A0A077ZHB2_TRITR Loading...

NADH-ubiquinone oxidoreductase chain 3

AlphaFold DB , UniProt , Accession A0A077ZHB2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 240 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	30.3	Very low	29.2	Very low	181 Å²	181	127.6 Å²	127.6	89%	0.892	66%	0.656	S	S	*	*				0	85.6	0	-85.6	-88.1	-80.6	0	0	108.8	Y3 H141	M1-Y3 HydrophobicContact SD-CD2 3.46Å; M1-Y3 WeakPolarHBondContact SD-CD2 3.2Å; M1-Y3 HydrophobicContact SD-CE2 3.45Å; M1-Y3 WeakPolarHBondContact SD-CE2 3.35Å; M1-H141 PolarHBondContact N-NE2 3.38Å
2	L	26.3	Very low	29.1	Very low	82 Å²	82	129.9 Å²	129.9	43%	0.429	67%	0.671	S	S	.	*			trans	-128.6	80.5	167.4	-144.8	130.7	0	0	0	105.6	Y4 F198	L2-Y4 HydrophobicContact CD2-CD2 4.21Å; L2-Y4 HydrophobicContact CD2-CE2 4.08Å; L2-F198 HydrophobicContact CD1-CD1 3.71Å; L2-F198 HydrophobicContact CD1-CE1 3.32Å; L2-F198 HydrophobicContact CD1-CZ 4.38Å
3	Y	29.8	Very low	29	Very low	119 Å²	119	130 Å²	130	47%	0.467	69%	0.687	S	S	.	*			trans	-102.3	99.7	179.8	-77.7	-70	0	0	0	108.2	M1 L5 Y36	M1-Y3 HydrophobicContact SD-CD2 3.46Å; M1-Y3 WeakPolarHBondContact SD-CD2 3.2Å; M1-Y3 HydrophobicContact SD-CE2 3.45Å; M1-Y3 WeakPolarHBondContact SD-CE2 3.35Å; Y3-L5 PolarHBondContact O-N 3.07Å; Y3-Y36 AromaticContact CD1-CD1 3.3Å; Y3-Y36 HydrophobicContact CD1-CD1 3.3Å; Y3-Y36 HydrophobicContact CD1-CE1 4.11Å; Y3-Y36 AromaticContact CD1-CG 3.94Å; Y3-Y36 HydrophobicContact CD1-CG 3.94Å; Y3-Y36 AromaticContact CE1-CD1 3.27Å; Y3-Y36 HydrophobicContact CE1-CD1 3.27Å; Y3-Y36 HydrophobicContact CE1-CE1 4.01Å; Y3-Y36 AromaticContact CE1-CG 3.58Å; Y3-Y36 HydrophobicContact CE1-CG 3.58Å; Y3-Y36 HydrophobicContact CG-CD1 4.38Å
4	Y	29.6	Very low	29.3	Very low	160 Å²	160	127.6 Å²	127.6	63%	0.627	67%	0.673	S	S	*	*			trans	-69.4	88.3	159.2	-88.7	-85.7	0	0	0	108.4	L2 I6	L2-Y4 HydrophobicContact CD2-CD2 4.21Å; L2-Y4 HydrophobicContact CD2-CE2 4.08Å; Y4-I6 HydrophobicContact CD1-CD1 4.43Å
5	L	27.8	Very low	29.5	Very low	126 Å²	126	126.1 Å²	126.1	66%	0.66	68%	0.677	S	S	*	*			trans	-90.2	86.8	162.4	-80.3	163.4	0	0	0	107.6	Y3 P7 Y36	Y3-L5 PolarHBondContact O-N 3.07Å; L5-P7 VanDerWaalsContact O-CD 3.25Å; L5-P7 WeakPolarHBondContact O-CD 3.18Å; L5-Y36 HydrophobicContact CD2-CD1 4.46Å; L5-Y36 HydrophobicContact CD2-CE1 4.14Å
6	I	27.7	Very low	29.6	Very low	127 Å²	127	131.6 Å²	131.6	65%	0.651	69%	0.685	S	S	*	*			trans	-89.5	107.8	160.3	-63.2	171.2	0	0	0	106.3	Y4 I8	Y4-I6 HydrophobicContact CD1-CD1 4.43Å; I6-I8 PolarHBondContact O-N 3.4Å; I6-I8 VanDerWaalsContact O-N 3.12Å
7	P	29.1	Very low	29.8	Very low	114 Å²	114	134.8 Å²	134.8	74%	0.74	69%	0.687	S	S	*	*			trans	-70.9	106.7	168.3	29.1	-29.8	0	0	0	107.7	L5 N9	L5-P7 VanDerWaalsContact O-CD 3.25Å; L5-P7 WeakPolarHBondContact O-CD 3.18Å; P7-N9 VanDerWaalsContact C-N 3.28Å; P7-N9 PolarHBondContact O-N 3.28Å
8	I	33.5	Very low	30.2	Very low	128 Å²	128	131.3 Å²	131.3	66%	0.656	67%	0.67	S	S	*	*			trans	-68.1	94	167.7	-58.1	170.9	0	0	0	106.3	I6 I14	I6-I8 PolarHBondContact O-N 3.4Å; I6-I8 VanDerWaalsContact O-N 3.12Å; I8-I14 HydrophobicContact CG2-CD1 4.13Å
9	N	29.7	Very low	30.6	Very low	145 Å²	145	129.8 Å²	129.8	78%	0.775	67%	0.667	S	S	*	*			trans	-77.4	140.2	170.3	-153.9	17.3	0	0	0	109	P7	P7-N9 VanDerWaalsContact C-N 3.28Å; P7-N9 PolarHBondContact O-N 3.28Å
10	S	29.6	Very low	30.7	Very low	81 Å²	81	129.3 Å²	129.3	57%	0.566	67%	0.665	S	S	*	*	S	Bend	trans	-46.2	137	-178.2	51.8	0	0	0	0	114
11	N	27.7	Very low	31	Very low	141 Å²	141	126.3 Å²	126.3	75%	0.754	65%	0.65	S	S	*	*	S	Bend	trans	72	100.3	152.9	-52.5	-12.2	0	0	0	116
12	N	28.7	Very low	31.2	Very low	155 Å²	155	122.1 Å²	122.1	83%	0.829	63%	0.632	S	S	*	*	S	Bend	trans	130.4	4.1	141.4	-64.4	-10.8	0	0	0	119.5
13	C	27.9	Very low	31.6	Very low	131 Å²	131	124.9 Å²	124.9	89%	0.885	65%	0.647	S	S	*	*			trans	-133.4	30.2	-176.3	-82.2	0	0	0	0	117.1
14	I	32	Very low	31.8	Very low	96 Å²	96	123.6 Å²	123.6	49%	0.492	65%	0.647	S	S	.	*			trans	-123.3	93	177.9	-88.8	155.3	0	0	0	109.3	I8 D18	I8-I14 HydrophobicContact CG2-CD1 4.13Å; I14-D18 WeakPolarHBondContact CG2-OD1 3.14Å; I14-D18 WeakPolarHBondContact CG2-OD2 3.36Å
15	S	33	Very low	31.8	Very low	105 Å²	105	123.8 Å²	123.8	73%	0.734	66%	0.659	S	S	*	*	S	Bend	trans	-138.6	-2.1	173.6	61.6	0	0	0	0	114
16	R	30.8	Very low	32.1	Very low	214 Å²	214	120.7 Å²	120.7	81%	0.808	66%	0.657	S	S	*	*	S	Bend	trans	-118	-22.9	-175.4	-161.5	165.3	172.1	161.4	-3.9	115
17	W	33.8	Very low	32.6	Very low	187 Å²	187	118.6 Å²	118.6	71%	0.708	65%	0.646	S	S	*	*	S	Bend	trans	-93.6	-24.5	177.4	-69.8	99.8	0	0	0	113.3	V19 L20 L21	W17-V19 VanDerWaalsContact C-N 3.29Å; W17-V19 PolarHBondContact O-N 2.91Å; W17-L20 PolarHBondContact O-N 3.48Å; W17-L21 PolarHBondContact O-N 3.21Å; W17-L21 VanDerWaalsContact O-N 3.1Å
18	D	36.6	Very low	32.7	Very low	72 Å²	72	116.6 Å²	116.6	39%	0.385	63%	0.63	S	S	.	*	H	α-helix	trans	-64	-32.4	177.8	-71.5	-2.6	0	0	0	113	I14 L20 L21 N22	I14-D18 WeakPolarHBondContact CG2-OD1 3.14Å; I14-D18 WeakPolarHBondContact CG2-OD2 3.36Å; D18-L20 VanDerWaalsContact C-N 3.29Å; D18-L20 PolarHBondContact O-N 3.34Å; D18-L21 PolarHBondContact O-N 2.92Å; D18-N22 WeakPolarHBondContact O-CB 3.46Å; D18-N22 PolarHBondContact O-N 3.19Å; D18-N22 PolarHBondContact O-ND2 3.47Å
