N 3.31Å; C292-M295 PolarHBondContact O-N 3.31Å; C292-I296 WeakPolarHBondContact O-CG1 3.36Å; C292-I296 PolarHBondContact O-N 2.91Å
293	R	89.1	Confident	86.2	Confident	172 Å²	172	40.9 Å²	40.9	65%	0.649	21%	0.21	S	C	*	.	H	α-helix	trans	-57.5	-44.4	174.1	-178	178.8	175.9	-179.6	-0.2	111.3	I289 F290 M295 I296 V297	I289-R293 PolarHBondContact O-N 3.33Å; F290-R293 PolarHBondContact O-N 3.49Å; R293-M295 VanDerWaalsContact C-N 3.34Å; R293-M295 PolarHBondContact O-N 3.38Å; R293-I296 PolarHBondContact O-N 3.43Å; R293-V297 WeakPolarHBondContact O-CG2 3.33Å; R293-V297 PolarHBondContact O-N 2.97Å
294	M	88.7	Confident	87.2	Confident	18 Å²	18	43.9 Å²	43.9	9%	0.089	22%	0.218	C	C	.	.	H	α-helix	trans	-64.6	-38.2	177.7	-70.2	-48.4	-58.3	0	0	112.9	F290 A291 C292 S298 L353 S357	F290-M294 HydrophobicContact CE1-CG 4.01Å; F290-M294 HydrophobicContact CE2-CG 4.32Å; F290-M294 HydrophobicContact CZ-CG 3.88Å; F290-M294 HydrophobicContact CZ-SD 4.44Å; F290-M294 WeakPolarHBondContact O-CG 3.29Å; F290-M294 PolarHBondContact O-N 2.98Å; A291-M294 PolarHBondContact O-N 3.45Å; C292-M294 VanDerWaalsContact C-N 3.29Å; C292-M294 PolarHBondContact O-N 3.31Å; M294-S298 WeakPolarHBondContact O-CB 3.31Å; M294-S298 PolarHBondContact O-N 3.48Å; M294-L353 VanDerWaalsContact CE-C 3.42Å; M294-L353 HydrophobicContact CE-CB 3.89Å; M294-L353 WeakPolarHBondContact CE-O 3.39Å; M294-S357 WeakPolarHBondContact CE-OG 3.38Å; M294-S357 WeakPolarHBondContact SD-CB 3.33Å; M294-S357 PolarHBondContact SD-OG 3.43Å
295	M	89.2	Confident	88	Confident	12 Å²	12	42 Å²	42	6%	0.059	20%	0.202	C	C	.	.	H	α-helix	trans	-64.6	-45	174.8	-68.2	-54.4	104.3	0	0	112	M102 M157 M160 T161 R164 A291 C292 R293 V297 S298 S299	M102-M295 HydrophobicContact SD-CE 4.47Å; M157-M295 HydrophobicContact CE-SD 3.93Å; M160-M295 HydrophobicContact CB-SD 4.41Å; M160-M295 HydrophobicContact CG-SD 3.51Å; M160-M295 VanDerWaalsContact CG-SD 3.51Å; M160-M295 HydrophobicContact SD-CE 3.71Å; M160-M295 HydrophobicContact SD-SD 3.22Å; T161-M295 HydrophobicContact CG2-CB 4.15Å; R164-M295 HydrophobicContact CG-CG 3.98Å; A291-M295 WeakPolarHBondContact O-CG 3.49Å; A291-M295 PolarHBondContact O-N 2.9Å; C292-M295 PolarHBondContact O-N 3.31Å; R293-M295 VanDerWaalsContact C-N 3.34Å; R293-M295 PolarHBondContact O-N 3.38Å; M295-V297 PolarHBondContact O-N 2.87Å; M295-S298 PolarHBondContact O-N 3.45Å; M295-S299 WeakPolarHBondContact O-CB 3.34Å; M295-S299 PolarHBondContact O-N 2.69Å; M295-S299 PolarHBondContact O-OG 2.92Å; M295-S299 VanDerWaalsContact O-OG 3.07Å
296	I	91	Very high	88.6	Confident	23 Å²	23	40.1 Å²	40.1	12%	0.118	20%	0.195	C	C	.	.	H	α-helix	trans	-60.1	-49	178.1	-67.4	165.2	0	0	0	110.4	N243 L244 C292 R293 S298 S299 I300	N243-I296 HydrophobicContact CB-CD1 4.16Å; N243-I296 HydrophobicContact CB-CG1 4.43Å; L244-I296 HydrophobicContact CB-CD1 4.33Å; C292-I296 WeakPolarHBondContact O-CG1 3.36Å; C292-I296 PolarHBondContact O-N 2.91Å; R293-I296 PolarHBondContact O-N 3.43Å; I296-S298 VanDerWaalsContact C-N 3.33Å; I296-S298 PolarHBondContact O-N 2.88Å; I296-S299 PolarHBondContact O-N 3.33Å; I296-I300 HydrophobicContact CG2-CD1 3.85Å; I296-I300 VanDerWaalsContact O-CG1 3.31Å; I296-I300 WeakPolarHBondContact O-CG1 3.29Å; I296-I300 PolarHBondContact O-N 2.96Å
297	V	92.6	Very high	89.2	Confident	51 Å²	51	39.3 Å²	39.3	31%	0.309	20%	0.196	S	C	.	.	H	α-helix	trans	-61.4	-43.6	178.1	174.9	0	0	0	0	110.8	R293 M295 S299 I300 V301 L353	R293-V297 WeakPolarHBondContact O-CG2 3.33Å; R293-V297 PolarHBondContact O-N 2.97Å; M295-V297 PolarHBondContact O-N 2.87Å; V297-S299 VanDerWaalsContact C-N 3.35Å; V297-S299 PolarHBondContact O-N 3.34Å; V297-I300 PolarHBondContact O-N 3.25Å; V297-V301 HydrophobicContact CG1-CG2 4.47Å; V297-V301 VanDerWaalsContact O-CG2 3.32Å; V297-V301 WeakPolarHBondContact O-CG2 3.14Å; V297-V301 PolarHBondContact O-N 2.98Å; V297-L353 HydrophobicContact CG1-CD1 3.96Å
298	S	91.2	Very high	89.8	Confident	15 Å²	15	38.3 Å²	38.3	11%	0.105	20%	0.195	C	C	.	.	H	α-helix	trans	-61.3	-41.1	177.2	-173.5	0	0	0	0	112.4	M294 M295 I296 V301 Y302 R350	M294-S298 WeakPolarHBondContact O-CB 3.31Å; M294-S298 PolarHBondContact O-N 3.48Å; M295-S298 PolarHBondContact O-N 3.45Å; I296-S298 VanDerWaalsContact C-N 3.33Å; I296-S298 PolarHBondContact O-N 2.88Å; S298-V301 PolarHBondContact O-N 3.27Å; S298-Y302 WeakPolarHBondContact O-CB 3.44Å; S298-Y302 PolarHBondContact O-N 3.34Å; S298-R350 WeakPolarHBondContact OG-CD 3.45Å
299	S	91.5	Very high	90.3	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-65	-42.6	175.6	-66.6	0	0	0	0	112.2	T161 M295 I296 V297 Y302 I303	T161-S299 WeakPolarHBondContact CG2-OG 3.36Å; M295-S299 WeakPolarHBondContact O-CB 3.34Å; M295-S299 PolarHBondContact O-N 2.69Å; M295-S299 PolarHBondContact O-OG 2.92Å; M295-S299 VanDerWaalsContact O-OG 3.07Å; I296-S299 PolarHBondContact O-N 3.33Å; V297-S299 VanDerWaalsContact C-N 3.35Å; V297-S299 PolarHBondContact O-N 3.34Å; S299-Y302 PolarHBondContact O-N 2.89Å; S299-I303 VanDerWaalsContact O-CG1 3.29Å; S299-I303 WeakPolarHBondContact O-CG1 3.27Å; S299-I303 PolarHBondContact O-N 3.3Å
300	I	92.1	Very high	90.4	Very high	84 Å²	84	35.7 Å²	35.7	43%	0.431	18%	0.179	S	C	.	.	H	α-helix	trans	-62.2	-46.9	176.2	-69	166.1	0	0	0	110.3	I296 V297 Y302 I303 I304	I296-I300 HydrophobicContact CG2-CD1 3.85Å; I296-I300 VanDerWaalsContact O-CG1 3.31Å; I296-I300 WeakPolarHBondContact O-CG1 3.29Å; I296-I300 PolarHBondContact O-N 2.96Å; V297-I300 PolarHBondContact O-N 3.25Å; I300-Y302 VanDerWaalsContact C-N 3.29Å; I300-Y302 PolarHBondContact O-N 3.46Å; I300-I303 PolarHBondContact O-N 2.9Å; I300-I304 HydrophobicContact CG2-CD1 3.6Å; I300-I304 HydrophobicContact CG2-CG1 4.28Å; I300-I304 WeakPolarHBondContact O-CB 3.43Å; I300-I304 VanDerWaalsContact O-CG1 3.3Å; I300-I304 WeakPolarHBondContact O-CG1 3.34Å; I300-I304 PolarHBondContact O-N 2.83Å
301	V	93.7	Very high	90.7	Very high	28 Å²	28	36.8 Å²	36.8	17%	0.17	19%	0.188	C	C	.	.	H	α-helix	trans	-59.8	-41.3	177.1	171	0	0	0	0	111.3	V297 S298 G305 C346 R350 L353	V297-V301 HydrophobicContact CG1-CG2 4.47Å; V297-V301 VanDerWaalsContact O-CG2 3.32Å; V297-V301 WeakPolarHBondContact O-CG2 3.14Å; V297-V301 PolarHBondContact O-N 2.98Å; S298-V301 PolarHBondContact O-N 3.27Å; V301-G305 PolarHBondContact O-N 3.15Å; V301-C346 HydrophobicContact CG1-CB 3.91Å; V301-C346 WeakPolarHBondContact CG1-O 3.06Å; V301-R350 HydrophobicContact CB-CG 4.3Å; V301-R350 HydrophobicContact CG1-CG 3.86Å; V301-L353 HydrophobicContact CG2-CD1 3.98Å
302	Y	91.5	Very high	90.9	Very high	8 Å²	8	37.1 Å²	37.1	3%	0.031	19%	0.187	C	C	.	.	H	α-helix	trans	-62.7	-47	175.5	178.2	-96.5	0	0	0	112.1	A154 L236 S298 S299 I300 G305 A306 F343 R350	A154-Y302 WeakPolarHBondContact CA-OH 3.46Å; A154-Y302 HydrophobicContact CB-CE1 4.36Å; A154-Y302 WeakPolarHBondContact CB-OH 3.3Å; L236-Y302 HydrophobicContact CD1-CD1 3.62Å; L236-Y302 HydrophobicContact CD1-CE1 4.07Å; S298-Y302 WeakPolarHBondContact O-CB 3.44Å; S298-Y302 PolarHBondContact O-N 3.34Å; S299-Y302 PolarHBondContact O-N 2.89Å; I300-Y302 VanDerWaalsContact C-N 3.29Å; I300-Y302 PolarHBondContact O-N 3.46Å; Y302-G305 PolarHBondContact O-N 2.98Å; Y302-A306 HydrophobicContact CE1-CB 4.17Å; Y302-A306 VanDerWaalsContact O-CB 3.26Å; Y302-A306 WeakPolarHBondContact O-CB 3.41Å; Y302-A306 PolarHBondContact O-N 2.94Å; Y302-F343 HydrophobicContact CD2-CE2 4.31Å; Y302-F343 AromaticContact CE2-CE2 3.88Å; Y302-F343 HydrophobicContact CE2-CE2 3.88Å; Y302-F343 HydrophobicContact CE2-CZ 4.18Å; Y302-R350 VanDerWaalsContact CD2-NH1 3.29Å
303	I	91.2	Very high	90.8	Very high	24 Å²	24	38.1 Å²	38.1	12%	0.123	19%	0.192	C	C	.	.	H	α-helix	trans	-61.7	-46.5	179	-70.8	168.5	0	0	0	110.6	F233 L236 M237 S299 I300 G305 A306 L307	F233-I303 HydrophobicContact CD2-CD1 4.04Å; F233-I303 HydrophobicContact CD2-CG1 4.08Å; F233-I303 HydrophobicContact CD2-CG2 3.91Å; F233-I303 HydrophobicContact CE2-CD1 4.21Å; F233-I303 HydrophobicContact CE2-CG1 4.5Å; F233-I303 HydrophobicContact CE2-CG2 3.71Å; L236-I303 HydrophobicContact CB-CD1 4.23Å; L236-I303 HydrophobicContact CD1-CG1 4.34Å; M237-I303 HydrophobicContact CG-CD1 4.23Å; M237-I303 HydrophobicContact SD-CD1 3.93Å; S299-I303 VanDerWaalsContact O-CG1 3.29Å; S299-I303 WeakPolarHBondContact O-CG1 3.27Å; S299-I303 PolarHBondContact O-N 3.3Å; I300-I303 PolarHBondContact O-N 2.9Å; I303-G305 VanDerWaalsContact C-N 3.28Å; I303-G305 PolarHBondContact O-N 2.88Å; I303-A306 PolarHBondContact O-N 2.98Å; I303-L307 WeakPolarHBondContact O-CB 3.3Å; I303-L307 PolarHBondContact O-N 3.26Å
304	I	92.2	Very high	90.7	Very high	106 Å²	106	34.8 Å²	34.8	54%	0.544	19%	0.186	S	C	.	.	H	α-helix	trans	-61.3	-37.8	178.5	-69.2	171.5	0	0	0	111.1	I300 P308	I300-I304 HydrophobicContact CG2-CD1 3.6Å; I300-I304 HydrophobicContact CG2-CG1 4.28Å; I300-I304 WeakPolarHBondContact O-CB 3.43Å; I300-I304 VanDerWaalsContact O-CG1 3.3Å; I300-I304 WeakPolarHBondContact O-CG1 3.34Å; I300-I304 PolarHBondContact O-N 2.83Å; I304-P308 WeakPolarHBondContact O-CD 3.49Å; I304-P308 WeakPolarHBondContact O-CG 3.26Å