19	V	36.8	Very low	32.6	Very low	102 Å²	102	118.2 Å²	118.2	62%	0.618	64%	0.639	S	S	*	*	H	α-helix	trans	-69.9	-28.4	179	-177.5	0	0	0	0	111.7	W17	W17-V19 VanDerWaalsContact C-N 3.29Å; W17-V19 PolarHBondContact O-N 2.91Å
20	L	33.5	Very low	32.7	Very low	120 Å²	120	116 Å²	116	63%	0.628	63%	0.627	S	S	*	*	H	α-helix	trans	-84	-34.9	176.8	-106.9	155.7	0	0	0	112.3	W17 D18	W17-L20 PolarHBondContact O-N 3.48Å; D18-L20 VanDerWaalsContact C-N 3.29Å; D18-L20 PolarHBondContact O-N 3.34Å
21	L	37.3	Very low	33	Very low	66 Å²	66	115.6 Å²	115.6	35%	0.346	63%	0.628	S	S	.	*	H	α-helix	trans	-78.3	-28.9	178.4	-89	144.9	0	0	0	113.5	W17 D18 N23 I24 I27	W17-L21 PolarHBondContact O-N 3.21Å; W17-L21 VanDerWaalsContact O-N 3.1Å; D18-L21 PolarHBondContact O-N 2.92Å; L21-N23 VanDerWaalsContact C-N 3.26Å; L21-N23 PolarHBondContact O-N 2.91Å; L21-I24 PolarHBondContact O-N 3.46Å; L21-I27 HydrophobicContact CD2-CG2 4.12Å
22	N	33.7	Very low	33.4	Very low	94 Å²	94	117.9 Å²	117.9	50%	0.503	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.6	-17.4	177.7	-77.7	-16.7	0	0	0	114.6	D18 I24 N28	D18-N22 WeakPolarHBondContact O-CB 3.46Å; D18-N22 PolarHBondContact O-N 3.19Å; D18-N22 PolarHBondContact O-ND2 3.47Å; N22-I24 VanDerWaalsContact C-N 3.32Å; N22-N28 PolarHBondContact OD1-ND2 3.06Å
23	N	34.9	Very low	33.5	Very low	139 Å²	139	115 Å²	115	74%	0.743	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-2.8	177.8	-77.6	-13.8	0	0	0	113.7	L21	L21-N23 VanDerWaalsContact C-N 3.26Å; L21-N23 PolarHBondContact O-N 2.91Å
24	I	34.6	Very low	33.6	Very low	92 Å²	92	119.1 Å²	119.1	47%	0.472	62%	0.618	S	S	.	*	S	Bend	trans	-112.6	87.9	179	-52.2	175	0	0	0	108.4	L21 N22 G26 I27	L21-I24 PolarHBondContact O-N 3.46Å; N22-I24 VanDerWaalsContact C-N 3.32Å; I24-G26 PolarHBondContact O-N 3.37Å; I24-I27 HydrophobicContact CB-CD1 4.36Å; I24-I27 HydrophobicContact CG2-CD1 3.61Å; I24-I27 HydrophobicContact CG2-CG1 4.06Å; I24-I27 PolarHBondContact O-N 3.39Å
25	N	29.5	Very low	33.8	Very low	165 Å²	165	116.3 Å²	116.3	88%	0.882	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.5	101	176.9	-75.3	-21.1	0	0	0	110.5
26	G	34.5	Very low	33.9	Very low	61 Å²	61	117.8 Å²	117.8	63%	0.629	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	143.6	-23.1	172.7	0	0	0	0	0	115.4	I24	I24-G26 PolarHBondContact O-N 3.37Å
27	I	37.9	Very low	33.9	Very low	82 Å²	82	113.2 Å²	113.2	42%	0.421	59%	0.589	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92	-25.3	-172.5	-59.4	178.7	0	0	0	112.4	L21 I24 L29 L30	L21-I27 HydrophobicContact CD2-CG2 4.12Å; I24-I27 HydrophobicContact CB-CD1 4.36Å; I24-I27 HydrophobicContact CG2-CD1 3.61Å; I24-I27 HydrophobicContact CG2-CG1 4.06Å; I24-I27 PolarHBondContact O-N 3.39Å; I27-L29 VanDerWaalsContact C-N 3.25Å; I27-L29 PolarHBondContact O-N 3.37Å; I27-L29 VanDerWaalsContact O-N 3.16Å; I27-L30 PolarHBondContact O-N 3.44Å; I27-L30 VanDerWaalsContact O-N 3.1Å
28	N	30	Very low	34.2	Very low	73 Å²	73	107.4 Å²	107.4	39%	0.39	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.5	-15.9	-176.5	-85.6	-13.2	0	0	0	116	N22	N22-N28 PolarHBondContact OD1-ND2 3.06Å
29	L	31.2	Very low	34.3	Very low	162 Å²	162	107.9 Å²	107.9	85%	0.848	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-21.5	174.9	-110.6	140.4	0	0	0	112.7	I27	I27-L29 VanDerWaalsContact C-N 3.25Å; I27-L29 PolarHBondContact O-N 3.37Å; I27-L29 VanDerWaalsContact O-N 3.16Å
30	L	33.7	Very low	34.5	Very low	99 Å²	99	104.9 Å²	104.9	52%	0.518	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.7	-25.3	-179	-111.3	94.3	0	0	0	113.7	I27 K32	I27-L30 PolarHBondContact O-N 3.44Å; I27-L30 VanDerWaalsContact O-N 3.1Å; L30-K32 VanDerWaalsContact C-N 3.33Å; L30-K32 PolarHBondContact O-N 3.05Å
31	A	35.9	Very low	35.2	Very low	71 Å²	71	101.6 Å²	101.6	59%	0.587	55%	0.545	S	S	*	.	S	Bend	trans	-78.2	-13.5	-175.5	0	0	0	0	0	114.4
32	K	34.3	Very low	35.6	Very low	189 Å²	189	99.4 Å²	99.4	82%	0.822	53%	0.534	S	S	*	.	S	Bend	trans	-90.2	-18.4	-173.5	-139	174.3	-174.6	177.4	0	114.1	L30	L30-K32 VanDerWaalsContact C-N 3.33Å; L30-K32 PolarHBondContact O-N 3.05Å
33	N	31.8	Very low	36.3	Very low	94 Å²	94	97.3 Å²	97.3	50%	0.503	53%	0.527	S	S	.	.	S	Bend	trans	-108	130.1	172.9	-82.3	4.5	0	0	0	109.5	S35 E83	N33-S35 VanDerWaalsContact C-N 3.32Å; N33-S35 PolarHBondContact O-N 3.15Å; N33-S35 PolarHBondContact O-OG 2.94Å; N33-E83 PolarHBondContact ND2-OE1 3.46Å; N33-E83 VanDerWaalsContact ND2-OE1 3.1Å
34	K	30.2	Very low	37	Very low	218 Å²	218	93.8 Å²	93.8	95%	0.948	51%	0.507	S	S	*	.			trans	-59	89.3	-179.8	-66.8	174.3	179.1	176.8	0	110.4
35	S	35.3	Very low	37.6	Very low	38 Å²	38	90.8 Å²	90.8	27%	0.266	49%	0.492	S	S	.	.			trans	-145.9	101.3	172.4	39.2	0	0	0	0	109.3	N33 L37	N33-S35 VanDerWaalsContact C-N 3.32Å; N33-S35 PolarHBondContact O-N 3.15Å; N33-S35 PolarHBondContact O-OG 2.94Å; S35-L37 PolarHBondContact O-N 3.39Å
36	Y	35.2	Very low	38.4	Very low	136 Å²	136	86.3 Å²	86.3	53%	0.533	47%	0.468	S	S	.	.			trans	1.8	96.3	158.3	-45.6	-76.7	0	0	0	115.1	Y3 L5 I38	Y3-Y36 AromaticContact CD1-CD1 3.3Å; Y3-Y36 HydrophobicContact CD1-CD1 3.3Å; Y3-Y36 HydrophobicContact CD1-CE1 4.11Å; Y3-Y36 AromaticContact CD1-CG 3.94Å; Y3-Y36 HydrophobicContact CD1-CG 3.94Å; Y3-Y36 AromaticContact CE1-CD1 3.27Å; Y3-Y36 HydrophobicContact CE1-CD1 3.27Å; Y3-Y36 HydrophobicContact CE1-CE1 4.01Å; Y3-Y36 AromaticContact CE1-CG 3.58Å; Y3-Y36 HydrophobicContact CE1-CG 3.58Å; Y3-Y36 HydrophobicContact CG-CD1 4.38Å; L5-Y36 HydrophobicContact CD2-CD1 4.46Å; L5-Y36 HydrophobicContact CD2-CE1 4.14Å; Y36-I38 VanDerWaalsContact C-N 3.33Å; Y36-I38 PolarHBondContact O-N 3.36Å
37	L	31.8	Very low	38.9	Very low	117 Å²	117	88.9 Å²	88.9	61%	0.613	47%	0.466	S	S	*	.			trans	-74	92.2	168.1	-165	90.3	0	0	0	107.8	S35 V39	S35-L37 PolarHBondContact O-N 3.39Å; L37-V39 VanDerWaalsContact C-N 3.34Å; L37-V39 HydrophobicContact CD2-CG2 3.62Å; L37-V39 HydrophobicContact CG-CG2 4.15Å; L37-V39 PolarHBondContact O-N 3.14Å
38	I	40.5	Very low	39.3	Very low	66 Å²	66	87.6 Å²	87.6	34%	0.338	46%	0.46	S	S	.	.			trans	-74.3	93.1	170.3	-62.8	164.3	0	0	0	106.3	Y36 T40 N75	Y36-I38 VanDerWaalsContact C-N 3.33Å; Y36-I38 PolarHBondContact O-N 3.36Å; I38-T40 VanDerWaalsContact C-N 3.28Å; I38-T40 HydrophobicContact CG2-CG2 3.45Å; I38-T40 VanDerWaalsContact CG2-CG2 3.45Å; I38-T40 PolarHBondContact O-N 3.2Å; I38-T40 VanDerWaalsContact O-N 3.08Å; I38-N75 WeakPolarHBondContact CD1-OD1 3.34Å
39	V	37.2	Very low	40	Very low	81 Å²	81	85.4 Å²	85.4	49%	0.491	45%	0.448	S	S	.	.			trans	-74.8	89.9	164.2	-177.9	0	0	0	0	105.9	L37 S43	L37-V39 VanDerWaalsContact C-N 3.34Å; L37-V39 HydrophobicContact CD2-CG2 3.62Å; L37-V39 HydrophobicContact CG-CG2 4.15Å; L37-V39 PolarHBondContact O-N 3.14Å; V39-S43 WeakPolarHBondContact CG1-OG 3.49Å
40	T	42.5	Very low	40.4	Very low	40 Å²	40	84 Å²	84	25%	0.245	44%	0.44	C	S	.	.			trans	-67.9	151.6	177.4	38.6	0	0	0	0	111.4	I38 T42 S43 V71	I38-T40 VanDerWaalsContact C-N 3.28Å; I38-T40 HydrophobicContact CG2-CG2 3.45Å; I38-T40 VanDerWaalsContact CG2-CG2 3.45Å; I38-T40 PolarHBondContact O-N 3.2Å; I38-T40 VanDerWaalsContact O-N 3.08Å; T40-T42 PolarHBondContact O-N 3.11Å; T40-T42 PolarHBondContact O-OG1 3.26Å; T40-T42 PolarHBondContact OG1-OG1 3.09Å; T40-S43 PolarHBondContact O-N 3.11Å; T40-S43 PolarHBondContact O-OG 3.06Å; T40-S43 VanDerWaalsContact O-OG 3.12Å; T40-V71 HydrophobicContact CG2-CG1 3.41Å; T40-V71 VanDerWaalsContact CG2-CG1 3.41Å
41	C	46.5	Very low	40.8	Very low	50 Å²	50	84.7 Å²	84.7	34%	0.338	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-39.7	-22.3	169	-66.6	0	0	0	0	114.3	S43 I44 N45 C138	C41-S43 VanDerWaalsContact C-N 3.28Å; C41-S43 PolarHBondContact O-N 3.36Å; C41-I44 WeakPolarHBondContact O-CB 3.41Å; C41-I44 PolarHBondContact O-N 3.47Å; C41-I44 VanDerWaalsContact O-N 3.1Å; C41-N45 PolarHBondContact O-N 3.27Å; C41-C138 HydrophobicContact CB-CB 4.06Å; C41-C138 WeakPolarHBondContact CB-SG 3.38Å; C41-C138 WeakPolarHBondContact SG-CB 3.06Å; C41-C138 CovalentContact SG-SG 2.07Å; C41-C138 PolarHBondContact SG-SG 3.4Å
42	T	46.2	Very low	41	Very low	21 Å²	21	83.3 Å²	83.3	13%	0.129	43%	0.43	C	S	.	.	H	α-helix	trans	-60.6	-30.1	177.7	58.5	0	0	0	0	113.8	T40 L46 T68	T40-T42 PolarHBondContact O-N 3.11Å; T40-T42 PolarHBondContact O-OG1 3.26Å; T40-T42 PolarHBondContact OG1-OG1 3.09Å; T42-L46 WeakPolarHBondContact O-CB 3.43Å; T42-L46 PolarHBondContact O-N 3.28Å; T42-L46 VanDerWaalsContact O-N 3.11Å; T42-T68 HydrophobicContact CG2-CG2 4.15Å
43	S	49.3	Very low	41.2	Very low	50 Å²	50	84.2 Å²	84.2	35%	0.35	43%	0.434	S	S	.	.	H	α-helix	trans	-70.7	-32.9	173.1	57.8	0	0	0	0	112.2	V39 T40 C41 L47	V39-S43 WeakPolarHBondContact CG1-OG 3.49Å; T40-S43 PolarHBondContact O-N 3.11Å; T40-S43 PolarHBondContact O-OG 3.06Å; T40-S43 VanDerWaalsContact O-OG 3.12Å; C41-S43 VanDerWaalsContact C-N 3.28Å; C41-S43 PolarHBondContact O-N 3.36Å; S43-L47 WeakPolarHBondContact O-CB 3.48Å; S43-L47 PolarHBondContact O-N 3.26Å
44	I	48.6	Very low	41.6	Very low	65 Å²	65	85.1 Å²	85.1	33%	0.333	44%	0.439	S	S	.	.	H	α-helix	trans	-71.2	-43	175.4	-59.4	173	0	0	0	110	C41 L46 L47 I48	C41-I44 WeakPolarHBondContact O-CB 3.41Å; C41-I44 PolarHBondContact O-N 3.47Å; C41-I44 VanDerWaalsContact O-N 3.1Å; I44-L46 VanDerWaalsContact C-N 3.3Å; I44-L46 PolarHBondContact O-N 3.1Å; I44-L47 WeakPolarHBondContact O-CB 3.35Å; I44-L47 PolarHBondContact O-N 3.01Å; I44-I48 HydrophobicContact CG2-CD1 3.88Å; I44-I48 HydrophobicContact CG2-CG1 4.41Å; I44-I48 VanDerWaalsContact O-CG1 3.3Å; I44-I48 WeakPolarHBondContact O-CG1 3.41Å; I44-I48 PolarHBondContact O-N 3.26Å
45	N	47.5	Very low	42	Very low	28 Å²	28	79.9 Å²	79.9	15%	0.15	43%	0.43	C	S	.	.	H	α-helix	trans	-60.4	-39.7	174.1	-76.9	-14.3	0	0	0	112.2	C41 I48 Q49	C41-N45 PolarHBondContact O-N 3.27Å; N45-I48 PolarHBondContact O-N 3.44Å; N45-Q49 WeakPolarHBondContact O-CB 3.38Å; N45-Q49 WeakPolarHBondContact O-CG 3.13Å; N45-Q49 PolarHBondContact O-N 3.31Å