305	G	92.3	Very high	90.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-73.6	-40	176.4	0	0	0	0	0	113.4	V301 Y302 I303	V301-G305 PolarHBondContact O-N 3.15Å; Y302-G305 PolarHBondContact O-N 2.98Å; I303-G305 VanDerWaalsContact C-N 3.28Å; I303-G305 PolarHBondContact O-N 2.88Å
306	A	91.9	Very high	90.7	Very high	8 Å²	8	41.3 Å²	41.3	7%	0.066	23%	0.227	C	C	.	.	H	α-helix	trans	-81.3	-34.9	-173.2	0	0	0	0	0	112.9	Y302 I303 I309 N310 F343	Y302-A306 HydrophobicContact CE1-CB 4.17Å; Y302-A306 VanDerWaalsContact O-CB 3.26Å; Y302-A306 WeakPolarHBondContact O-CB 3.41Å; Y302-A306 PolarHBondContact O-N 2.94Å; I303-A306 PolarHBondContact O-N 2.98Å; A306-I309 PolarHBondContact O-N 2.99Å; A306-N310 PolarHBondContact O-N 3.24Å; A306-N310 PolarHBondContact O-ND2 2.89Å; A306-F343 HydrophobicContact CB-CD2 4.23Å; A306-F343 HydrophobicContact CB-CE2 4.03Å
307	L	90.8	Very high	90.1	Very high	70 Å²	70	44.7 Å²	44.7	37%	0.366	25%	0.253	S	S	.	.	H	α-helix	trans	-60.6	-45.1	-174.6	-177.8	67.6	0	0	0	112.9	I303 I309 N310 L311	I303-L307 WeakPolarHBondContact O-CB 3.3Å; I303-L307 PolarHBondContact O-N 3.26Å; L307-I309 VanDerWaalsContact C-N 3.33Å; L307-I309 PolarHBondContact O-N 3.4Å; L307-N310 PolarHBondContact O-N 2.68Å; L307-N310 VanDerWaalsContact O-N 3.17Å; L307-L311 HydrophobicContact CD1-CD1 4.05Å; L307-L311 HydrophobicContact CD1-CD2 4.41Å; L307-L311 HydrophobicContact CD1-CG 3.94Å; L307-L311 HydrophobicContact CD2-CD1 4.21Å; L307-L311 HydrophobicContact CG-CD1 3.73Å; L307-L311 HydrophobicContact CG-CG 4.06Å; L307-L311 WeakPolarHBondContact O-CG 3.33Å; L307-L311 PolarHBondContact O-N 3.03Å
308	P	93.5	Very high	89.5	Confident	38 Å²	38	48.1 Å²	48.1	25%	0.247	27%	0.27	C	S	.	.	H	α-helix	trans	-58.6	-39	177.9	-27.1	36.5	0	0	0	113.8	I304 N310 F312 I339 M342	I304-P308 WeakPolarHBondContact O-CD 3.49Å; I304-P308 WeakPolarHBondContact O-CG 3.26Å; P308-N310 VanDerWaalsContact C-N 3.34Å; P308-N310 PolarHBondContact O-N 3.32Å; P308-F312 WeakPolarHBondContact O-CB 3.42Å; P308-F312 PolarHBondContact O-N 3.46Å; P308-I339 HydrophobicContact CB-CG2 3.88Å; P308-M342 HydrophobicContact CB-CE 4.38Å; P308-M342 HydrophobicContact CG-CE 4.22Å
309	I	91.1	Very high	88.8	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-59.3	-48.9	176.5	-65.7	167.8	0	0	0	110.1	A306 L307 F312 K313 I339 F343	A306-I309 PolarHBondContact O-N 2.99Å; L307-I309 VanDerWaalsContact C-N 3.33Å; L307-I309 PolarHBondContact O-N 3.4Å; I309-F312 PolarHBondContact O-N 2.88Å; I309-K313 HydrophobicContact CG2-CD 4.48Å; I309-K313 WeakPolarHBondContact O-CG 3.49Å; I309-K313 PolarHBondContact O-N 3.35Å; I309-I339 HydrophobicContact CB-CG2 4.29Å; I309-I339 HydrophobicContact CG1-CG2 3.52Å; I309-F343 HydrophobicContact CD1-CB 3.34Å; I309-F343 HydrophobicContact CD1-CD1 3.89Å; I309-F343 HydrophobicContact CD1-CD2 3.98Å; I309-F343 HydrophobicContact CD1-CG 3.46Å; I309-F343 VanDerWaalsContact CD1-CG 3.46Å; I309-F343 HydrophobicContact CG1-CB 4.3Å
310	N	88	Confident	87.5	Confident	7 Å²	7	53.2 Å²	53.2	4%	0.037	29%	0.29	C	S	.	.	H	α-helix	trans	-71.2	-41.7	-174.6	-66.8	-69.2	0	0	0	111.6	L225 C229 A306 L307 P308 F312 K313 L314	L225-N310 HydrophobicContact CD1-CB 4.11Å; C229-N310 HydrophobicContact CB-CB 4.37Å; C229-N310 PolarHBondContact SG-ND2 3.31Å; A306-N310 PolarHBondContact O-N 3.24Å; A306-N310 PolarHBondContact O-ND2 2.89Å; L307-N310 PolarHBondContact O-N 2.68Å; L307-N310 VanDerWaalsContact O-N 3.17Å; P308-N310 VanDerWaalsContact C-N 3.34Å; P308-N310 PolarHBondContact O-N 3.32Å; N310-F312 VanDerWaalsContact C-N 3.32Å; N310-F312 PolarHBondContact O-N 3.18Å; N310-K313 PolarHBondContact O-N 3.46Å; N310-L314 WeakPolarHBondContact O-CG 3.31Å; N310-L314 PolarHBondContact O-N 2.82Å
311	L	90.1	Very high	86.1	Confident	94 Å²	94	50.4 Å²	50.4	49%	0.492	28%	0.276	S	S	.	.	H	α-helix	trans	-62.2	-40.5	174.2	-70.6	178.6	0	0	0	111.6	L307 L314 S315	L307-L311 HydrophobicContact CD1-CD1 4.05Å; L307-L311 HydrophobicContact CD1-CD2 4.41Å; L307-L311 HydrophobicContact CD1-CG 3.94Å; L307-L311 HydrophobicContact CD2-CD1 4.21Å; L307-L311 HydrophobicContact CG-CD1 3.73Å; L307-L311 HydrophobicContact CG-CG 4.06Å; L307-L311 WeakPolarHBondContact O-CG 3.33Å; L307-L311 PolarHBondContact O-N 3.03Å; L311-L314 PolarHBondContact O-N 2.79Å; L311-S315 VanDerWaalsContact O-CB 3.3Å; L311-S315 WeakPolarHBondContact O-CB 3.47Å; L311-S315 PolarHBondContact O-N 3.09Å
312	F	89.7	Confident	84.9	Confident	19 Å²	19	51.1 Å²	51.1	8%	0.083	28%	0.28	C	S	.	.	H	α-helix	trans	-63.1	-46.6	177.4	-169.8	-85.1	0	0	0	111.8	P308 I309 N310 L314 S315 M316 F319 I335 Y336 I339	P308-F312 WeakPolarHBondContact O-CB 3.42Å; P308-F312 PolarHBondContact O-N 3.46Å; I309-F312 PolarHBondContact O-N 2.88Å; N310-F312 VanDerWaalsContact C-N 3.32Å; N310-F312 PolarHBondContact O-N 3.18Å; F312-L314 PolarHBondContact O-N 3.44Å; F312-S315 PolarHBondContact O-N 3.32Å; F312-M316 HydrophobicContact CD1-CG 4.33Å; F312-M316 HydrophobicContact CD2-CG 4.39Å; F312-M316 HydrophobicContact CE1-CB 4.26Å; F312-M316 HydrophobicContact CE1-CG 4.02Å; F312-M316 HydrophobicContact CE2-CG 4.08Å; F312-M316 HydrophobicContact CZ-CG 3.89Å; F312-M316 PolarHBondContact O-N 3.04Å; F312-F319 HydrophobicContact CE1-CB 4.32Å; F312-F319 HydrophobicContact CE1-CD1 4.38Å; F312-F319 AromaticContact CE1-CD2 3.61Å; F312-F319 HydrophobicContact CE1-CD2 3.61Å; F312-F319 AromaticContact CE1-CE2 3.92Å; F312-F319 HydrophobicContact CE1-CE2 3.92Å; F312-F319 AromaticContact CE1-CG 3.85Å; F312-F319 HydrophobicContact CE1-CG 3.85Å; F312-F319 HydrophobicContact CE1-CZ 4.41Å; F312-F319 HydrophobicContact CZ-CD2 4.29Å; F312-F319 HydrophobicContact CZ-CE2 4.22Å; F312-I335 HydrophobicContact CD2-CG2 4.26Å; F312-I335 HydrophobicContact CE2-CB 4.38Å; F312-I335 HydrophobicContact CE2-CG2 3.68Å; F312-I335 HydrophobicContact CZ-CG2 4.43Å; F312-Y336 AromaticContact CD1-CD2 3.51Å; F312-Y336 HydrophobicContact CD1-CD2 3.51Å; F312-Y336 HydrophobicContact CD1-CE2 4.29Å; F312-Y336 HydrophobicContact CD1-CG 4.33Å; F312-Y336 AromaticContact CE1-CD2 3.71Å; F312-Y336 HydrophobicContact CE1-CD2 3.71Å; F312-Y336 HydrophobicContact CE1-CG 4.08Å; F312-Y336 HydrophobicContact CG-CD2 4.38Å; F312-I339 HydrophobicContact CB-CD1 4.22Å; F312-I339 HydrophobicContact CD2-CD1 3.71Å; F312-I339 HydrophobicContact CE2-CD1 4.36Å; F312-I339 HydrophobicContact CG-CD1 4.12Å
313	K	85.9	Confident	84	Confident	22 Å²	22	51.1 Å²	51.1	10%	0.096	28%	0.28	C	S	.	.	H	α-helix	trans	-60.6	-32.8	175.3	-73.7	-174.2	176.5	-165.2	0	113.1	I309 N310 K320 Y336	I309-K313 HydrophobicContact CG2-CD 4.48Å; I309-K313 WeakPolarHBondContact O-CG 3.49Å; I309-K313 PolarHBondContact O-N 3.35Å; N310-K313 PolarHBondContact O-N 3.46Å; K313-K320 WeakPolarHBondContact O-CA 3.31Å; K313-Y336 WeakPolarHBondContact CE-OH 3.41Å; K313-Y336 HydrophobicContact CG-CE2 4.25Å
314	L	86.8	Confident	82.4	Confident	102 Å²	102	50.2 Å²	50.2	53%	0.534	28%	0.276	S	S	.	.	H	α-helix	trans	-76.6	-39.3	176.4	-74.3	172.5	0	0	0	112.6	L225 N310 L311 F312	L225-L314 HydrophobicContact CD1-CD1 4.33Å; L225-L314 HydrophobicContact CD2-CD1 4.31Å; L225-L314 HydrophobicContact CD2-CD2 3.86Å; L225-L314 HydrophobicContact CD2-CG 4.43Å; N310-L314 WeakPolarHBondContact O-CG 3.31Å; N310-L314 PolarHBondContact O-N 2.82Å; L311-L314 PolarHBondContact O-N 2.79Å; F312-L314 PolarHBondContact O-N 3.44Å
315	S	88.9	Confident	81.2	Confident	92 Å²	92	46 Å²	46	64%	0.643	26%	0.258	S	S	*	.	H	α-helix	trans	-77.6	-33.8	-175.3	-172.7	0	0	0	0	113.1	L311 F312	L311-S315 VanDerWaalsContact O-CB 3.3Å; L311-S315 WeakPolarHBondContact O-CB 3.47Å; L311-S315 PolarHBondContact O-N 3.09Å; F312-S315 PolarHBondContact O-N 3.32Å
316	M	88	Confident	79.9	Confident	74 Å²	74	50.7 Å²	50.7	37%	0.365	28%	0.275	S	S	.	.			trans	-104.3	108.4	-174.2	-62.7	-63.5	178.8	0	0	110.4	F312 N318 F319 K320	F312-M316 HydrophobicContact CD1-CG 4.33Å; F312-M316 HydrophobicContact CD2-CG 4.39Å; F312-M316 HydrophobicContact CE1-CB 4.26Å; F312-M316 HydrophobicContact CE1-CG 4.02Å; F312-M316 HydrophobicContact CE2-CG 4.08Å; F312-M316 HydrophobicContact CZ-CG 3.89Å; F312-M316 PolarHBondContact O-N 3.04Å; M316-N318 PolarHBondContact O-N 3.29Å; M316-N318 VanDerWaalsContact O-N 3.15Å; M316-F319 HydrophobicContact CB-CD2 3.82Å; M316-F319 PolarHBondContact O-N 3.42Å; M316-K320 PolarHBondContact O-N 2.9Å; M316-K320 VanDerWaalsContact O-N 3.16Å
317	S	79.4	Confident	78.9	Confident	95 Å²	95	52 Å²	52	66%	0.664	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-54.3	-35.7	-178.4	52.8	0	0	0	0	113.1	F319 K320	S317-F319 VanDerWaalsContact C-N 3.29Å; S317-F319 PolarHBondContact O-N 3.38Å; S317-K320 WeakPolarHBondContact O-CB 3.44Å; S317-K320 PolarHBondContact O-N 2.83Å
318	N	79.5	Confident	78.2	Confident	122 Å²	122	48.7 Å²	48.7	65%	0.652	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-68.2	-28.2	-177.4	-60.4	-8.4	0	0	0	112.4	M316 V322	M316-N318 PolarHBondContact O-N 3.29Å; M316-N318 VanDerWaalsContact O-N 3.15Å; N318-V322 WeakPolarHBondContact O-CG2 3.34Å
319	F	77.3	Confident	77.8	Confident	15 Å²	15	49 Å²	49	7%	0.066	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-102.2	-3.4	179.9	-63.7	-89.3	0	0	0	113.1	F312 M316 S317 N321 D333 Y336	F312-F319 HydrophobicContact CE1-CB 4.32Å; F312-F319 HydrophobicContact CE1-CD1 4.38Å; F312-F319 AromaticContact CE1-CD2 3.61Å; F312-F319 HydrophobicContact CE1-CD2 3.61Å; F312-F319 AromaticContact CE1-CE2 3.92Å; F312-F319 HydrophobicContact CE1-CE2 3.92Å; F312-F319 AromaticContact CE1-CG 3.85Å; F312-F319 HydrophobicContact CE1-CG 3.85Å; F312-F319 HydrophobicContact CE1-CZ 4.41Å; F312-F319 HydrophobicContact CZ-CD2 4.29Å; F312-F319 HydrophobicContact CZ-CE2 4.22Å; M316-F319 HydrophobicContact CB-CD2 3.82Å; M316-F319 PolarHBondContact O-N 3.42Å; S317-F319 VanDerWaalsContact C-N 3.29Å; S317-F319 PolarHBondContact O-N 3.38Å; F319-N321 PolarHBondContact O-N 2.87Å; F319-N321 VanDerWaalsContact O-N 3.07Å; F319-D333 WeakPolarHBondContact CE1-OD1 3.39Å; F319-D333 WeakPolarHBondContact CZ-OD1 3.5Å; F319-Y336 HydrophobicContact CD1-CD1 4.29Å; F319-Y336 HydrophobicContact CD1-CD2 4.49Å; F319-Y336 HydrophobicContact CD1-CG 4.19Å; F319-Y336 HydrophobicContact CE1-CD1 4.3Å; F319-Y336 HydrophobicContact CE1-CG 4.24Å
320	K	64.4	Low	77.6	Confident	108 Å²	108	50.5 Å²	50.5	47%	0.47	28%	0.277	S	S	.	.	S	Bend	trans	-54.6	-33	-178.4	-174.1	172.3	179.8	171.2	0	111.8	K313 M316 S317	K313-K320 WeakPolarHBondContact O-CA 3.31Å; M316-K320 PolarHBondContact O-N 2.9Å; M316-K320 VanDerWaalsContact O-N 3.16Å; S317-K320 WeakPolarHBondContact O-CB 3.44Å; S317-K320 PolarHBondContact O-N 2.83Å
321	N	61.9	Low	77.7	Confident	24 Å²	24	54 Å²	54	13%	0.128	30%	0.298	C	S	.	.	S	Bend	trans	-128.3	8.7	-172.8	-61.5	-36.9	0	0	0	115.2	T216 F221 F319	T216-N321 HydrophobicContact CG2-CB 3.41Å; T216-N321 VanDerWaalsContact CG2-CB 3.41Å; F221-N321 HydrophobicContact CD2-CB 4.01Å; F221-N321 VanDerWaalsContact CD2-OD1 3.31Å; F221-N321 WeakPolarHBondContact CD2-OD1 3.09Å; F221-N321 VanDerWaalsContact CE2-C 3.46Å; F221-N321 HydrophobicContact CE2-CB 3.68Å; F221-N321 WeakPolarHBondContact CE2-O 3.43Å; F221-N321 VanDerWaalsContact CZ-CA 3.42Å; F221-N321 HydrophobicContact CZ-CB 4.33Å; F221-N321 WeakPolarHBondContact CZ-O 3.42Å; F319-N321 PolarHBondContact O-N 2.87Å; F319-N321 VanDerWaalsContact O-N 3.07Å
322	V	68.5	Low	77.8	Confident	43 Å²	43	51.6 Å²	51.6	26%	0.261	29%	0.288	S	S	.	.			trans	-92.1	115.7	-173	177.3	0	0	0	0	110.6	N318 T324	N318-V322 WeakPolarHBondContact O-CG2 3.34Å; V322-T324 WeakPolarHBondContact CG1-O 3.35Å
323	L	72.3	Confident	77.8	Confident	8 Å²	8	51.9 Å²	51.9	4%	0.042	29%	0.29	C	S	.	.	S	Bend	trans	-82.4	-33.6	172.5	-69.3	-179.7	0	0	0	112.3	R119 L143 Y147 L203 V210 Y215 F220 F221	R119-L323 PolarHBondContact NH2-O 2.83Å; R119-L323 VanDerWaalsContact NH2-O 3.13Å; L143-L323 HydrophobicContact CD2-CB 3.93Å; L143-L323 HydrophobicContact CD2-CD2 4.43Å; Y147-L323 HydrophobicContact CE2-CD2 3.84Å; Y147-L323 WeakPolarHBondContact OH-CD2 3.45Å; L203-L323 HydrophobicContact CD2-CD1 4.08Å; V210-L323 HydrophobicContact CB-CD1 4.15Å; Y215-L323 HydrophobicContact CD1-CD1 3.32Å; Y215-L323 HydrophobicContact CD1-CG 3.88Å; Y215-L323 HydrophobicContact CE1-CD1 3.51Å; Y215-L323 HydrophobicContact CE1-CG 4.29Å; Y215-L323 HydrophobicContact CG-CD1 4.24Å; F220-L323 HydrophobicContact CE1-CD2 3.94Å; F221-L323 HydrophobicContact CE1-CD2 3.92Å; F221-L323 HydrophobicContact CZ-CD2 3.77Å; F221-L323 HydrophobicContact CZ-CG 3.91Å
324	T	58.4	Low	78.1	Confident	6 Å²	6	51.4 Å²	51.4	4%	0.037	29%	0.288	C	S	.	.			trans	-127.8	117.5	-174.4	43.1	0	0	0	0	109.5	L143 C211 V322	L143-T324 HydrophobicContact CD1-CG2 4.38Å; C211-T324 PolarHBondContact O-OG1 3Å; V322-T324 WeakPolarHBondContact CG1-O 3.35Å
325	A	67.3	Low	78.4	Confident	18 Å²	18	50.3 Å²	50.3	15%	0.149	28%	0.282	C	S	.	.			trans	-92.8	117	171.8	0	0	0	0	0	107.5	D129	D129-A325 WeakPolarHBondContact CB-O 3.17Å
326	R	63.2	Low	78.5	Confident	98 Å²	98	46.9 Å²	46.9	37%	0.37	26%	0.255	S	S	.	.			trans	-69.4	-53.7	-177.7	-161.3	-164.4	-158.2	143.3	8	111.2	L132 E213	L132-R326 HydrophobicContact CD1-CB 4.29Å; L132-R326 HydrophobicContact CD1-CG 3.73Å; E213-R326 VanDerWaalsContact CD-NH1 3.34Å; E213-R326 HydrophobicContact CG-CB 4.02Å; E213-R326 WeakPolarHBondContact OE1-CD 3.37Å; E213-R326 IonicContact OE1-CZ 3.32Å; E213-R326 IonicContact OE1-NE 3.37Å; E213-R326 PolarHBondContact OE1-NE 3.21Å; E213-R326 IonicContact OE1-NH1 3.27Å; E213-R326 PolarHBondContact OE1-NH1 3.38Å; E213-R326 IonicContact OE1-NH2 2.77Å; E213-R326 IonicContact OE2-NH1 2.59Å; E213-R326 PolarHBondContact OE2-NH1 3.4Å
327	D	71.5	Confident	78.8	Confident	35 Å²	35	43.5 Å²	43.5	19%	0.187	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-127.9	137.8	-169.7	-54.2	-28.2	0	0	0	109.5	R16	R16-D327 IonicContact CZ-OD2 3.87Å; R16-D327 IonicContact NH1-OD2 3.27Å; R16-D327 PolarHBondContact NH1-OD2 3.16Å
328	I	76.8	Confident	79.5	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	22%	0.22	C	C	.	.			trans	-97.3	90.1	170.8	-51	172.8	0	0	0	108.9	L123 D333 I334 N337	L123-I328 VanDerWaalsContact C-CD1 3.47Å; L123-I328 HydrophobicContact CB-CD1 4.44Å; L123-I328 HydrophobicContact CD1-CD1 4.49Å; L123-I328 HydrophobicContact CD1-CG1 4.19Å; L123-I328 HydrophobicContact CD2-CG1 4.37Å; L123-I328 HydrophobicContact CG-CD1 3.78Å; L123-I328 HydrophobicContact CG-CG1 3.83Å; L123-I328 WeakPolarHBondContact O-CD1 3.26Å; I328-D333 HydrophobicContact CB-CB 4.22Å; I328-D333 HydrophobicContact CG2-CB 3.52Å; I328-I334 HydrophobicContact CG2-CG1 3.72Å; I328-N337 WeakPolarHBondContact CD1-ND2 3.2Å
329	C	83.7	Confident	80.3	Confident	45 Å²	45	36 Å²	36	30%	0.304	20%	0.195	S	C	.	.			trans	-127.5	13.6	-178.7	-54.3	0	0	0	0	112.9	C20 Y23 D333	C20-C329 HydrophobicContact CB-CB 3.95Å; C20-C329 WeakPolarHBondContact CB-SG 3.5Å; C20-C329 WeakPolarHBondContact SG-CB 3.06Å; C20-C329 CovalentContact SG-SG 2.03Å; C20-C329 PolarHBondContact SG-SG 3.28Å; Y23-C329 WeakPolarHBondContact CE2-O 3.3Å; C329-D333 PolarHBondContact N-OD2 3.43Å
330	S	88.4	Confident	81.1	Confident	32 Å²	32	35.3 Å²	35.3	22%	0.224	19%	0.193	C	C	.	.	S	Bend	trans	-128.8	150.8	174.2	74.8	0	0	0	0	111.8	T332 D333 I334	S330-T332 PolarHBondContact O-N 3.39Å; S330-T332 VanDerWaalsContact O-N 3.15Å; S330-T332 PolarHBondContact OG-N 3.45Å; S330-T332 PolarHBondContact OG-OG1 3.42Å; S330-D333 WeakPolarHBondContact CB-OD2 3.33Å; S330-D333 PolarHBondContact N-OD2 3.12Å; S330-D333 VanDerWaalsContact N-OD2 3.14Å; S330-D333 WeakPolarHBondContact O-CB 3.49Å; S330-D333 PolarHBondContact O-N 3.44Å; S330-D333 PolarHBondContact OG-N 2.96Å; S330-D333 VanDerWaalsContact OG-N 3.12Å; S330-D333 PolarHBondContact OG-OD2 2.81Å; S330-I334 WeakPolarHBondContact O-CG1 3.44Å; S330-I334 PolarHBondContact O-N 3.35Å
331	V	90.3	Very high	82.6	Confident	80 Å²	80	30.2 Å²	30.2	49%	0.485	17%	0.17	S	C	.	.	H	α-helix	trans	-52.7	-35.4	169.9	179.1	0	0	0	0	111.1	Y23 D333 I334 I335	Y23-V331 HydrophobicContact CD1-CG2 4.43Å; Y23-V331 HydrophobicContact CE1-CG2 3.49Å; Y23-V331 VanDerWaalsContact CE1-CG2 3.49Å; V331-D333 PolarHBondContact O-N 3.3Å; V331-I334 PolarHBondContact O-N 2.93Å; V331-I335 HydrophobicContact CG1-CD1 3.79Å; V331-I335 HydrophobicContact CG1-CG1 4.31Å; V331-I335 VanDerWaalsContact O-CG1 3.29Å; V331-I335 WeakPolarHBondContact O-CG1 3.3Å; V331-I335 PolarHBondContact O-N 3.07Å
332	T	91	Very high	84.2	Confident	45 Å²	45	32.6 Å²	32.6	28%	0.276	18%	0.182	S	C	.	.	H	α-helix	trans	-66	-36	179	44.2	0	0	0	0	113.4	S330 I335 Y336	S330-T332 PolarHBondContact O-N 3.39Å; S330-T332 VanDerWaalsContact O-N 3.15Å; S330-T332 PolarHBondContact OG-N 3.45Å; S330-T332 PolarHBondContact OG-OG1 3.42Å; T332-I335 PolarHBondContact O-N 3.49Å; T332-Y336 WeakPolarHBondContact O-CB 3.31Å; T332-Y336 PolarHBondContact O-N 3.43Å
333	D	89.8	Confident	85.5	Confident	24 Å²	24	30.6 Å²	30.6	13%	0.128	17%	0.17	C	C	.	.	H	α-helix	trans	-66.3	-41.9	175.2	-61.1	-49.2	0	0	0	111	F319 I328 C329 S330 V331 Y336 N337	F319-D333 WeakPolarHBondContact CE1-OD1 3.39Å; F319-D333 WeakPolarHBondContact CZ-OD1 3.5Å; I328-D333 HydrophobicContact CB-CB 4.22Å; I328-D333 HydrophobicContact CG2-CB 3.52Å; C329-D333 PolarHBondContact N-OD2 3.43Å; S330-D333 WeakPolarHBondContact CB-OD2 3.33Å; S330-D333 PolarHBondContact N-OD2 3.12Å; S330-D333 VanDerWaalsContact N-OD2 3.14Å; S330-D333 WeakPolarHBondContact O-CB 3.49Å; S330-D333 PolarHBondContact O-N 3.44Å; S330-D333 PolarHBondContact OG-N 2.96Å; S330-D333 VanDerWaalsContact OG-N 3.12Å; S330-D333 PolarHBondContact OG-OD2 2.81Å; V331-D333 PolarHBondContact O-N 3.3Å; D333-Y336 PolarHBondContact O-N 2.78Å; D333-N337 WeakPolarHBondContact O-CB 3.27Å; D333-N337 VanDerWaalsContact O-CG 3.32Å; D333-N337 PolarHBondContact O-N 3.38Å; D333-N337 PolarHBondContact O-ND2 3.48Å