46	L	46.9	Very low	42.2	Very low	71 Å²	71	82.7 Å²	82.7	37%	0.372	45%	0.445	S	S	.	.	H	α-helix	trans	-68.1	-36.1	177.3	-153.4	135.4	0	0	0	111.8	T42 I44 Q49 L50	T42-L46 WeakPolarHBondContact O-CB 3.43Å; T42-L46 PolarHBondContact O-N 3.28Å; T42-L46 VanDerWaalsContact O-N 3.11Å; I44-L46 VanDerWaalsContact C-N 3.3Å; I44-L46 PolarHBondContact O-N 3.1Å; L46-Q49 PolarHBondContact O-N 3.01Å; L46-L50 HydrophobicContact CD2-CD1 3.83Å; L46-L50 HydrophobicContact CD2-CG 4.4Å; L46-L50 VanDerWaalsContact O-CG 3.3Å; L46-L50 WeakPolarHBondContact O-CG 3.25Å; L46-L50 PolarHBondContact O-N 3.44Å
47	L	43.8	Very low	42.6	Very low	115 Å²	115	78.3 Å²	78.3	60%	0.602	43%	0.43	S	S	*	.	H	α-helix	trans	-65.3	-43.3	172.2	-99.5	156.3	0	0	0	112.9	S43 I44 Q49 N51	S43-L47 WeakPolarHBondContact O-CB 3.48Å; S43-L47 PolarHBondContact O-N 3.26Å; I44-L47 WeakPolarHBondContact O-CB 3.35Å; I44-L47 PolarHBondContact O-N 3.01Å; L47-Q49 VanDerWaalsContact C-N 3.29Å; L47-Q49 PolarHBondContact O-N 3.1Å; L47-N51 PolarHBondContact O-N 2.82Å
48	I	47	Very low	42.6	Very low	55 Å²	55	76.2 Å²	76.2	28%	0.282	43%	0.425	S	S	.	.	H	α-helix	trans	-65.3	-36.3	176.7	-66.6	169.4	0	0	0	110.5	I44 N45 I209	I44-I48 HydrophobicContact CG2-CD1 3.88Å; I44-I48 HydrophobicContact CG2-CG1 4.41Å; I44-I48 VanDerWaalsContact O-CG1 3.3Å; I44-I48 WeakPolarHBondContact O-CG1 3.41Å; I44-I48 PolarHBondContact O-N 3.26Å; N45-I48 PolarHBondContact O-N 3.44Å; I48-I209 HydrophobicContact CD1-CD1 3.83Å; I48-I209 HydrophobicContact CG1-CD1 4.01Å
49	Q	44	Very low	42.6	Very low	28 Å²	28	79.4 Å²	79.4	13%	0.131	44%	0.443	C	S	.	.	H	α-helix	trans	-76	-32.9	-179.5	-74	175.6	-29	0	0	113.6	N45 L46 L47 N51 S52 M57 N64	N45-Q49 WeakPolarHBondContact O-CB 3.38Å; N45-Q49 WeakPolarHBondContact O-CG 3.13Å; N45-Q49 PolarHBondContact O-N 3.31Å; L46-Q49 PolarHBondContact O-N 3.01Å; L47-Q49 VanDerWaalsContact C-N 3.29Å; L47-Q49 PolarHBondContact O-N 3.1Å; Q49-N51 VanDerWaalsContact C-N 3.29Å; Q49-N51 PolarHBondContact O-N 2.92Å; Q49-S52 PolarHBondContact O-N 3.5Å; Q49-M57 HydrophobicContact CB-CG 4.28Å; Q49-M57 HydrophobicContact CG-CE 4.05Å; Q49-M57 HydrophobicContact CG-CG 4.09Å; Q49-M57 HydrophobicContact CG-SD 3.89Å; Q49-N64 VanDerWaalsContact CD-ND2 3.32Å; Q49-N64 PolarHBondContact NE2-ND2 3.42Å; Q49-N64 PolarHBondContact OE1-ND2 3.28Å
50	L	40.6	Very low	43.1	Very low	132 Å²	132	77 Å²	77	69%	0.691	43%	0.427	S	S	*	.	H	α-helix	trans	-68.3	-26.6	174.6	-75.6	170.2	0	0	0	113.2	L46	L46-L50 HydrophobicContact CD2-CD1 3.83Å; L46-L50 HydrophobicContact CD2-CG 4.4Å; L46-L50 VanDerWaalsContact O-CG 3.3Å; L46-L50 WeakPolarHBondContact O-CG 3.25Å; L46-L50 PolarHBondContact O-N 3.44Å
51	N	41.8	Very low	43.2	Very low	113 Å²	113	78.7 Å²	78.7	60%	0.604	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-11.3	177.1	-102	-6.8	0	0	0	114.1	L47 Q49	L47-N51 PolarHBondContact O-N 2.82Å; Q49-N51 VanDerWaalsContact C-N 3.29Å; Q49-N51 PolarHBondContact O-N 2.92Å
52	S	41	Very low	43.3	Very low	42 Å²	42	79.1 Å²	79.1	29%	0.294	44%	0.441	S	S	.	.			trans	-93.6	102	176.9	179.3	0	0	0	0	110.6	Q49 N54 M57	Q49-S52 PolarHBondContact O-N 3.5Å; S52-N54 PolarHBondContact O-N 2.72Å; S52-M57 WeakPolarHBondContact OG-CE 3.12Å
53	K	38.4	Very low	43.9	Very low	209 Å²	209	82.1 Å²	82.1	91%	0.909	45%	0.453	S	S	*	.			trans	-69.1	21.2	176.3	-78.8	-174.9	175.4	178.5	0	114.7
54	N	39	Very low	44.4	Very low	113 Å²	113	80.3 Å²	80.3	60%	0.604	44%	0.44	S	S	*	.			trans	-92.9	120.5	-176.7	-76.6	-9.2	0	0	0	111.5	S52 V56 M57	S52-N54 PolarHBondContact O-N 2.72Å; N54-V56 PolarHBondContact O-N 3.08Å; N54-M57 WeakPolarHBondContact O-CB 3.28Å; N54-M57 PolarHBondContact O-N 3.13Å
55	S	38.7	Very low	45.1	Very low	107 Å²	107	81 Å²	81	75%	0.748	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-55.5	-16.3	179.4	48.6	0	0	0	0	115.3	M57 S58	S55-M57 VanDerWaalsContact C-N 3.26Å; S55-M57 PolarHBondContact O-N 3.02Å; S55-S58 PolarHBondContact O-OG 2.78Å
56	V	40	Very low	46.1	Very low	98 Å²	98	83.5 Å²	83.5	59%	0.594	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-71.1	-20.3	175.9	-175.5	0	0	0	0	112.1	N54 S58	N54-V56 PolarHBondContact O-N 3.08Å; V56-S58 VanDerWaalsContact C-N 3.28Å; V56-S58 PolarHBondContact O-N 2.82Å
57	M	42.8	Very low	47	Very low	44 Å²	44	80.4 Å²	80.4	22%	0.217	44%	0.441	C	S	.	.	G	3₁₀ helix	trans	-79.8	-2.4	-179.6	-151.5	86.1	80.2	0	0	114	Q49 S52 N54 S55 I60 T61	Q49-M57 HydrophobicContact CB-CG 4.28Å; Q49-M57 HydrophobicContact CG-CE 4.05Å; Q49-M57 HydrophobicContact CG-CG 4.09Å; Q49-M57 HydrophobicContact CG-SD 3.89Å; S52-M57 WeakPolarHBondContact OG-CE 3.12Å; N54-M57 WeakPolarHBondContact O-CB 3.28Å; N54-M57 PolarHBondContact O-N 3.13Å; S55-M57 VanDerWaalsContact C-N 3.26Å; S55-M57 PolarHBondContact O-N 3.02Å; M57-I60 HydrophobicContact CG-CB 4.49Å; M57-I60 HydrophobicContact CG-CD1 4.49Å; M57-I60 PolarHBondContact O-N 3Å; M57-I60 HydrophobicContact SD-CD1 3.86Å; M57-T61 WeakPolarHBondContact O-CG2 3.35Å; M57-T61 PolarHBondContact O-N 2.94Å
58	S	33.4	Very low	47.9	Very low	73 Å²	73	76.2 Å²	76.2	51%	0.51	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-69.8	-38.5	-174.7	55.7	0	0	0	0	113.5	S55 V56 I60 T61	S55-S58 PolarHBondContact O-OG 2.78Å; V56-S58 VanDerWaalsContact C-N 3.28Å; V56-S58 PolarHBondContact O-N 2.82Å; S58-I60 VanDerWaalsContact C-N 3.3Å; S58-I60 PolarHBondContact O-N 2.79Å; S58-T61 WeakPolarHBondContact O-CB 3.22Å; S58-T61 PolarHBondContact O-N 3.24Å; S58-T61 PolarHBondContact O-OG1 3.32Å
59	N	40.3	Very low	48.9	Very low	133 Å²	133	78.2 Å²	78.2	71%	0.711	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-19.8	175.4	-82.2	-6.1	0	0	0	113.6	T61 S62	N59-T61 VanDerWaalsContact C-N 3.29Å; N59-S62 PolarHBondContact O-OG 2.9Å
60	I	47	Very low	49.9	Very low	29 Å²	29	77.5 Å²	77.5	15%	0.149	43%	0.429	C	S	.	.	H	α-helix	trans	-76.1	-22.8	177.3	-59.1	171.4	0	0	0	110.4	M57 S58 S62 H63 N64	M57-I60 HydrophobicContact CG-CB 4.49Å; M57-I60 HydrophobicContact CG-CD1 4.49Å; M57-I60 PolarHBondContact O-N 3Å; M57-I60 HydrophobicContact SD-CD1 3.86Å; S58-I60 VanDerWaalsContact C-N 3.3Å; S58-I60 PolarHBondContact O-N 2.79Å; I60-S62 VanDerWaalsContact C-N 3.33Å; I60-S62 PolarHBondContact O-N 3.05Å; I60-H63 PolarHBondContact O-N 3.23Å; I60-N64 WeakPolarHBondContact CG2-ND2 3.49Å; I60-N64 WeakPolarHBondContact O-CB 3.25Å; I60-N64 PolarHBondContact O-N 2.97Å; I60-N64 VanDerWaalsContact O-N 3.14Å
61	T	45.5	Very low	51.1	Low	76 Å²	76	71.8 Å²	71.8	47%	0.466	40%	0.4	S	S	.	.	H	α-helix	trans	-61.9	-35	-179.9	66.6	0	0	0	0	113.7	M57 S58 N59 N65	M57-T61 WeakPolarHBondContact O-CG2 3.35Å; M57-T61 PolarHBondContact O-N 2.94Å; S58-T61 WeakPolarHBondContact O-CB 3.22Å; S58-T61 PolarHBondContact O-N 3.24Å; S58-T61 PolarHBondContact O-OG1 3.32Å; N59-T61 VanDerWaalsContact C-N 3.29Å; T61-N65 PolarHBondContact O-N 2.92Å; T61-N65 PolarHBondContact O-ND2 2.91Å; T61-N65 PolarHBondContact O-OD1 3.31Å
62	S	48.2	Very low	52.3	Low	59 Å²	59	70.9 Å²	70.9	41%	0.413	39%	0.394	S	S	.	.	H	α-helix	trans	-73.4	-44.7	-178.1	61.8	0	0	0	0	111.7	N59 I60 N64 N65 I66	N59-S62 PolarHBondContact O-OG 2.9Å; I60-S62 VanDerWaalsContact C-N 3.33Å; I60-S62 PolarHBondContact O-N 3.05Å; S62-N64 VanDerWaalsContact C-N 3.34Å; S62-N64 PolarHBondContact O-N 2.97Å; S62-N65 PolarHBondContact O-N 3.3Å; S62-I66 WeakPolarHBondContact O-CG1 3.27Å; S62-I66 PolarHBondContact O-N 2.76Å
63	H	57.5	Low	53.4	Low	85 Å²	85	72.1 Å²	72.1	39%	0.394	40%	0.397	S	S	.	.	H	α-helix	trans	-68.3	-34.4	-179.7	-69.1	-74.2	0	0	0	112.2	I60 N65 I66 S67	I60-H63 PolarHBondContact O-N 3.23Å; H63-N65 VanDerWaalsContact C-N 3.35Å; H63-I66 PolarHBondContact O-N 2.93Å; H63-S67 PolarHBondContact O-N 3.41Å
64	N	61.1	Low	54.8	Low	11 Å²	11	64.2 Å²	64.2	6%	0.059	36%	0.363	C	S	.	.	H	α-helix	trans	-73	-28.4	178	-71.5	4	0	0	0	113	Q49 I60 S62 S67 T68 E114	Q49-N64 VanDerWaalsContact CD-ND2 3.32Å; Q49-N64 PolarHBondContact NE2-ND2 3.42Å; Q49-N64 PolarHBondContact OE1-ND2 3.28Å; I60-N64 WeakPolarHBondContact CG2-ND2 3.49Å; I60-N64 WeakPolarHBondContact O-CB 3.25Å; I60-N64 PolarHBondContact O-N 2.97Å; I60-N64 VanDerWaalsContact O-N 3.14Å; S62-N64 VanDerWaalsContact C-N 3.34Å; S62-N64 PolarHBondContact O-N 2.97Å; N64-S67 WeakPolarHBondContact CA-OG 3.37Å; N64-S67 PolarHBondContact O-OG 3.05Å; N64-T68 WeakPolarHBondContact O-CG2 3.47Å; N64-T68 PolarHBondContact O-N 3.04Å; N64-T68 VanDerWaalsContact O-N 3.1Å; N64-T68 PolarHBondContact O-OG1 3.12Å; N64-E114 PolarHBondContact ND2-OE1 3.47Å; N64-E114 PolarHBondContact OD1-OE1 3.27Å; N64-E114 PolarHBondContact OD1-OE2 3.14Å
65	N	63	Low	55.9	Low	81 Å²	81	60.1 Å²	60.1	43%	0.433	34%	0.341	S	S	.	.	H	α-helix	trans	-69.5	-33.7	170.4	-70.4	-13.5	0	0	0	111.9	T61 S62 H63 T68 L69	T61-N65 PolarHBondContact O-N 2.92Å; T61-N65 PolarHBondContact O-ND2 2.91Å; T61-N65 PolarHBondContact O-OD1 3.31Å; S62-N65 PolarHBondContact O-N 3.3Å; H63-N65 VanDerWaalsContact C-N 3.35Å; N65-T68 VanDerWaalsContact C-OG1 3.31Å; N65-T68 VanDerWaalsContact CA-OG1 3.31Å; N65-T68 WeakPolarHBondContact CA-OG1 3.48Å; N65-T68 PolarHBondContact O-OG1 3.49Å; N65-L69 WeakPolarHBondContact O-CB 3.35Å; N65-L69 PolarHBondContact O-N 3.23Å; N65-L69 VanDerWaalsContact O-N 3.08Å
66	I	68.9	Low	57.1	Low	80 Å²	80	58.7 Å²	58.7	41%	0.41	33%	0.325	S	S	.	.	H	α-helix	trans	-73.4	-40.4	177.6	-59.2	165.6	0	0	0	110.5	S62 H63 L69 C70 I110	S62-I66 WeakPolarHBondContact O-CG1 3.27Å; S62-I66 PolarHBondContact O-N 2.76Å; H63-I66 PolarHBondContact O-N 2.93Å; I66-L69 PolarHBondContact O-N 3Å; I66-C70 PolarHBondContact O-N 3.19Å; I66-C70 PolarHBondContact O-SG 2.9Å; I66-I110 HydrophobicContact CB-CD1 4.43Å; I66-I110 HydrophobicContact CG2-CD1 3.53Å
67	S	64.8	Low	58.3	Low	6 Å²	6	55.3 Å²	55.3	4%	0.042	31%	0.306	C	S	.	.	H	α-helix	trans	-65.3	-40.8	178.3	68.1	0	0	0	0	112	H63 N64 C70 V71	H63-S67 PolarHBondContact O-N 3.41Å; N64-S67 WeakPolarHBondContact CA-OG 3.37Å; N64-S67 PolarHBondContact O-OG 3.05Å; S67-C70 PolarHBondContact O-N 2.78Å; S67-V71 WeakPolarHBondContact O-CG2 3.45Å; S67-V71 PolarHBondContact O-N 3.16Å
68	T	63.5	Low	59.2	Low	27 Å²	27	55.7 Å²	55.7	17%	0.166	31%	0.308	C	S	.	.	H	α-helix	trans	-62.3	-44.8	172	47.4	0	0	0	0	112.1	T42 N64 N65 C70 V71 I72	T42-T68 HydrophobicContact CG2-CG2 4.15Å; N64-T68 WeakPolarHBondContact O-CG2 3.47Å; N64-T68 PolarHBondContact O-N 3.04Å; N64-T68 VanDerWaalsContact O-N 3.1Å; N64-T68 PolarHBondContact O-OG1 3.12Å; N65-T68 VanDerWaalsContact C-OG1 3.31Å; N65-T68 VanDerWaalsContact CA-OG1 3.31Å; N65-T68 WeakPolarHBondContact CA-OG1 3.48Å; N65-T68 PolarHBondContact O-OG1 3.49Å; T68-C70 PolarHBondContact O-N 2.89Å; T68-V71 PolarHBondContact O-N 3.44Å; T68-I72 VanDerWaalsContact O-CG1 3.29Å; T68-I72 WeakPolarHBondContact O-CG1 3.37Å; T68-I72 PolarHBondContact O-N 3.34Å