334	I	91.7	Very high	86.7	Confident	13 Å²	13	30.2 Å²	30.2	7%	0.067	17%	0.168	C	C	.	.	H	α-helix	trans	-63.1	-46.1	178.3	-56.1	170.8	0	0	0	109.9	Y23 P26 V30 I328 S330 V331 Y336 N337 A338	Y23-I334 HydrophobicContact CD1-CD1 3.39Å; Y23-I334 HydrophobicContact CE1-CD1 4.3Å; Y23-I334 HydrophobicContact CG-CD1 3.74Å; P26-I334 HydrophobicContact CB-CD1 4.14Å; P26-I334 HydrophobicContact CB-CG2 4.04Å; V30-I334 HydrophobicContact CG2-CG2 3.99Å; I328-I334 HydrophobicContact CG2-CG1 3.72Å; S330-I334 WeakPolarHBondContact O-CG1 3.44Å; S330-I334 PolarHBondContact O-N 3.35Å; V331-I334 PolarHBondContact O-N 2.93Å; I334-Y336 VanDerWaalsContact C-N 3.34Å; I334-Y336 PolarHBondContact O-N 3.16Å; I334-N337 PolarHBondContact O-N 3.06Å; I334-A338 WeakPolarHBondContact O-CB 3.49Å; I334-A338 PolarHBondContact O-N 3.15Å
335	I	93.6	Very high	88.5	Confident	78 Å²	78	31.3 Å²	31.3	40%	0.4	17%	0.174	S	C	.	.	H	α-helix	trans	-60.5	-45.3	176.1	-69.7	169.5	0	0	0	110.3	F312 V331 T332 N337 A338 I339	F312-I335 HydrophobicContact CD2-CG2 4.26Å; F312-I335 HydrophobicContact CE2-CB 4.38Å; F312-I335 HydrophobicContact CE2-CG2 3.68Å; F312-I335 HydrophobicContact CZ-CG2 4.43Å; V331-I335 HydrophobicContact CG1-CD1 3.79Å; V331-I335 HydrophobicContact CG1-CG1 4.31Å; V331-I335 VanDerWaalsContact O-CG1 3.29Å; V331-I335 WeakPolarHBondContact O-CG1 3.3Å; V331-I335 PolarHBondContact O-N 3.07Å; T332-I335 PolarHBondContact O-N 3.49Å; I335-N337 PolarHBondContact O-N 2.85Å; I335-A338 PolarHBondContact O-N 2.89Å; I335-I339 HydrophobicContact CG2-CD1 3.69Å; I335-I339 HydrophobicContact CG2-CG1 4.32Å; I335-I339 WeakPolarHBondContact O-CB 3.14Å; I335-I339 VanDerWaalsContact O-CG1 3.25Å; I335-I339 WeakPolarHBondContact O-CG1 3.34Å; I335-I339 PolarHBondContact O-N 2.94Å
336	Y	92.2	Very high	89.8	Confident	20 Å²	20	31.4 Å²	31.4	8%	0.078	17%	0.174	C	C	.	.	H	α-helix	trans	-60.7	-44.6	178.3	-178.5	-109	0	0	0	112.1	Y120 F312 K313 F319 T332 D333 I334 I339 N340	Y120-Y336 HydrophobicContact CE1-CE1 4.27Å; F312-Y336 AromaticContact CD1-CD2 3.51Å; F312-Y336 HydrophobicContact CD1-CD2 3.51Å; F312-Y336 HydrophobicContact CD1-CE2 4.29Å; F312-Y336 HydrophobicContact CD1-CG 4.33Å; F312-Y336 AromaticContact CE1-CD2 3.71Å; F312-Y336 HydrophobicContact CE1-CD2 3.71Å; F312-Y336 HydrophobicContact CE1-CG 4.08Å; F312-Y336 HydrophobicContact CG-CD2 4.38Å; K313-Y336 WeakPolarHBondContact CE-OH 3.41Å; K313-Y336 HydrophobicContact CG-CE2 4.25Å; F319-Y336 HydrophobicContact CD1-CD1 4.29Å; F319-Y336 HydrophobicContact CD1-CD2 4.49Å; F319-Y336 HydrophobicContact CD1-CG 4.19Å; F319-Y336 HydrophobicContact CE1-CD1 4.3Å; F319-Y336 HydrophobicContact CE1-CG 4.24Å; T332-Y336 WeakPolarHBondContact O-CB 3.31Å; T332-Y336 PolarHBondContact O-N 3.43Å; D333-Y336 PolarHBondContact O-N 2.78Å; I334-Y336 VanDerWaalsContact C-N 3.34Å; I334-Y336 PolarHBondContact O-N 3.16Å; Y336-I339 PolarHBondContact O-N 3.49Å; Y336-N340 VanDerWaalsContact CE1-ND2 3.26Å; Y336-N340 WeakPolarHBondContact CE1-ND2 3.48Å; Y336-N340 WeakPolarHBondContact CE2-ND2 3.05Å; Y336-N340 PolarHBondContact O-N 3.03Å; Y336-N340 PolarHBondContact O-ND2 3.4Å
337	N	92.8	Very high	91.3	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.016	16%	0.156	C	C	.	.	H	α-helix	trans	-64.3	-42.7	176.6	-72	-20	0	0	0	111.8	V30 Y120 I328 D333 I334 I335 I339 N340 I341	V30-N337 HydrophobicContact CG1-CB 4.23Å; Y120-N337 VanDerWaalsContact CD1-OD1 3.3Å; Y120-N337 WeakPolarHBondContact CD1-OD1 3.09Å; I328-N337 WeakPolarHBondContact CD1-ND2 3.2Å; D333-N337 WeakPolarHBondContact O-CB 3.27Å; D333-N337 VanDerWaalsContact O-CG 3.32Å; D333-N337 PolarHBondContact O-N 3.38Å; D333-N337 PolarHBondContact O-ND2 3.48Å; I334-N337 PolarHBondContact O-N 3.06Å; I335-N337 PolarHBondContact O-N 2.85Å; N337-I339 VanDerWaalsContact C-N 3.34Å; N337-I339 PolarHBondContact O-N 3.15Å; N337-N340 PolarHBondContact O-N 3.46Å; N337-I341 WeakPolarHBondContact O-CG1 3.28Å; N337-I341 PolarHBondContact O-N 3.36Å
338	A	95.5	Very high	92.4	Very high	34 Å²	34	25.2 Å²	25.2	28%	0.281	15%	0.148	S	C	.	.	H	α-helix	trans	-60	-43.5	175.3	0	0	0	0	0	111.7	V30 I334 I335 I341 M342	V30-A338 HydrophobicContact CG1-CB 4.48Å; V30-A338 HydrophobicContact CG2-CB 4.01Å; I334-A338 WeakPolarHBondContact O-CB 3.49Å; I334-A338 PolarHBondContact O-N 3.15Å; I335-A338 PolarHBondContact O-N 2.89Å; A338-I341 PolarHBondContact O-N 2.76Å; A338-M342 VanDerWaalsContact O-CB 3.27Å; A338-M342 WeakPolarHBondContact O-CB 3.37Å; A338-M342 PolarHBondContact O-N 3.48Å
339	I	95.4	Very high	93.3	Very high	25 Å²	25	29.4 Å²	29.4	13%	0.128	17%	0.17	C	C	.	.	H	α-helix	trans	-62.6	-43.5	176.3	-70.7	167.9	0	0	0	111.1	P308 I309 F312 I335 Y336 N337 M342 F343	P308-I339 HydrophobicContact CB-CG2 3.88Å; I309-I339 HydrophobicContact CB-CG2 4.29Å; I309-I339 HydrophobicContact CG1-CG2 3.52Å; F312-I339 HydrophobicContact CB-CD1 4.22Å; F312-I339 HydrophobicContact CD2-CD1 3.71Å; F312-I339 HydrophobicContact CE2-CD1 4.36Å; F312-I339 HydrophobicContact CG-CD1 4.12Å; I335-I339 HydrophobicContact CG2-CD1 3.69Å; I335-I339 HydrophobicContact CG2-CG1 4.32Å; I335-I339 WeakPolarHBondContact O-CB 3.14Å; I335-I339 VanDerWaalsContact O-CG1 3.25Å; I335-I339 WeakPolarHBondContact O-CG1 3.34Å; I335-I339 PolarHBondContact O-N 2.94Å; Y336-I339 PolarHBondContact O-N 3.49Å; N337-I339 VanDerWaalsContact C-N 3.34Å; N337-I339 PolarHBondContact O-N 3.15Å; I339-M342 PolarHBondContact O-N 2.89Å; I339-F343 PolarHBondContact O-N 2.91Å
340	N	94.6	Very high	93.7	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.011	16%	0.158	C	C	.	.	H	α-helix	trans	-64.7	-42.1	177.5	-81.8	-78.8	0	0	0	112.3	Y120 Y336 N337 F343 W344	Y120-N340 HydrophobicContact CD1-CB 4.26Å; Y120-N340 HydrophobicContact CD2-CB 3.71Å; Y120-N340 HydrophobicContact CE1-CB 4.2Å; Y120-N340 HydrophobicContact CE2-CB 3.67Å; Y120-N340 HydrophobicContact CG-CB 4.04Å; Y336-N340 VanDerWaalsContact CE1-ND2 3.26Å; Y336-N340 WeakPolarHBondContact CE1-ND2 3.48Å; Y336-N340 WeakPolarHBondContact CE2-ND2 3.05Å; Y336-N340 PolarHBondContact O-N 3.03Å; Y336-N340 PolarHBondContact O-ND2 3.4Å; N337-N340 PolarHBondContact O-N 3.46Å; N340-F343 WeakPolarHBondContact O-CB 3.41Å; N340-F343 PolarHBondContact O-N 2.84Å; N340-W344 PolarHBondContact O-N 3.5Å
341	I	96.1	Very high	94	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-64.4	-45	175.4	-68.9	173.6	0	0	0	110.1	V30 F33 N337 A338 F343 W344 T345	V30-I341 HydrophobicContact CG1-CD1 3.53Å; V30-I341 WeakPolarHBondContact O-CD1 3.24Å; F33-I341 HydrophobicContact CD1-CB 4.41Å; F33-I341 HydrophobicContact CD1-CG2 3.43Å; F33-I341 VanDerWaalsContact CD1-CG2 3.43Å; F33-I341 HydrophobicContact CE1-CG2 3.71Å; F33-I341 HydrophobicContact CG-CG2 4.34Å; N337-I341 WeakPolarHBondContact O-CG1 3.28Å; N337-I341 PolarHBondContact O-N 3.36Å; A338-I341 PolarHBondContact O-N 2.76Å; I341-F343 VanDerWaalsContact C-N 3.29Å; I341-F343 PolarHBondContact O-N 3.33Å; I341-W344 CarbonylContact O-C 3.56Å; I341-W344 PolarHBondContact O-N 3.05Å; I341-T345 PolarHBondContact O-N 3.46Å; I341-T345 PolarHBondContact O-OG1 2.95Å
342	M	96.1	Very high	94.2	Very high	75 Å²	75	25 Å²	25	37%	0.369	13%	0.134	S	C	.	.	H	α-helix	trans	-57.7	-40.3	177	-176.2	179	69	0	0	112.2	P308 A338 I339 W344 T345 C346	P308-M342 HydrophobicContact CB-CE 4.38Å; P308-M342 HydrophobicContact CG-CE 4.22Å; A338-M342 VanDerWaalsContact O-CB 3.27Å; A338-M342 WeakPolarHBondContact O-CB 3.37Å; A338-M342 PolarHBondContact O-N 3.48Å; I339-M342 PolarHBondContact O-N 2.89Å; M342-W344 PolarHBondContact O-N 3.12Å; M342-T345 WeakPolarHBondContact O-CB 3.49Å; M342-T345 PolarHBondContact O-N 3.13Å; M342-C346 PolarHBondContact O-N 2.59Å; M342-C346 PolarHBondContact O-SG 2.91Å; M342-C346 VanDerWaalsContact O-SG 3.35Å
343	F	95.8	Very high	94.2	Very high	1 Å²	1	26.1 Å²	26.1	0%	0.004	14%	0.138	C	C	.	.	H	α-helix	trans	-56.9	-49.1	172	165.1	-102.9	0	0	0	111.8	Q150 Y302 A306 I309 I339 N340 I341 T345 C346 V347	Q150-F343 HydrophobicContact CG-CE1 4.5Å; Y302-F343 HydrophobicContact CD2-CE2 4.31Å; Y302-F343 AromaticContact CE2-CE2 3.88Å; Y302-F343 HydrophobicContact CE2-CE2 3.88Å; Y302-F343 HydrophobicContact CE2-CZ 4.18Å; A306-F343 HydrophobicContact CB-CD2 4.23Å; A306-F343 HydrophobicContact CB-CE2 4.03Å; I309-F343 HydrophobicContact CD1-CB 3.34Å; I309-F343 HydrophobicContact CD1-CD1 3.89Å; I309-F343 HydrophobicContact CD1-CD2 3.98Å; I309-F343 HydrophobicContact CD1-CG 3.46Å; I309-F343 VanDerWaalsContact CD1-CG 3.46Å; I309-F343 HydrophobicContact CG1-CB 4.3Å; I339-F343 PolarHBondContact O-N 2.91Å; N340-F343 WeakPolarHBondContact O-CB 3.41Å; N340-F343 PolarHBondContact O-N 2.84Å; I341-F343 VanDerWaalsContact C-N 3.29Å; I341-F343 PolarHBondContact O-N 3.33Å; F343-T345 VanDerWaalsContact C-N 3.29Å; F343-T345 PolarHBondContact O-N 3.3Å; F343-C346 WeakPolarHBondContact O-CB 3Å; F343-C346 PolarHBondContact O-N 3.27Å; F343-V347 HydrophobicContact CD1-CG2 4.5Å; F343-V347 HydrophobicContact CD2-CG2 4.31Å; F343-V347 HydrophobicContact CE1-CG2 4.08Å; F343-V347 HydrophobicContact CE2-CG2 3.89Å; F343-V347 HydrophobicContact CZ-CG2 3.76Å; F343-V347 WeakPolarHBondContact O-CG2 3.21Å; F343-V347 PolarHBondContact O-N 2.9Å
344	W	96.3	Very high	94.1	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-66.8	-30.4	177.6	-70.7	111.3	0	0	0	112.8	T37 G112 Q113 S116 C117 Q150 N340 I341 M342 V347 G348	T37-W344 HydrophobicContact CG2-CB 4.2Å; G112-W344 VanDerWaalsContact C-CH2 3.42Å; G112-W344 VanDerWaalsContact CA-CH2 3.43Å; G112-W344 WeakPolarHBondContact O-CZ2 3.41Å; Q113-W344 HydrophobicContact CB-CE3 4.17Å; S116-W344 WeakPolarHBondContact OG-CZ2 3.31Å; C117-W344 HydrophobicContact CB-CB 4.01Å; C117-W344 HydrophobicContact CB-CG 3.97Å; Q150-W344 HydrophobicContact CG-CH2 4.04Å; Q150-W344 HydrophobicContact CG-CZ2 3.67Å; N340-W344 PolarHBondContact O-N 3.5Å; I341-W344 CarbonylContact O-C 3.56Å; I341-W344 PolarHBondContact O-N 3.05Å; M342-W344 PolarHBondContact O-N 3.12Å; W344-V347 HydrophobicContact CE3-CB 4.18Å; W344-V347 HydrophobicContact CE3-CG1 3.99Å; W344-V347 HydrophobicContact CE3-CG2 4.36Å; W344-V347 HydrophobicContact CZ3-CG1 4.17Å; W344-V347 PolarHBondContact O-N 3.31Å; W344-G348 PolarHBondContact O-N 3.44Å
345	T	96.2	Very high	94	Very high	28 Å²	28	26.3 Å²	26.3	17%	0.172	14%	0.137	C	C	.	.	H	α-helix	trans	-62.9	-49.1	170	-45.4	0	0	0	0	110.7	F33 T37 I341 M342 F343 V347 G348 L349	F33-T345 HydrophobicContact CE2-CG2 4.39Å; F33-T345 HydrophobicContact CZ-CG2 3.93Å; F33-T345 VanDerWaalsContact CZ-OG1 3.32Å; F33-T345 WeakPolarHBondContact CZ-OG1 3.43Å; T37-T345 WeakPolarHBondContact CG2-OG1 3.41Å; T37-T345 PolarHBondContact OG1-OG1 2.99Å; I341-T345 PolarHBondContact O-N 3.46Å; I341-T345 PolarHBondContact O-OG1 2.95Å; M342-T345 WeakPolarHBondContact O-CB 3.49Å; M342-T345 PolarHBondContact O-N 3.13Å; F343-T345 VanDerWaalsContact C-N 3.29Å; F343-T345 PolarHBondContact O-N 3.3Å; T345-V347 VanDerWaalsContact C-N 3.3Å; T345-V347 PolarHBondContact O-N 3.46Å; T345-G348 PolarHBondContact O-N 3.12Å; T345-L349 HydrophobicContact CG2-CD1 4.25Å; T345-L349 HydrophobicContact CG2-CG 4.47Å; T345-L349 WeakPolarHBondContact O-CB 3.31Å; T345-L349 VanDerWaalsContact O-CG 3.29Å; T345-L349 WeakPolarHBondContact O-CG 3.05Å; T345-L349 PolarHBondContact O-N 2.97Å
346	C	95.8	Very high	93.9	Very high	21 Å²	21	28.6 Å²	28.6	14%	0.142	15%	0.145	C	C	.	.	H	α-helix	trans	-57.6	-44.3	175.3	-70.1	0	0	0	0	111.1	V301 M342 F343 L349 R350	V301-C346 HydrophobicContact CG1-CB 3.91Å; V301-C346 WeakPolarHBondContact CG1-O 3.06Å; M342-C346 PolarHBondContact O-N 2.59Å; M342-C346 PolarHBondContact O-SG 2.91Å; M342-C346 VanDerWaalsContact O-SG 3.35Å; F343-C346 WeakPolarHBondContact O-CB 3Å; F343-C346 PolarHBondContact O-N 3.27Å; C346-L349 PolarHBondContact O-N 3.01Å; C346-R350 WeakPolarHBondContact O-CG 3.04Å; C346-R350 PolarHBondContact O-N 3.24Å
347	V	94.3	Very high	93.6	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	15%	0.152	C	C	.	.	H	α-helix	trans	-57.6	-49.1	175.6	164.1	0	0	0	0	111.4	D109 F343 W344 T345 R350	D109-V347 HydrophobicContact CB-CG1 3.65Å; D109-V347 WeakPolarHBondContact OD2-CG1 3.27Å; F343-V347 HydrophobicContact CD1-CG2 4.5Å; F343-V347 HydrophobicContact CD2-CG2 4.31Å; F343-V347 HydrophobicContact CE1-CG2 4.08Å; F343-V347 HydrophobicContact CE2-CG2 3.89Å; F343-V347 HydrophobicContact CZ-CG2 3.76Å; F343-V347 WeakPolarHBondContact O-CG2 3.21Å; F343-V347 PolarHBondContact O-N 2.9Å; W344-V347 HydrophobicContact CE3-CB 4.18Å; W344-V347 HydrophobicContact CE3-CG1 3.99Å; W344-V347 HydrophobicContact CE3-CG2 4.36Å; W344-V347 HydrophobicContact CZ3-CG1 4.17Å; W344-V347 PolarHBondContact O-N 3.31Å; T345-V347 VanDerWaalsContact C-N 3.3Å; T345-V347 PolarHBondContact O-N 3.46Å; V347-R350 WeakPolarHBondContact O-CB 3.09Å; V347-R350 PolarHBondContact O-N 2.99Å; V347-R350 PolarHBondContact O-NE 3.41Å
348	G	95	Very high	93.2	Very high	2 Å²	2	30 Å²	30	2%	0.021	16%	0.157	C	C	.	.	H	α-helix	trans	-63.9	-38.8	177.8	0	0	0	0	0	113.5	W344 T345 R350 F351 Y352	W344-G348 PolarHBondContact O-N 3.44Å; T345-G348 PolarHBondContact O-N 3.12Å; G348-R350 PolarHBondContact O-N 3.37Å; G348-F351 PolarHBondContact O-N 2.79Å; G348-Y352 WeakPolarHBondContact O-CD2 3.39Å
349	L	93.9	Very high	92.6	Very high	89 Å²	89	32 Å²	32	47%	0.466	17%	0.167	S	C	.	.	H	α-helix	trans	-60.5	-29	177.9	-76	172.2	0	0	0	112.9	T345 C346 F351 Y352 L353	T345-L349 HydrophobicContact CG2-CD1 4.25Å; T345-L349 HydrophobicContact CG2-CG 4.47Å; T345-L349 WeakPolarHBondContact O-CB 3.31Å; T345-L349 VanDerWaalsContact O-CG 3.29Å; T345-L349 WeakPolarHBondContact O-CG 3.05Å; T345-L349 PolarHBondContact O-N 2.97Å; C346-L349 PolarHBondContact O-N 3.01Å; L349-F351 VanDerWaalsContact C-N 3.27Å; L349-F351 PolarHBondContact O-N 3.2Å; L349-Y352 WeakPolarHBondContact O-CB 3.39Å; L349-Y352 PolarHBondContact O-N 3.07Å; L349-Y352 VanDerWaalsContact O-N 3.14Å; L349-L353 WeakPolarHBondContact O-CG 3.08Å; L349-L353 PolarHBondContact O-N 3.44Å
350	R	93.4	Very high	92	Very high	9 Å²	9	33.2 Å²	33.2	3%	0.034	17%	0.17	C	C	.	.	H	α-helix	trans	-57	-39.8	177.9	-63.7	-177.3	-62.9	179.9	-4.2	112.5	D109 S153 S298 V301 Y302 C346 V347 G348 L353 Y354	D109-R350 IonicContact OD1-NH2 2.69Å; D109-R350 PolarHBondContact OD1-NH2 3.3Å; D109-R350 IonicContact OD2-CZ 3.95Å; D109-R350 IonicContact OD2-NH2 3.6Å; D109-R350 PolarHBondContact OD2-NH2 3.32Å; S153-R350 PolarHBondContact OG-NH2 3.04Å; S298-R350 WeakPolarHBondContact OG-CD 3.45Å; V301-R350 HydrophobicContact CB-CG 4.3Å; V301-R350 HydrophobicContact CG1-CG 3.86Å; Y302-R350 VanDerWaalsContact CD2-NH1 3.29Å; C346-R350 WeakPolarHBondContact O-CG 3.04Å; C346-R350 PolarHBondContact O-N 3.24Å; V347-R350 WeakPolarHBondContact O-CB 3.09Å; V347-R350 PolarHBondContact O-N 2.99Å; V347-R350 PolarHBondContact O-NE 3.41Å; G348-R350 PolarHBondContact O-N 3.37Å; R350-L353 WeakPolarHBondContact O-CB 3.41Å; R350-L353 PolarHBondContact O-N 3.19Å; R350-Y354 PolarHBondContact O-N 3.02Å
351	F	93.8	Very high	91.6	Very high	11 Å²	11	33.2 Å²	33.2	5%	0.048	17%	0.17	C	C	.	.	H	α-helix	trans	-70.1	-35.7	179.4	-62.4	-63.7	0	0	0	112.3	T48 L105 A106 D109 G348 L349 Y354 I355	T48-F351 HydrophobicContact CG2-CD1 3.96Å; L105-F351 HydrophobicContact CG-CZ 4.34Å; A106-F351 HydrophobicContact CB-CD1 4.25Å; A106-F351 HydrophobicContact CB-CE1 3.6Å; A106-F351 HydrophobicContact CB-CZ 3.98Å; D109-F351 HydrophobicContact CB-CE2 3.59Å; D109-F351 HydrophobicContact CB-CZ 3.81Å; D109-F351 VanDerWaalsContact OD2-CE2 3.29Å; D109-F351 WeakPolarHBondContact OD2-CE2 3.49Å; D109-F351 WeakPolarHBondContact OD2-CZ 3.33Å; G348-F351 PolarHBondContact O-N 2.79Å; L349-F351 VanDerWaalsContact C-N 3.27Å; L349-F351 PolarHBondContact O-N 3.2Å; F351-Y354 WeakPolarHBondContact O-CB 3.07Å; F351-Y354 PolarHBondContact O-N 3.06Å; F351-I355 VanDerWaalsContact O-CG1 3.3Å; F351-I355 WeakPolarHBondContact O-CG1 3.17Å; F351-I355 PolarHBondContact O-N 2.88Å
352	Y	94.5	Very high	91.3	Very high	44 Å²	44	39.4 Å²	39.4	17%	0.173	19%	0.194	C	C	.	.	H	α-helix	trans	-66.7	-40.5	172.3	-71.5	-71.2	0	0	0	112	F40 G348 L349 Y354 I355 F356	F40-Y352 HydrophobicContact CB-CE2 4.44Å; F40-Y352 VanDerWaalsContact O-CE2 3.31Å; F40-Y352 WeakPolarHBondContact O-CE2 3.35Å; F40-Y352 PolarHBondContact O-OH 3.4Å; G348-Y352 WeakPolarHBondContact O-CD2 3.39Å; L349-Y352 WeakPolarHBondContact O-CB 3.39Å; L349-Y352 PolarHBondContact O-N 3.07Å; L349-Y352 VanDerWaalsContact O-N 3.14Å; Y352-Y354 VanDerWaalsContact C-N 3.28Å; Y352-Y354 PolarHBondContact O-N 3.19Å; Y352-I355 PolarHBondContact O-N 3.16Å; Y352-F356 AromaticContact CD1-CE2 3.78Å; Y352-F356 HydrophobicContact CD1-CE2 3.78Å; Y352-F356 HydrophobicContact CD1-CZ 4.3Å; Y352-F356 HydrophobicContact CG-CE2 4.3Å; Y352-F356 WeakPolarHBondContact O-CB 3.43Å; Y352-F356 WeakPolarHBondContact O-CD2 3.37Å; Y352-F356 WeakPolarHBondContact O-CG 3Å; Y352-F356 PolarHBondContact O-N 3.46Å
353	L	91.5	Very high	91	Very high	68 Å²	68	41.6 Å²	41.6	36%	0.356	20%	0.198	S	C	.	.	H	α-helix	trans	-59	-42.4	172.4	-68.6	174	0	0	0	110.8	M294 V297 V301 L349 R350 S357	M294-L353 VanDerWaalsContact CE-C 3.42Å; M294-L353 HydrophobicContact CE-CB 3.89Å; M294-L353 WeakPolarHBondContact CE-O 3.39Å; V297-L353 HydrophobicContact CG1-CD1 3.96Å; V301-L353 HydrophobicContact CG2-CD1 3.98Å; L349-L353 WeakPolarHBondContact O-CG 3.08Å; L349-L353 PolarHBondContact O-N 3.44Å; R350-L353 WeakPolarHBondContact O-CB 3.41Å; R350-L353 PolarHBondContact O-N 3.19Å; L353-S357 WeakPolarHBondContact O-CB 3.42Å; L353-S357 PolarHBondContact O-N 3.35Å; L353-S357 PolarHBondContact O-OG 3.1Å
354	Y	87.9	Confident	90.6	Very high	27 Å²	27	43 Å²	43	11%	0.106	21%	0.205	C	C	.	.	H	α-helix	trans	-61.4	-47.2	174.1	179.6	-100.5	0	0	0	112.8	T48 Y51 M102 R350 F351 Y352 S357 V361	T48-Y354 HydrophobicContact CG2-CD1 3.96Å; T48-Y354 HydrophobicContact CG2-CE1 4.22Å; Y51-Y354 HydrophobicContact CD1-CE1 4.25Å; Y51-Y354 HydrophobicContact CE1-CE1 4.23Å; M102-Y354 HydrophobicContact CE-CE2 3.89Å; M102-Y354 HydrophobicContact SD-CD2 4.06Å; M102-Y354 HydrophobicContact SD-CE2 3.59Å; M102-Y354 VanDerWaalsContact SD-CE2 3.59Å; R350-Y354 PolarHBondContact O-N 3.02Å; F351-Y354 WeakPolarHBondContact O-CB 3.07Å; F351-Y354 PolarHBondContact O-N 3.06Å; Y352-Y354 VanDerWaalsContact C-N 3.28Å; Y352-Y354 PolarHBondContact O-N 3.19Å; Y354-S357 PolarHBondContact O-OG 3.42Å; Y354-S357 VanDerWaalsContact O-OG 3.05Å; Y354-V361 HydrophobicContact CE1-CG1 4.36Å; Y354-V361 HydrophobicContact CE1-CG2 4.05Å