69	L	66.9	Low	60.3	Low	97 Å²	97	54.1 Å²	54.1	51%	0.508	30%	0.295	S	S	.	.	H	α-helix	trans	-57.9	-44.2	175.1	-103.7	152	0	0	0	112.6	N65 I66 V71 I72 L73	N65-L69 WeakPolarHBondContact O-CB 3.35Å; N65-L69 PolarHBondContact O-N 3.23Å; N65-L69 VanDerWaalsContact O-N 3.08Å; I66-L69 PolarHBondContact O-N 3Å; L69-V71 VanDerWaalsContact C-N 3.34Å; L69-V71 PolarHBondContact O-N 2.96Å; L69-I72 PolarHBondContact O-N 3.32Å; L69-L73 HydrophobicContact CD2-CD1 4.47Å; L69-L73 WeakPolarHBondContact O-CB 3.44Å; L69-L73 VanDerWaalsContact O-CG 3.3Å; L69-L73 WeakPolarHBondContact O-CG 3.34Å; L69-L73 PolarHBondContact O-N 2.74Å
70	C	66.3	Low	61.3	Low	12 Å²	12	50 Å²	50	8%	0.081	28%	0.28	C	S	.	.	H	α-helix	trans	-60.6	-43.1	179.1	-71.3	0	0	0	0	112	I66 S67 T68 L73 M74 F107	I66-C70 PolarHBondContact O-N 3.19Å; I66-C70 PolarHBondContact O-SG 2.9Å; S67-C70 PolarHBondContact O-N 2.78Å; T68-C70 PolarHBondContact O-N 2.89Å; C70-L73 PolarHBondContact O-N 3.47Å; C70-M74 WeakPolarHBondContact O-CB 3.3Å; C70-M74 PolarHBondContact O-N 3.1Å; C70-F107 HydrophobicContact CB-CB 4.35Å
71	V	65.4	Low	61.8	Low	13 Å²	13	50.2 Å²	50.2	8%	0.079	28%	0.28	C	S	.	.	H	α-helix	trans	-65	-44	177.4	170.4	0	0	0	0	111.3	T40 S67 T68 L69 L73 M74 N75 F107	T40-V71 HydrophobicContact CG2-CG1 3.41Å; T40-V71 VanDerWaalsContact CG2-CG1 3.41Å; S67-V71 WeakPolarHBondContact O-CG2 3.45Å; S67-V71 PolarHBondContact O-N 3.16Å; T68-V71 PolarHBondContact O-N 3.44Å; L69-V71 VanDerWaalsContact C-N 3.34Å; L69-V71 PolarHBondContact O-N 2.96Å; V71-L73 PolarHBondContact O-N 3.24Å; V71-M74 WeakPolarHBondContact O-CB 3.49Å; V71-M74 PolarHBondContact O-N 3.43Å; V71-N75 PolarHBondContact O-N 3.07Å; V71-N75 PolarHBondContact O-ND2 3.39Å; V71-F107 HydrophobicContact CG2-CD2 3.81Å; V71-F107 HydrophobicContact CG2-CE2 3.5Å; V71-F107 HydrophobicContact CG2-CZ 4.03Å
72	I	66.3	Low	62.2	Low	94 Å²	94	49.6 Å²	49.6	48%	0.482	28%	0.283	S	S	.	.	H	α-helix	trans	-61.5	-45.9	178	-67.8	165.8	0	0	0	110.4	T68 L69 N75 L76	T68-I72 VanDerWaalsContact O-CG1 3.29Å; T68-I72 WeakPolarHBondContact O-CG1 3.37Å; T68-I72 PolarHBondContact O-N 3.34Å; L69-I72 PolarHBondContact O-N 3.32Å; I72-N75 PolarHBondContact O-N 2.94Å; I72-L76 HydrophobicContact CG2-CD1 3.9Å; I72-L76 HydrophobicContact CG2-CG 4.49Å; I72-L76 WeakPolarHBondContact O-CB 3.17Å; I72-L76 WeakPolarHBondContact O-CG 3Å; I72-L76 PolarHBondContact O-N 3.26Å
73	L	64.9	Low	62.6	Low	68 Å²	68	52.8 Å²	52.8	36%	0.356	29%	0.291	S	S	.	.	H	α-helix	trans	-64.6	-38.7	177.2	-69.9	172.6	0	0	0	112.3	L69 C70 V71 L76 C77 F103	L69-L73 HydrophobicContact CD2-CD1 4.47Å; L69-L73 WeakPolarHBondContact O-CB 3.44Å; L69-L73 VanDerWaalsContact O-CG 3.3Å; L69-L73 WeakPolarHBondContact O-CG 3.34Å; L69-L73 PolarHBondContact O-N 2.74Å; C70-L73 PolarHBondContact O-N 3.47Å; V71-L73 PolarHBondContact O-N 3.24Å; L73-L76 HydrophobicContact CD2-CD1 4.45Å; L73-L76 PolarHBondContact O-N 3.47Å; L73-C77 WeakPolarHBondContact O-CB 3.5Å; L73-C77 PolarHBondContact O-N 3.27Å; L73-F103 HydrophobicContact CB-CD1 4.45Å; L73-F103 HydrophobicContact CB-CD2 4.39Å; L73-F103 HydrophobicContact CB-CE1 4.08Å; L73-F103 HydrophobicContact CB-CE2 3.96Å; L73-F103 HydrophobicContact CB-CZ 3.81Å; L73-F103 HydrophobicContact CD1-CE1 3.77Å; L73-F103 HydrophobicContact CD1-CZ 3.87Å; L73-F103 HydrophobicContact CG-CZ 4.39Å
74	M	66.9	Low	62.3	Low	42 Å²	42	55.8 Å²	55.8	21%	0.207	30%	0.299	C	S	.	.	H	α-helix	trans	-59.4	-48.2	173.8	-172.3	-172.9	80.7	0	0	110.8	C70 V71 C77 L78 P100 F103 L104	C70-M74 WeakPolarHBondContact O-CB 3.3Å; C70-M74 PolarHBondContact O-N 3.1Å; V71-M74 WeakPolarHBondContact O-CB 3.49Å; V71-M74 PolarHBondContact O-N 3.43Å; M74-C77 PolarHBondContact O-N 3.07Å; M74-L78 HydrophobicContact CE-CD1 4.17Å; M74-L78 HydrophobicContact CG-CD1 3.92Å; M74-L78 WeakPolarHBondContact O-CD1 3.43Å; M74-L78 PolarHBondContact O-N 3.19Å; M74-P100 HydrophobicContact CG-CB 4.33Å; M74-F103 HydrophobicContact CB-CB 4.32Å; M74-L104 HydrophobicContact SD-CB 4.44Å; M74-L104 HydrophobicContact SD-CD1 3.78Å
75	N	63.3	Low	61.7	Low	27 Å²	27	61.5 Å²	61.5	14%	0.144	33%	0.33	C	S	.	.	H	α-helix	trans	-63.8	-43.4	179.1	-70.8	-25.6	0	0	0	111.8	I38 V71 I72 C77 L78 T79	I38-N75 WeakPolarHBondContact CD1-OD1 3.34Å; V71-N75 PolarHBondContact O-N 3.07Å; V71-N75 PolarHBondContact O-ND2 3.39Å; I72-N75 PolarHBondContact O-N 2.94Å; N75-C77 VanDerWaalsContact C-N 3.3Å; N75-C77 PolarHBondContact O-N 3.18Å; N75-L78 PolarHBondContact O-N 3.41Å; N75-T79 WeakPolarHBondContact O-CG2 3.48Å; N75-T79 PolarHBondContact O-N 2.95Å; N75-T79 PolarHBondContact O-OG1 3.48Å