355	I	90.1	Very high	90.2	Very high	14 Å²	14	44.1 Å²	44.1	7%	0.072	21%	0.211	C	C	.	.	H	α-helix	trans	-63.6	-48.1	179.6	-69.1	165.7	0	0	0	111.1	L47 F351 Y352 V361 R362 M365	L47-I355 HydrophobicContact CB-CD1 4.31Å; F351-I355 VanDerWaalsContact O-CG1 3.3Å; F351-I355 WeakPolarHBondContact O-CG1 3.17Å; F351-I355 PolarHBondContact O-N 2.88Å; Y352-I355 PolarHBondContact O-N 3.16Å; I355-V361 HydrophobicContact CB-CG1 4.42Å; I355-V361 HydrophobicContact CG1-CG1 4.29Å; I355-V361 HydrophobicContact CG2-CG1 4.47Å; I355-R362 WeakPolarHBondContact O-CG 3.37Å; I355-M365 HydrophobicContact CD1-CE 4.2Å; I355-M365 HydrophobicContact CG2-CG 4.48Å
356	F	90	Very high	90	Very high	127 Å²	127	49.6 Å²	49.6	56%	0.557	23%	0.233	S	C	*	.	H	α-helix	trans	-78.7	-32.5	-172.9	-68.3	-51.4	0	0	0	113.7	Y352 S358 R362	Y352-F356 AromaticContact CD1-CE2 3.78Å; Y352-F356 HydrophobicContact CD1-CE2 3.78Å; Y352-F356 HydrophobicContact CD1-CZ 4.3Å; Y352-F356 HydrophobicContact CG-CE2 4.3Å; Y352-F356 WeakPolarHBondContact O-CB 3.43Å; Y352-F356 WeakPolarHBondContact O-CD2 3.37Å; Y352-F356 WeakPolarHBondContact O-CG 3Å; Y352-F356 PolarHBondContact O-N 3.46Å; F356-S358 VanDerWaalsContact C-N 3.27Å; F356-S358 PolarHBondContact O-N 3.15Å; F356-R362 PolarHBondContact O-NE 3.42Å
357	S	85.9	Confident	89.7	Confident	34 Å²	34	53.5 Å²	53.5	24%	0.238	25%	0.252	C	S	.	.	H	α-helix	trans	-63.3	-33.6	-179.8	58.7	0	0	0	0	112.9	F290 M294 L353 Y354 P359	F290-S357 WeakPolarHBondContact CE2-O 3.47Å; F290-S357 VanDerWaalsContact CZ-O 3.25Å; F290-S357 WeakPolarHBondContact CZ-O 3.11Å; F290-S357 WeakPolarHBondContact CZ-OG 3.29Å; M294-S357 WeakPolarHBondContact CE-OG 3.38Å; M294-S357 WeakPolarHBondContact SD-CB 3.33Å; M294-S357 PolarHBondContact SD-OG 3.43Å; L353-S357 WeakPolarHBondContact O-CB 3.42Å; L353-S357 PolarHBondContact O-N 3.35Å; L353-S357 PolarHBondContact O-OG 3.1Å; Y354-S357 PolarHBondContact O-OG 3.42Å; Y354-S357 VanDerWaalsContact O-OG 3.05Å; S357-P359 WeakPolarHBondContact O-CD 3.19Å
358	S	84.5	Confident	89.4	Confident	17 Å²	17	53.9 Å²	53.9	12%	0.119	25%	0.254	C	S	.	.			trans	-99.6	113	-174.5	179.9	0	0	0	0	111.5	F356 R360 V361 R362	F356-S358 VanDerWaalsContact C-N 3.27Å; F356-S358 PolarHBondContact O-N 3.15Å; S358-R360 PolarHBondContact O-N 2.89Å; S358-R360 VanDerWaalsContact O-N 3.14Å; S358-R360 PolarHBondContact OG-N 3.03Å; S358-V361 VanDerWaalsContact CB-CG2 3.49Å; S358-V361 PolarHBondContact O-N 3.44Å; S358-V361 WeakPolarHBondContact OG-CG2 3.44Å; S358-V361 PolarHBondContact OG-N 3.35Å; S358-R362 PolarHBondContact O-N 3.15Å
359	P	83.9	Confident	89.2	Confident	76 Å²	76	59.4 Å²	59.4	49%	0.494	28%	0.277	S	S	.	.	H	α-helix	trans	-60	-23.1	172.6	-21.3	32.4	0	0	0	113.2	S357 R363	S357-P359 WeakPolarHBondContact O-CD 3.19Å; P359-R363 WeakPolarHBondContact O-CG 3.24Å; P359-R363 PolarHBondContact O-N 3.39Å; P359-R363 PolarHBondContact O-NE 2.83Å
360	R	83.2	Confident	89.2	Confident	51 Å²	51	63.3 Å²	63.3	19%	0.192	29%	0.286	C	S	.	.	H	α-helix	trans	-70.6	-55.2	173.8	-172.7	-176.5	-63.4	162.5	13.6	110	Q91 S92 E287 S358 R362 R363 D364	Q91-R360 VanDerWaalsContact CG-NH2 3.34Å; Q91-R360 VanDerWaalsContact OE1-NH2 3.09Å; S92-R360 PolarHBondContact O-NH1 3.36Å; E287-R360 IonicContact OE1-CZ 3.59Å; E287-R360 IonicContact OE1-NH1 3.03Å; E287-R360 IonicContact OE1-NH2 2.72Å; E287-R360 PolarHBondContact OE1-NH2 3.13Å; S358-R360 PolarHBondContact O-N 2.89Å; S358-R360 VanDerWaalsContact O-N 3.14Å; S358-R360 PolarHBondContact OG-N 3.03Å; R360-R362 VanDerWaalsContact C-N 3.27Å; R360-R362 PolarHBondContact O-N 2.58Å; R360-R363 PolarHBondContact O-N 3.08Å; R360-R363 VanDerWaalsContact O-N 3.08Å; R360-D364 PolarHBondContact O-N 2.72Å
361	V	86.2	Confident	89	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.012	30%	0.303	C	S	.	.	H	α-helix	trans	-55.7	-44.5	179	-178.9	0	0	0	0	110.2	Y51 Y354 I355 S358 R363 D364 M365	Y51-V361 HydrophobicContact CD1-CG1 4.25Å; Y51-V361 HydrophobicContact CD2-CG1 4.47Å; Y51-V361 HydrophobicContact CE1-CB 4.43Å; Y51-V361 HydrophobicContact CE1-CG1 4.04Å; Y51-V361 HydrophobicContact CE1-CG2 3.79Å; Y51-V361 HydrophobicContact CE2-CG1 4.28Å; Y51-V361 HydrophobicContact CG-CG1 4.47Å; Y354-V361 HydrophobicContact CE1-CG1 4.36Å; Y354-V361 HydrophobicContact CE1-CG2 4.05Å; I355-V361 HydrophobicContact CB-CG1 4.42Å; I355-V361 HydrophobicContact CG1-CG1 4.29Å; I355-V361 HydrophobicContact CG2-CG1 4.47Å; S358-V361 VanDerWaalsContact CB-CG2 3.49Å; S358-V361 PolarHBondContact O-N 3.44Å; S358-V361 WeakPolarHBondContact OG-CG2 3.44Å; S358-V361 PolarHBondContact OG-N 3.35Å; V361-R363 PolarHBondContact O-N 2.97Å; V361-D364 PolarHBondContact O-N 3.25Å; V361-M365 HydrophobicContact CG1-CG 3.88Å; V361-M365 VanDerWaalsContact O-CB 3.3Å; V361-M365 WeakPolarHBondContact O-CB 3.14Å; V361-M365 WeakPolarHBondContact O-CG 3.47Å; V361-M365 PolarHBondContact O-N 3.14Å
362	R	89.8	Confident	88.8	Confident	130 Å²	130	69.2 Å²	69.2	49%	0.491	32%	0.317	S	S	.	.	H	α-helix	trans	-56.6	-45.8	176.6	-70.8	-170.4	-79.6	165	-5	114	I355 F356 S358 R360 M365 F366	I355-R362 WeakPolarHBondContact O-CG 3.37Å; F356-R362 PolarHBondContact O-NE 3.42Å; S358-R362 PolarHBondContact O-N 3.15Å; R360-R362 VanDerWaalsContact C-N 3.27Å; R360-R362 PolarHBondContact O-N 2.58Å; R362-M365 PolarHBondContact O-N 3.4Å; R362-F366 WeakPolarHBondContact O-CB 3.4Å; R362-F366 PolarHBondContact O-N 2.67Å
363	R	88.4	Confident	88.7	Confident	121 Å²	121	70.7 Å²	70.7	46%	0.457	33%	0.328	S	S	.	.	H	α-helix	trans	-66.7	-42.7	178.9	-74.8	-175.5	-64.3	157	4.5	111.6	P359 R360 V361 M365 F366 L367	P359-R363 WeakPolarHBondContact O-CG 3.24Å; P359-R363 PolarHBondContact O-N 3.39Å; P359-R363 PolarHBondContact O-NE 2.83Å; R360-R363 PolarHBondContact O-N 3.08Å; R360-R363 VanDerWaalsContact O-N 3.08Å; V361-R363 PolarHBondContact O-N 2.97Å; R363-M365 VanDerWaalsContact C-N 3.33Å; R363-F366 PolarHBondContact O-N 3.03Å; R363-L367 PolarHBondContact O-N 3.21Å
364	D	87.4	Confident	88.8	Confident	30 Å²	30	71.2 Å²	71.2	16%	0.16	33%	0.333	C	S	.	.	H	α-helix	trans	-64.9	-40.8	178.5	-64	-16.5	0	0	0	111.4	Y51 F55 R360 V361 L367 I368	Y51-D364 HydrophobicContact CD2-CB 4.2Å; Y51-D364 HydrophobicContact CE2-CB 3.44Å; Y51-D364 VanDerWaalsContact CE2-CB 3.44Å; Y51-D364 WeakPolarHBondContact CE2-OD2 3.28Å; Y51-D364 PolarHBondContact OH-OD2 3.49Å; F55-D364 HydrophobicContact CE2-CB 3.64Å; F55-D364 HydrophobicContact CZ-CB 3.48Å; F55-D364 VanDerWaalsContact CZ-CB 3.48Å; F55-D364 VanDerWaalsContact CZ-OD2 3.27Å; F55-D364 WeakPolarHBondContact CZ-OD2 2.91Å; R360-D364 PolarHBondContact O-N 2.72Å; V361-D364 PolarHBondContact O-N 3.25Å; D364-L367 WeakPolarHBondContact O-CB 3.46Å; D364-L367 PolarHBondContact O-N 3.38Å; D364-I368 WeakPolarHBondContact O-CG1 3.41Å; D364-I368 PolarHBondContact O-N 2.9Å
365	M	88.9	Confident	88.9	Confident	25 Å²	25	76.6 Å²	76.6	12%	0.123	36%	0.357	C	S	.	.	H	α-helix	trans	-64.5	-40.7	175.2	-70.8	-59	-92.3	0	0	111.7	L47 Y51 I355 V361 R362 R363 L367 I368 F369	L47-M365 HydrophobicContact CB-CE 3.47Å; L47-M365 VanDerWaalsContact CB-CE 3.47Å; L47-M365 HydrophobicContact CD1-CE 4.34Å; L47-M365 HydrophobicContact CD2-CE 3.76Å; L47-M365 HydrophobicContact CG-CE 4.04Å; Y51-M365 HydrophobicContact CD2-CG 4.31Å; Y51-M365 HydrophobicContact CD2-SD 3.78Å; Y51-M365 HydrophobicContact CG-SD 3.98Å; I355-M365 HydrophobicContact CD1-CE 4.2Å; I355-M365 HydrophobicContact CG2-CG 4.48Å; V361-M365 HydrophobicContact CG1-CG 3.88Å; V361-M365 VanDerWaalsContact O-CB 3.3Å; V361-M365 WeakPolarHBondContact O-CB 3.14Å; V361-M365 WeakPolarHBondContact O-CG 3.47Å; V361-M365 PolarHBondContact O-N 3.14Å; R362-M365 PolarHBondContact O-N 3.4Å; R363-M365 VanDerWaalsContact C-N 3.33Å; M365-L367 VanDerWaalsContact C-N 3.28Å; M365-L367 PolarHBondContact O-N 3.41Å; M365-I368 PolarHBondContact O-N 3.25Å; M365-I368 HydrophobicContact SD-CD1 4.09Å; M365-F369 VanDerWaalsContact O-CB 3.32Å; M365-F369 WeakPolarHBondContact O-CB 3.46Å; M365-F369 PolarHBondContact O-N 2.81Å
366	F	91.5	Very high	88.9	Confident	143 Å²	143	82.6 Å²	82.6	63%	0.627	38%	0.383	S	S	*	.	H	α-helix	trans	-61.8	-38.2	172.8	-171.9	-97.6	0	0	0	111.9	R362 R363 F369 R370	R362-F366 WeakPolarHBondContact O-CB 3.4Å; R362-F366 PolarHBondContact O-N 2.67Å; R363-F366 PolarHBondContact O-N 3.03Å; F366-F369 PolarHBondContact O-N 3.13Å; F366-R370 WeakPolarHBondContact O-CB 3.19Å; F366-R370 PolarHBondContact O-N 3.3Å