76	L	64	Low	60.8	Low	77 Å²	77	64.5 Å²	64.5	40%	0.403	35%	0.346	S	S	.	.	H	α-helix	trans	-60.1	-38.8	174.1	-75.2	166.2	0	0	0	112.3	I72 L73 T79 A80	I72-L76 HydrophobicContact CG2-CD1 3.9Å; I72-L76 HydrophobicContact CG2-CG 4.49Å; I72-L76 WeakPolarHBondContact O-CB 3.17Å; I72-L76 WeakPolarHBondContact O-CG 3Å; I72-L76 PolarHBondContact O-N 3.26Å; L73-L76 HydrophobicContact CD2-CD1 4.45Å; L73-L76 PolarHBondContact O-N 3.47Å; L76-T79 WeakPolarHBondContact CA-OG1 3.21Å; L76-T79 PolarHBondContact O-OG1 2.92Å; L76-A80 VanDerWaalsContact O-CB 3.25Å; L76-A80 WeakPolarHBondContact O-CB 3.29Å; L76-A80 PolarHBondContact O-N 3.22Å
77	C	64.3	Low	59.3	Low	28 Å²	28	70.5 Å²	70.5	19%	0.189	37%	0.369	C	S	.	.	H	α-helix	trans	-68.2	-41.4	177.5	-164.6	0	0	0	0	111.7	L73 M74 N75 H81 P100	L73-C77 WeakPolarHBondContact O-CB 3.5Å; L73-C77 PolarHBondContact O-N 3.27Å; M74-C77 PolarHBondContact O-N 3.07Å; N75-C77 VanDerWaalsContact C-N 3.3Å; N75-C77 PolarHBondContact O-N 3.18Å; C77-H81 PolarHBondContact O-N 3.4Å; C77-H81 VanDerWaalsContact O-N 3.1Å; C77-P100 HydrophobicContact CB-CG 4.09Å
78	L	61.8	Low	58.1	Low	51 Å²	51	74.6 Å²	74.6	27%	0.267	40%	0.398	S	S	.	.	H	α-helix	trans	-64.2	-44.2	175.4	-79.8	153	0	0	0	112.2	M74 N75 H81 A82 W153	M74-L78 HydrophobicContact CE-CD1 4.17Å; M74-L78 HydrophobicContact CG-CD1 3.92Å; M74-L78 WeakPolarHBondContact O-CD1 3.43Å; M74-L78 PolarHBondContact O-N 3.19Å; N75-L78 PolarHBondContact O-N 3.41Å; L78-H81 PolarHBondContact O-N 3.06Å; L78-A82 PolarHBondContact O-N 2.94Å; L78-W153 HydrophobicContact CD2-CH2 3.98Å; L78-W153 HydrophobicContact CD2-CZ2 3.68Å
79	T	57.3	Low	57.2	Low	40 Å²	40	80.8 Å²	80.8	25%	0.245	42%	0.423	C	S	.	.	H	α-helix	trans	-67.1	-41	177.9	55.9	0	0	0	0	111.6	N75 L76 H81 A82 E83	N75-T79 WeakPolarHBondContact O-CG2 3.48Å; N75-T79 PolarHBondContact O-N 2.95Å; N75-T79 PolarHBondContact O-OG1 3.48Å; L76-T79 WeakPolarHBondContact CA-OG1 3.21Å; L76-T79 PolarHBondContact O-OG1 2.92Å; T79-H81 PolarHBondContact O-N 3.04Å; T79-A82 PolarHBondContact O-N 3.24Å; T79-E83 PolarHBondContact O-N 3.43Å
80	A	59.5	Low	56.5	Low	48 Å²	48	82.7 Å²	82.7	40%	0.397	44%	0.438	S	S	.	.	H	α-helix	trans	-60.8	-33.5	174.3	0	0	0	0	0	112.5	L76 R84	L76-A80 VanDerWaalsContact O-CB 3.25Å; L76-A80 WeakPolarHBondContact O-CB 3.29Å; L76-A80 PolarHBondContact O-N 3.22Å; A80-R84 PolarHBondContact O-N 2.9Å
81	H	57.9	Low	55.6	Low	32 Å²	32	88.3 Å²	88.3	15%	0.148	47%	0.467	C	S	.	.	H	α-helix	trans	-69.6	-42.5	171.5	-174.4	-57.2	0	0	0	111.6	C77 L78 T79 E83 R84 W153	C77-H81 PolarHBondContact O-N 3.4Å; C77-H81 VanDerWaalsContact O-N 3.1Å; L78-H81 PolarHBondContact O-N 3.06Å; T79-H81 PolarHBondContact O-N 3.04Å; H81-E83 VanDerWaalsContact C-N 3.33Å; H81-E83 PolarHBondContact O-N 3.32Å; H81-R84 PolarHBondContact O-N 3.26Å; H81-W153 HydrophobicContact CB-CH2 4.45Å; H81-W153 HydrophobicContact CB-CZ3 4.32Å; H81-W153 AromaticContact CD2-CZ3 3.58Å; H81-W153 AromaticContact CE1-CZ3 3.59Å; H81-W153 AromaticContact CG-CZ3 3.59Å; H81-W153 AromaticContact ND1-CH2 3.96Å; H81-W153 AromaticContact ND1-CZ3 3.59Å; H81-W153 AromaticContact NE2-CZ3 3.6Å
82	A	54.7	Low	55.1	Low	63 Å²	63	90.8 Å²	90.8	52%	0.521	48%	0.48	S	S	.	.	H	α-helix	trans	-62.8	-38.1	-179.2	0	0	0	0	0	112.5	L78 T79	L78-A82 PolarHBondContact O-N 2.94Å; T79-A82 PolarHBondContact O-N 3.24Å
83	E	55.4	Low	54.3	Low	126 Å²	126	90.6 Å²	90.6	59%	0.589	47%	0.474	S	S	*	.	H	α-helix	trans	-74	-22.5	178	-73.6	-173.3	158.2	0	0	113.4	N33 T79 H81 N85	N33-E83 PolarHBondContact ND2-OE1 3.46Å; N33-E83 VanDerWaalsContact ND2-OE1 3.1Å; T79-E83 PolarHBondContact O-N 3.43Å; H81-E83 VanDerWaalsContact C-N 3.33Å; H81-E83 PolarHBondContact O-N 3.32Å; E83-N85 VanDerWaalsContact C-N 3.28Å; E83-N85 PolarHBondContact O-N 3.31Å
84	R	51.5	Low	53.6	Low	148 Å²	148	93.4 Å²	93.4	56%	0.558	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	9.6	-177.9	-93.7	-177.1	178.4	170.2	1.5	115.9	A80 H81 N86	A80-R84 PolarHBondContact O-N 2.9Å; H81-R84 PolarHBondContact O-N 3.26Å; R84-N86 PolarHBondContact O-N 3.39Å
85	N	49.8	Very low	53.2	Low	132 Å²	132	95.7 Å²	95.7	71%	0.706	50%	0.499	S	S	*	.			trans	-69.8	14.1	180	-94.7	-12.3	0	0	0	116	E83	E83-N85 VanDerWaalsContact C-N 3.28Å; E83-N85 PolarHBondContact O-N 3.31Å
86	N	43	Very low	52.7	Low	143 Å²	143	95.5 Å²	95.5	77%	0.765	50%	0.499	S	S	*	.	S	Bend	trans	-123	103	168.8	-90.3	-25.4	0	0	0	111.2	R84	R84-N86 PolarHBondContact O-N 3.39Å
87	K	37.9	Very low	52.5	Low	206 Å²	206	94 Å²	94	90%	0.896	49%	0.487	S	S	*	.	S	Bend	trans	50.5	72.9	154.6	-64.2	178.5	177.4	177.3	0	116.1
88	S	40.3	Very low	52.4	Low	92 Å²	92	96.1 Å²	96.1	64%	0.643	50%	0.497	S	S	*	.			trans	-173.2	130.2	141.2	40.9	0	0	0	0	112.8
89	F	44.3	Very low	52.6	Low	158 Å²	158	99.7 Å²	99.7	69%	0.693	51%	0.507	S	S	*	.			trans	77	94.8	148	-99.1	-103.7	0	0	0	120.1	N91 N92	F89-N91 HydrophobicContact CD1-CB 3.72Å; F89-N91 HydrophobicContact CE1-CB 4.19Å; F89-N91 PolarHBondContact O-N 3.3Å; F89-N92 PolarHBondContact O-N 3.2Å
90	V	52.4	Low	52.8	Low	137 Å²	137	98.7 Å²	98.7	83%	0.83	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-46.5	-24.5	159.9	174.4	0	0	0	0	113.4	Y93	V90-Y93 WeakPolarHBondContact O-CB 3.42Å; V90-Y93 PolarHBondContact O-N 3.44Å
91	N	47.3	Very low	53	Low	130 Å²	130	100.6 Å²	100.6	70%	0.695	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-81.2	-16.5	-175	-124.8	15.9	0	0	0	114.9	F89	F89-N91 HydrophobicContact CD1-CB 3.72Å; F89-N91 HydrophobicContact CE1-CB 4.19Å; F89-N91 PolarHBondContact O-N 3.3Å