367	L	89.9	Confident	88.9	Confident	103 Å²	103	83.3 Å²	83.3	54%	0.539	39%	0.388	S	S	.	.	H	α-helix	trans	-68.2	-43.5	175.7	-175.8	133.3	0	0	0	112	R363 D364 M365 F369 R370 I371	R363-L367 PolarHBondContact O-N 3.21Å; D364-L367 WeakPolarHBondContact O-CB 3.46Å; D364-L367 PolarHBondContact O-N 3.38Å; M365-L367 VanDerWaalsContact C-N 3.28Å; M365-L367 PolarHBondContact O-N 3.41Å; L367-F369 VanDerWaalsContact C-N 3.33Å; L367-F369 PolarHBondContact O-N 2.8Å; L367-R370 PolarHBondContact O-N 2.65Å; L367-I371 HydrophobicContact CD2-CD1 3.56Å; L367-I371 HydrophobicContact CG-CD1 4.22Å; L367-I371 VanDerWaalsContact O-CG1 3.28Å; L367-I371 WeakPolarHBondContact O-CG1 3.42Å; L367-I371 PolarHBondContact O-N 3.19Å
368	I	88.6	Confident	88.9	Confident	8 Å²	8	85.6 Å²	85.6	4%	0.041	40%	0.403	C	S	.	.	H	α-helix	trans	-58.9	-47.1	173.2	-69.4	167.6	0	0	0	110	Y51 M54 F55 D364 M365 R370 I371 I372	Y51-I368 HydrophobicContact CD2-CD1 4Å; M54-I368 HydrophobicContact CE-CG1 4.1Å; M54-I368 HydrophobicContact SD-CD1 4.06Å; M54-I368 HydrophobicContact SD-CG1 4.04Å; M54-I368 HydrophobicContact SD-CG2 4.12Å; F55-I368 HydrophobicContact CE2-CD1 4.26Å; D364-I368 WeakPolarHBondContact O-CG1 3.41Å; D364-I368 PolarHBondContact O-N 2.9Å; M365-I368 PolarHBondContact O-N 3.25Å; M365-I368 HydrophobicContact SD-CD1 4.09Å; I368-R370 PolarHBondContact O-N 3.16Å; I368-I371 PolarHBondContact O-N 2.92Å; I368-I372 HydrophobicContact CG2-CD1 3.69Å; I368-I372 HydrophobicContact CG2-CG1 4.37Å; I368-I372 VanDerWaalsContact O-CG1 3.29Å; I368-I372 WeakPolarHBondContact O-CG1 3.35Å; I368-I372 PolarHBondContact O-N 3.32Å
369	F	90.6	Very high	88.8	Confident	118 Å²	118	90.4 Å²	90.4	52%	0.518	43%	0.427	S	S	.	.	H	α-helix	trans	-60.1	-44.2	177.8	-175.3	-105.6	0	0	0	111.9	M365 F366 L367 I371 I372 L373	M365-F369 VanDerWaalsContact O-CB 3.32Å; M365-F369 WeakPolarHBondContact O-CB 3.46Å; M365-F369 PolarHBondContact O-N 2.81Å; F366-F369 PolarHBondContact O-N 3.13Å; L367-F369 VanDerWaalsContact C-N 3.33Å; L367-F369 PolarHBondContact O-N 2.8Å; F369-I371 PolarHBondContact O-N 3.46Å; F369-I372 PolarHBondContact O-N 3.27Å; F369-L373 HydrophobicContact CD1-CD1 3.75Å; F369-L373 HydrophobicContact CD1-CG 4.26Å; F369-L373 HydrophobicContact CE1-CD1 3.25Å; F369-L373 HydrophobicContact CE1-CG 3.93Å; F369-L373 HydrophobicContact CE2-CG 4.45Å; F369-L373 HydrophobicContact CZ-CD1 3.73Å; F369-L373 HydrophobicContact CZ-CD2 4.22Å; F369-L373 HydrophobicContact CZ-CG 4.02Å; F369-L373 WeakPolarHBondContact O-CG 3.03Å; F369-L373 PolarHBondContact O-N 2.99Å
370	R	92.8	Very high	88.6	Confident	172 Å²	172	90.2 Å²	90.2	65%	0.649	43%	0.427	S	S	*	.	H	α-helix	trans	-61.6	-41.8	175.1	-171	178.2	179.7	-179	0.6	112	F366 L367 I368 L373 V374	F366-R370 WeakPolarHBondContact O-CB 3.19Å; F366-R370 PolarHBondContact O-N 3.3Å; L367-R370 PolarHBondContact O-N 2.65Å; I368-R370 PolarHBondContact O-N 3.16Å; R370-L373 PolarHBondContact O-N 3.34Å; R370-V374 WeakPolarHBondContact O-CB 3.47Å; R370-V374 VanDerWaalsContact O-CG2 3.23Å; R370-V374 WeakPolarHBondContact O-CG2 3.34Å; R370-V374 PolarHBondContact O-N 3.39Å
371	I	89.8	Confident	87.7	Confident	75 Å²	75	91.2 Å²	91.2	39%	0.385	44%	0.44	S	S	.	.	H	α-helix	trans	-63.7	-43	176.5	-69.4	166.2	0	0	0	110.8	L367 I368 F369 V374 K375	L367-I371 HydrophobicContact CD2-CD1 3.56Å; L367-I371 HydrophobicContact CG-CD1 4.22Å; L367-I371 VanDerWaalsContact O-CG1 3.28Å; L367-I371 WeakPolarHBondContact O-CG1 3.42Å; L367-I371 PolarHBondContact O-N 3.19Å; I368-I371 PolarHBondContact O-N 2.92Å; F369-I371 PolarHBondContact O-N 3.46Å; I371-V374 PolarHBondContact O-N 2.04Å; I371-K375 WeakPolarHBondContact O-CB 3.46Å; I371-K375 WeakPolarHBondContact O-CG 3.34Å; I371-K375 PolarHBondContact O-N 2.99Å
372	I	89.6	Confident	86.9	Confident	69 Å²	69	97.1 Å²	97.1	35%	0.354	47%	0.47	S	S	.	.	H	α-helix	trans	-62.2	-49.2	177.4	-70.1	169.5	0	0	0	110.1	I368 F369 V374 K375 F376	I368-I372 HydrophobicContact CG2-CD1 3.69Å; I368-I372 HydrophobicContact CG2-CG1 4.37Å; I368-I372 VanDerWaalsContact O-CG1 3.29Å; I368-I372 WeakPolarHBondContact O-CG1 3.35Å; I368-I372 PolarHBondContact O-N 3.32Å; F369-I372 PolarHBondContact O-N 3.27Å; I372-V374 PolarHBondContact O-N 3.46Å; I372-K375 PolarHBondContact O-N 3.32Å; I372-F376 HydrophobicContact CG2-CD2 3.54Å; I372-F376 HydrophobicContact CG2-CE2 3.47Å; I372-F376 VanDerWaalsContact CG2-CE2 3.47Å; I372-F376 VanDerWaalsContact O-CD2 3.25Å; I372-F376 WeakPolarHBondContact O-CD2 2.95Å; I372-F376 PolarHBondContact O-N 3.34Å
373	L	91.7	Very high	85.5	Confident	75 Å²	75	101.5 Å²	101.5	39%	0.393	49%	0.487	S	S	.	.	H	α-helix	trans	-60	-44.2	177.4	-75.9	-177.9	0	0	0	112.7	F369 R370 K375 F376 H377	F369-L373 HydrophobicContact CD1-CD1 3.75Å; F369-L373 HydrophobicContact CD1-CG 4.26Å; F369-L373 HydrophobicContact CE1-CD1 3.25Å; F369-L373 HydrophobicContact CE1-CG 3.93Å; F369-L373 HydrophobicContact CE2-CG 4.45Å; F369-L373 HydrophobicContact CZ-CD1 3.73Å; F369-L373 HydrophobicContact CZ-CD2 4.22Å; F369-L373 HydrophobicContact CZ-CG 4.02Å; F369-L373 WeakPolarHBondContact O-CG 3.03Å; F369-L373 PolarHBondContact O-N 2.99Å; R370-L373 PolarHBondContact O-N 3.34Å; L373-K375 VanDerWaalsContact C-N 3.34Å; L373-K375 PolarHBondContact O-N 3Å; L373-F376 PolarHBondContact O-N 2.9Å; L373-H377 WeakPolarHBondContact O-CB 3.42Å; L373-H377 PolarHBondContact O-CD2 3.44Å; L373-H377 VanDerWaalsContact O-CD2 3.31Å; L373-H377 PolarHBondContact O-N 3.45Å
374	V	93.2	Very high	84.1	Confident	78 Å²	78	105.8 Å²	105.8	47%	0.473	50%	0.503	S	S	.	.	H	α-helix	trans	-62	-43.4	176.6	169.9	0	0	0	0	110.5	R370 I371 I372 F376 H377 C378	R370-V374 WeakPolarHBondContact O-CB 3.47Å; R370-V374 VanDerWaalsContact O-CG2 3.23Å; R370-V374 WeakPolarHBondContact O-CG2 3.34Å; R370-V374 PolarHBondContact O-N 3.39Å; I371-V374 PolarHBondContact O-N 2.04Å; I372-V374 PolarHBondContact O-N 3.46Å; V374-F376 PolarHBondContact O-N 2.91Å; V374-H377 PolarHBondContact O-N 3.32Å; V374-C378 WeakPolarHBondContact O-CB 3.33Å; V374-C378 PolarHBondContact O-N 2.03Å; V374-C378 PolarHBondContact O-SG 3.49Å
375	K	90.7	Very high	83	Confident	140 Å²	140	112.3 Å²	112.3	61%	0.609	53%	0.53	S	S	*	.	H	α-helix	trans	-61.8	-43.3	175.3	-79.6	-169.4	173.5	-169.5	0	112.3	I371 I372 L373 H377 C378 L379	I371-K375 WeakPolarHBondContact O-CB 3.46Å; I371-K375 WeakPolarHBondContact O-CG 3.34Å; I371-K375 PolarHBondContact O-N 2.99Å; I372-K375 PolarHBondContact O-N 3.32Å; L373-K375 VanDerWaalsContact C-N 3.34Å; L373-K375 PolarHBondContact O-N 3Å; K375-H377 VanDerWaalsContact C-N 3.35Å; K375-H377 PolarHBondContact O-N 3.28Å; K375-C378 PolarHBondContact O-N 3.27Å; K375-L379 VanDerWaalsContact O-CG 3.27Å; K375-L379 WeakPolarHBondContact O-CG 3.48Å; K375-L379 PolarHBondContact O-N 3.36Å
376	F	90.5	Very high	81.7	Confident	141 Å²	141	114.6 Å²	114.6	62%	0.618	55%	0.549	S	S	*	.	H	α-helix	trans	-62.5	-41.2	175.4	-85.9	-68.5	0	0	0	112.1	I372 L373 V374 L379 S380	I372-F376 HydrophobicContact CG2-CD2 3.54Å; I372-F376 HydrophobicContact CG2-CE2 3.47Å; I372-F376 VanDerWaalsContact CG2-CE2 3.47Å; I372-F376 VanDerWaalsContact O-CD2 3.25Å; I372-F376 WeakPolarHBondContact O-CD2 2.95Å; I372-F376 PolarHBondContact O-N 3.34Å; L373-F376 PolarHBondContact O-N 2.9Å; V374-F376 PolarHBondContact O-N 2.91Å; F376-L379 PolarHBondContact O-N 2.95Å; F376-S380 PolarHBondContact O-N 3.47Å
377	H	89.1	Confident	80.3	Confident	141 Å²	141	115 Å²	115	65%	0.653	55%	0.55	S	S	*	.	H	α-helix	trans	-65.9	-39.6	174.7	-86.9	-70	0	0	0	113	L373 V374 K375 L379 S380 P381	L373-H377 WeakPolarHBondContact O-CB 3.42Å; L373-H377 PolarHBondContact O-CD2 3.44Å; L373-H377 VanDerWaalsContact O-CD2 3.31Å; L373-H377 PolarHBondContact O-N 3.45Å; V374-H377 PolarHBondContact O-N 3.32Å; K375-H377 VanDerWaalsContact C-N 3.35Å; K375-H377 PolarHBondContact O-N 3.28Å; H377-L379 VanDerWaalsContact C-N 3.3Å; H377-L379 PolarHBondContact O-N 3.33Å; H377-S380 WeakPolarHBondContact O-CB 3.48Å; H377-S380 PolarHBondContact O-N 3.4Å; H377-P381 WeakPolarHBondContact O-CD 3.4Å
378	C	86.6	Confident	79.1	Confident	83 Å²	83	119.1 Å²	119.1	56%	0.561	56%	0.559	S	S	*	*	H	α-helix	trans	-69.8	-23.9	176.3	-69.9	0	0	0	0	113.4	V374 K375 P381	V374-C378 WeakPolarHBondContact O-CB 3.33Å; V374-C378 PolarHBondContact O-N 2.03Å; V374-C378 PolarHBondContact O-SG 3.49Å; K375-C378 PolarHBondContact O-N 3.27Å; C378-P381 VanDerWaalsContact O-CD 3.25Å; C378-P381 WeakPolarHBondContact O-CD 3.18Å; C378-P381 VanDerWaalsContact O-CG 3.25Å; C378-P381 WeakPolarHBondContact O-CG 3.28Å
379	L	81.9	Confident	77.8	Confident	117 Å²	117	124.3 Å²	124.3	61%	0.613	59%	0.586	S	S	*	*	H	α-helix	trans	-80.2	-26.4	173.9	-71.2	168.2	0	0	0	112.8	K375 F376 H377	K375-L379 VanDerWaalsContact O-CG 3.27Å; K375-L379 WeakPolarHBondContact O-CG 3.48Å; K375-L379 PolarHBondContact O-N 3.36Å; F376-L379 PolarHBondContact O-N 2.95Å; H377-L379 VanDerWaalsContact C-N 3.3Å; H377-L379 PolarHBondContact O-N 3.33Å
380	S	79.5	Confident	76.4	Confident	73 Å²	73	124.7 Å²	124.7	51%	0.51	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.4	-41.5	177.3	-167.3	0	0	0	0	116.2	F376 H377 I382 R383	F376-S380 PolarHBondContact O-N 3.47Å; H377-S380 WeakPolarHBondContact O-CB 3.48Å; H377-S380 PolarHBondContact O-N 3.4Å; S380-I382 PolarHBondContact O-N 3.06Å; S380-I382 VanDerWaalsContact O-N 3.12Å; S380-R383 PolarHBondContact O-N 2.98Å
381	P	66.1	Low	74.8	Confident	71 Å²	71	120.6 Å²	120.6	46%	0.461	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.4	-18.9	-175.3	21.5	-34.5	0	0	0	115.1	H377 C378 R383 R384	H377-P381 WeakPolarHBondContact O-CD 3.4Å; C378-P381 VanDerWaalsContact O-CD 3.25Å; C378-P381 WeakPolarHBondContact O-CD 3.18Å; C378-P381 VanDerWaalsContact O-CG 3.25Å; C378-P381 WeakPolarHBondContact O-CG 3.28Å; P381-R383 PolarHBondContact O-N 3.37Å; P381-R384 PolarHBondContact O-N 3.09Å; P381-R384 VanDerWaalsContact O-N 3.16Å
382	I	67.6	Low	73.2	Confident	126 Å²	126	120.4 Å²	120.4	65%	0.646	59%	0.589	S	S	*	*	H	α-helix	trans	-65	-30.1	178.2	-65	174.4	0	0	0	111.1	S380 R384	S380-I382 PolarHBondContact O-N 3.06Å; S380-I382 VanDerWaalsContact O-N 3.12Å; I382-R384 PolarHBondContact O-N 3.19Å
383	R	60.3	Low	71.7	Confident	222 Å²	222	124.1 Å²	124.1	84%	0.838	61%	0.605	S	S	*	*	H	α-helix	trans	-72.7	-22.4	176	-103.2	-177.7	177.5	174.8	-0.3	114.3	S380 P381	S380-R383 PolarHBondContact O-N 2.98Å; P381-R383 PolarHBondContact O-N 3.37Å
384	R	60.9	Low	70.1	Confident	211 Å²	211	124 Å²	124	80%	0.796	61%	0.61	S	S	*	*	H	α-helix	trans	-80.1	-29.5	179.7	-75.5	-172	-175.6	172.2	1.7	113.5	P381 I382 R388	P381-R384 PolarHBondContact O-N 3.09Å; P381-R384 VanDerWaalsContact O-N 3.16Å; I382-R384 PolarHBondContact O-N 3.19Å; R384-R388 PolarHBondContact O-N 3.05Å
385	K	62.5	Low	68.4	Low	167 Å²	167	127.9 Å²	127.9	73%	0.726	62%	0.621	S	S	*	*	H	α-helix	trans	-72.9	-34.3	176	-79.5	-170.9	175.9	-176.9	0	112.7	K387 R388 N389	K385-K387 PolarHBondContact O-N 3.16Å; K385-R388 PolarHBondContact O-N 3Å; K385-N389 PolarHBondContact O-N 3.11Å
386	S	62.3	Low	66.7	Low	73 Å²	73	124.7 Å²	124.7	51%	0.51	62%	0.616	S	S	.	*	H	α-helix	trans	-62.3	-44	178.1	173.6	0	0	0	0	112.5	R388 N389 E390	S386-R388 VanDerWaalsContact C-N 3.32Å; S386-R388 PolarHBondContact O-N 3.01Å; S386-N389 PolarHBondContact O-N 2.94Å; S386-E390 PolarHBondContact O-N 2.74Å
387	K	63.2	Low	65	Low	151 Å²	151	120 Å²	120	66%	0.657	61%	0.608	S	S	*	*	H	α-helix	trans	-65.8	-29.8	174.1	-91.3	-171.3	173.8	-173	0	114.2	K385 N389 E390 T391	K385-K387 PolarHBondContact O-N 3.16Å; K387-N389 VanDerWaalsContact C-N 3.3Å; K387-N389 PolarHBondContact O-N 2.91Å; K387-E390 PolarHBondContact O-N 3.25Å; K387-T391 PolarHBondContact O-N 3.29Å; K387-T391 PolarHBondContact O-OG1 3.27Å
388	R	63.9	Low	63.4	Low	191 Å²	191	118.9 Å²	118.9	72%	0.721	61%	0.605	S	S	*	*	H	α-helix	trans	-69.6	-31.1	179	-151.9	176.4	-157.7	-175.4	5.3	111.8	R384 K385 S386 S392	R384-R388 PolarHBondContact O-N 3.05Å; K385-R388 PolarHBondContact O-N 3Å; S386-R388 VanDerWaalsContact C-N 3.32Å; S386-R388 PolarHBondContact O-N 3.01Å; R388-S392 WeakPolarHBondContact O-CB 3.2Å; R388-S392 PolarHBondContact O-N 2.88Å; R388-S392 VanDerWaalsContact O-N 3.14Å; R388-S392 PolarHBondContact O-OG 3.37Å
389	N	60.6	Low	61.9	Low	117 Å²	117	118.8 Å²	118.8	63%	0.626	61%	0.606	S	S	*	*	H	α-helix	trans	-73	-40	175	-71.3	3.2	0	0	0	112.1	K385 S386 K387 T391 S392 Q393	K385-N389 PolarHBondContact O-N 3.11Å; S386-N389 PolarHBondContact O-N 2.94Å; K387-N389 VanDerWaalsContact C-N 3.3Å; K387-N389 PolarHBondContact O-N 2.91Å; N389-T391 PolarHBondContact O-N 3.35Å; N389-S392 PolarHBondContact O-N 2.57Å; N389-Q393 PolarHBondContact O-N 3.27Å
390	E	61.6	Low	60.6	Low	125 Å²	125	121 Å²	121	58%	0.584	61%	0.613	S	S	*	*	H	α-helix	trans	-64.6	-39	174.3	-75.1	177.6	165.8	0	0	112.6	S386 K387 S392 Q393 S394	S386-E390 PolarHBondContact O-N 2.74Å; K387-E390 PolarHBondContact O-N 3.25Å; E390-S392 VanDerWaalsContact C-N 3.27Å; E390-S392 PolarHBondContact O-N 2.77Å; E390-Q393 PolarHBondContact O-N 3.37Å; E390-S394 PolarHBondContact O-N 3.21Å
391	T	59.8	Low	59.4	Low	86 Å²	86	125.5 Å²	125.5	53%	0.528	63%	0.628	S	S	.	*	H	α-helix	trans	-70.7	-27.3	177.8	-33.9	0	0	0	0	111.9	K387 N389 K395	K387-T391 PolarHBondContact O-N 3.29Å; K387-T391 PolarHBondContact O-OG1 3.27Å; N389-T391 PolarHBondContact O-N 3.35Å; T391-K395 PolarHBondContact O-N 2.99Å
392	S	56.4	Low	58.9	Low	71 Å²	71	127 Å²	127	50%	0.497	64%	0.64	S	S	.	*	H	α-helix	trans	-76.6	-34.7	177.1	-55.4	0	0	0	0	111.5	R388 N389 E390 S396	R388-S392 WeakPolarHBondContact O-CB 3.2Å; R388-S392 PolarHBondContact O-N 2.88Å; R388-S392 VanDerWaalsContact O-N 3.14Å; R388-S392 PolarHBondContact O-OG 3.37Å; N389-S392 PolarHBondContact O-N 2.57Å; E390-S392 VanDerWaalsContact C-N 3.27Å; E390-S392 PolarHBondContact O-N 2.77Å; S392-S396 PolarHBondContact O-N 3.24Å; S392-S396 VanDerWaalsContact O-N 3.16Å
393	Q	57.8	Low	58.3	Low	147 Å²	147	129.9 Å²	129.9	69%	0.687	65%	0.648	S	S	*	*	H	α-helix	trans	-69.5	-36.2	171	-99.1	178.2	-24.7	0	0	112.9	N389 E390 K395 S396 G397	N389-Q393 PolarHBondContact O-N 3.27Å; E390-Q393 PolarHBondContact O-N 3.37Å; Q393-K395 VanDerWaalsContact C-N 3.34Å; Q393-K395 PolarHBondContact O-N 2.95Å; Q393-S396 PolarHBondContact O-N 2.85Å; Q393-S396 PolarHBondContact O-OG 2.81Å; Q393-S396 VanDerWaalsContact O-OG 3.12Å; Q393-G397 PolarHBondContact O-N 2.96Å; Q393-G397 VanDerWaalsContact O-N 3.16Å
394	S	58.6	Low	58	Low	72 Å²	72	124.5 Å²	124.5	50%	0.503	65%	0.645	S	S	.	*	H	α-helix	trans	-65.7	-35.6	175	171.8	0	0	0	0	112.5	E390 I398	E390-S394 PolarHBondContact O-N 3.21Å; S394-I398 PolarHBondContact O-N 2.95Å
395	K	56.5	Low	57.6	Low	161 Å²	161	123.1 Å²	123.1	70%	0.7	65%	0.647	S	S	*	*	H	α-helix	trans	-75.3	-30	175.8	-84.6	-171.5	174.1	-173.8	0	113.9	T391 Q393 G397 S399	T391-K395 PolarHBondContact O-N 2.99Å; Q393-K395 VanDerWaalsContact C-N 3.34Å; Q393-K395 PolarHBondContact O-N 2.95Å; K395-G397 VanDerWaalsContact C-N 3.32Å; K395-S399 PolarHBondContact O-N 2.73Å
396	S	55.2	Low	57.2	Low	72 Å²	72	121.5 Å²	121.5	50%	0.503	65%	0.651	S	S	.	*	H	α-helix	trans	-69.8	-32.2	172.9	71.2	0	0	0	0	111.9	S392 Q393 I398 S399	S392-S396 PolarHBondContact O-N 3.24Å; S392-S396 VanDerWaalsContact O-N 3.16Å; Q393-S396 PolarHBondContact O-N 2.85Å; Q393-S396 PolarHBondContact O-OG 2.81Å; Q393-S396 VanDerWaalsContact O-OG 3.12Å; S396-I398 PolarHBondContact O-N 2.96Å; S396-S399 PolarHBondContact O-N 3.09Å
397	G	55.1	Low	56.8	Low	43 Å²	43	125.2 Å²	125.2	44%	0.443	67%	0.671	S	S	.	*	H	α-helix	trans	-66.3	-33.9	176.1	0	0	0	0	0	114.6	Q393 K395	Q393-G397 PolarHBondContact O-N 2.96Å; Q393-G397 VanDerWaalsContact O-N 3.16Å; K395-G397 VanDerWaalsContact C-N 3.32Å
398	I	56.1	Low	55.8	Low	117 Å²	117	121.7 Å²	121.7	60%	0.6	68%	0.678	S	S	*	*	H	α-helix	trans	-76.7	-30.3	178.9	-63	172.5	0	0	0	111.4	S394 S396 E400 M401	S394-I398 PolarHBondContact O-N 2.95Å; S396-I398 PolarHBondContact O-N 2.96Å; I398-E400 VanDerWaalsContact C-N 3.33Å; I398-E400 PolarHBondContact O-N 2.88Å; I398-M401 PolarHBondContact O-N 2.94Å
399	S	54.3	Low	55.3	Low	82 Å²	82	124.7 Å²	124.7	57%	0.573	69%	0.689	S	S	*	*	H	α-helix	trans	-74.2	-20.4	-180	-170	0	0	0	0	114	K395 S396	K395-S399 PolarHBondContact O-N 2.73Å; S396-S399 PolarHBondContact O-N 3.09Å
400	E	54.9	Low	54.7	Low	162 Å²	162	127.9 Å²	127.9	76%	0.757	70%	0.7	S	S	*	*	H	α-helix	trans	-83.9	-24.8	174.2	-82	-174.9	155.3	0	0	112.9	I398 S402 K403	I398-E400 VanDerWaalsContact C-N 3.33Å; I398-E400 PolarHBondContact O-N 2.88Å; E400-S402 VanDerWaalsContact C-N 3.29Å; E400-S402 PolarHBondContact O-N 2.94Å; E400-K403 PolarHBondContact O-N 3.33Å
401	M	54.6	Low	54.3	Low	168 Å²	168	133.2 Å²	133.2	83%	0.828	73%	0.732	S	S	*	*	H	α-helix	trans	-74.9	-17.6	-178.8	-148.3	165.8	167.2	0	0	113.4	I398	I398-M401 PolarHBondContact O-N 2.94Å
402	S	54	Low	54	Low	103 Å²	103	135.6 Å²	135.6	72%	0.72	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	1.5	176.7	-57.2	0	0	0	0	115.1	E400	E400-S402 VanDerWaalsContact C-N 3.29Å; E400-S402 PolarHBondContact O-N 2.94Å
403	K	55.9	Low	53.9	Low	187 Å²	187	138.9 Å²	138.9	81%	0.813	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	2.8	176.7	-81.5	-172.5	176.8	-179	0	115.2	E400	E400-K403 PolarHBondContact O-N 3.33Å
404	S	53.3	Low	53.6	Low	109 Å²	109	138.5 Å²	138.5	76%	0.762	76%	0.759	S	S	*	*	S	Bend	trans	-108.4	42.3	179.9	-157.5	0	0	0	0	113.7
405	Q	52.7	Low	53.4	Low	182 Å²	182	142.4 Å²	142.4	85%	0.85	77%	0.774	S	S	*	*	S	Bend	trans	-141.1	51.6	172.8	-92.9	-169.1	-18.5	0	0	112.1
406	T	54.5	Low	53.2	Low	133 Å²	133	141.3 Å²	141.3	82%	0.816	78%	0.779	S	S	*	*			trans	-163	79.7	162.2	10.9	0	0	0	0	110.2
407	T	53.5	Low	53	Low	151 Å²	151	145.9 Å²	145.9	93%	0.926	80%	0.797	S	S	*	*			trans	-162.4	117.4	157.8	16	0	0	0	0	110.6
408	G	42.4	Very low	52.9	Low	77 Å²	77	153.2 Å²	153.2	79%	0.794	82%	0.822	S	S	*	*			trans	91.7	86.3	143.5	0	0	0	0	0	117.5
409	R	53.5	Low	52.6	Low	254 Å²	254	156 Å²	156	96%	0.958	84%	0.839	S	S	*	*			trans	-135.1	82.8	138.7	-150.5	173.1	-168.9	170	2.6	109.3
410	H	47.9	Very low	52.5	Low	184 Å²	184	162.2 Å²	162.2	85%	0.852	86%	0.862	S	S	*	*			trans	-88.7	113.4	154.6	-95.1	-69.1	0	0	0	106.9
411	N	52.7	Low	52.3	Low	236 Å²	236	162.2 Å²	162.2	100%	1.262	87%	0.871	S	S	*	*			trans	-174.4	0	134	-94	-0.7	0	0	0	108.4

Retrieved 411 of 411 residues in 153.5 ms (Link to these results)

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