92	N	53.9	Low	53.6	Low	64 Å²	64	103.1 Å²	103.1	34%	0.342	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-91.4	0.4	172.7	-84.2	-19.8	0	0	0	113.1	F89 M94 I95 T96	F89-N92 PolarHBondContact O-N 3.2Å; N92-M94 VanDerWaalsContact C-N 3.33Å; N92-M94 PolarHBondContact O-N 3.03Å; N92-I95 PolarHBondContact O-N 3.19Å; N92-T96 HydrophobicContact CB-CG2 4.48Å; N92-T96 WeakPolarHBondContact O-CG2 3.48Å; N92-T96 PolarHBondContact O-N 3.28Å; N92-T96 PolarHBondContact O-OG1 3.08Å; N92-T96 VanDerWaalsContact O-OG1 3.14Å
93	Y	49.6	Very low	54.2	Low	91 Å²	91	101.4 Å²	101.4	36%	0.357	49%	0.493	S	S	.	.	H	α-helix	trans	-63.3	-37.6	-173.1	-171	-99.3	0	0	0	113.3	V90 T96 R97 P155	V90-Y93 WeakPolarHBondContact O-CB 3.42Å; V90-Y93 PolarHBondContact O-N 3.44Å; Y93-T96 PolarHBondContact O-OG1 2.83Å; Y93-R97 VanDerWaalsContact CZ-CZ 3.49Å; Y93-R97 PolarHBondContact O-N 3.3Å; Y93-R97 PolarHBondContact OH-NH1 3.12Å; Y93-P155 HydrophobicContact CE1-CG 4.17Å; Y93-P155 WeakPolarHBondContact OH-CA 2.96Å; Y93-P155 VanDerWaalsContact OH-CB 3.28Å; Y93-P155 WeakPolarHBondContact OH-CB 3.46Å
94	M	51.1	Low	54.6	Low	127 Å²	127	96.6 Å²	96.6	63%	0.626	47%	0.471	S	S	*	.	H	α-helix	trans	-68.2	-44.4	175.6	-69.3	-68	-88.5	0	0	110.8	N92 R97 L98	N92-M94 VanDerWaalsContact C-N 3.33Å; N92-M94 PolarHBondContact O-N 3.03Å; M94-R97 PolarHBondContact O-N 3.32Å; M94-L98 HydrophobicContact CB-CD1 3.98Å; M94-L98 HydrophobicContact CE-CD1 3.9Å; M94-L98 WeakPolarHBondContact O-CB 3.42Å; M94-L98 WeakPolarHBondContact O-CD1 3.29Å; M94-L98 WeakPolarHBondContact O-CG 3.39Å; M94-L98 PolarHBondContact O-N 2.96Å; M94-L98 HydrophobicContact SD-CD1 4.26Å
95	I	57.1	Low	55.4	Low	90 Å²	90	96 Å²	96	46%	0.462	47%	0.473	S	S	.	.	H	α-helix	trans	-65.8	-44.4	-178	-63	174.4	0	0	0	110.7	N92 R97 W99	N92-I95 PolarHBondContact O-N 3.19Å; I95-R97 VanDerWaalsContact C-N 3.31Å; I95-R97 PolarHBondContact O-N 3Å; I95-W99 WeakPolarHBondContact O-CB 3.38Å; I95-W99 PolarHBondContact O-N 2.8Å
96	T	54.3	Low	56.5	Low	23 Å²	23	92.9 Å²	92.9	14%	0.141	46%	0.455	C	S	.	.	H	α-helix	trans	-72.7	-21.1	-176.6	57.8	0	0	0	0	113.9	N92 Y93	N92-T96 HydrophobicContact CB-CG2 4.48Å; N92-T96 WeakPolarHBondContact O-CG2 3.48Å; N92-T96 PolarHBondContact O-N 3.28Å; N92-T96 PolarHBondContact O-OG1 3.08Å; N92-T96 VanDerWaalsContact O-OG1 3.14Å; Y93-T96 PolarHBondContact O-OG1 2.83Å
97	R	59.1	Low	57.9	Low	44 Å²	44	86.7 Å²	86.7	17%	0.166	42%	0.421	C	S	.	.	H	α-helix	trans	-101.6	-29.4	179	-73.1	-176.6	164.6	-153.4	-6.2	114.5	Y93 M94 I95 W153 L154	Y93-R97 VanDerWaalsContact CZ-CZ 3.49Å; Y93-R97 PolarHBondContact O-N 3.3Å; Y93-R97 PolarHBondContact OH-NH1 3.12Å; M94-R97 PolarHBondContact O-N 3.32Å; I95-R97 VanDerWaalsContact C-N 3.31Å; I95-R97 PolarHBondContact O-N 3Å; R97-W153 PolarHBondContact NH1-O 2.91Å; R97-L154 PolarHBondContact NH1-O 3.1Å
98	L	62.4	Low	59.4	Low	73 Å²	73	79.3 Å²	79.3	38%	0.382	39%	0.391	S	S	.	.	H	α-helix	trans	-79.8	-39.8	-179.1	-71.2	165.5	0	0	0	112.4	M94 R101 I102	M94-L98 HydrophobicContact CB-CD1 3.98Å; M94-L98 HydrophobicContact CE-CD1 3.9Å; M94-L98 WeakPolarHBondContact O-CB 3.42Å; M94-L98 WeakPolarHBondContact O-CD1 3.29Å; M94-L98 WeakPolarHBondContact O-CG 3.39Å; M94-L98 PolarHBondContact O-N 2.96Å; M94-L98 HydrophobicContact SD-CD1 4.26Å; L98-R101 WeakPolarHBondContact O-CB 3.36Å; L98-R101 PolarHBondContact O-N 3.35Å; L98-R101 VanDerWaalsContact O-N 3.08Å; L98-I102 HydrophobicContact CB-CD1 4.48Å; L98-I102 WeakPolarHBondContact O-CG1 2.9Å; L98-I102 PolarHBondContact O-N 3.19Å
99	W	65.6	Low	61	Low	126 Å²	126	78.4 Å²	78.4	48%	0.477	38%	0.378	S	S	.	.	H	α-helix	trans	-58.8	-44.8	-175.8	-89.7	86.9	0	0	0	114.5	I95 R101 I102 F103	I95-W99 WeakPolarHBondContact O-CB 3.38Å; I95-W99 PolarHBondContact O-N 2.8Å; W99-R101 PolarHBondContact O-N 3.06Å; W99-I102 PolarHBondContact O-N 2.81Å; W99-F103 HydrophobicContact CD2-CE2 4.35Å; W99-F103 HydrophobicContact CE3-CD2 4.01Å; W99-F103 HydrophobicContact CE3-CE1 4.34Å; W99-F103 AromaticContact CE3-CE2 3.26Å; W99-F103 HydrophobicContact CE3-CE2 3.26Å; W99-F103 AromaticContact CE3-CZ 3.45Å; W99-F103 HydrophobicContact CE3-CZ 3.45Å; W99-F103 VanDerWaalsContact CE3-CZ 3.45Å; W99-F103 HydrophobicContact CZ3-CE1 4.15Å; W99-F103 AromaticContact CZ3-CE2 3.76Å; W99-F103 HydrophobicContact CZ3-CE2 3.76Å; W99-F103 AromaticContact CZ3-CZ 3.39Å; W99-F103 HydrophobicContact CZ3-CZ 3.39Å; W99-F103 VanDerWaalsContact O-CD2 3.27Å; W99-F103 WeakPolarHBondContact O-CD2 3.19Å; W99-F103 PolarHBondContact O-N 3.36Å
100	P	62.4	Low	62.4	Low	20 Å²	20	71.8 Å²	71.8	13%	0.13	35%	0.35	C	S	.	.	H	α-helix	trans	-60	-35.6	175.5	-23.7	33.8	0	0	0	112.8	M74 C77 L104	M74-P100 HydrophobicContact CG-CB 4.33Å; C77-P100 HydrophobicContact CB-CG 4.09Å; P100-L104 WeakPolarHBondContact O-CB 2.69Å; P100-L104 PolarHBondContact O-N 2.93Å
101	R	64	Low	63.4	Low	88 Å²	88	66.2 Å²	66.2	33%	0.332	32%	0.315	S	S	.	.	H	α-helix	trans	-67.8	-41.1	177.6	-60.7	178.5	179.1	-169.2	-3.3	111.4	L98 W99 F105 V150	L98-R101 WeakPolarHBondContact O-CB 3.36Å; L98-R101 PolarHBondContact O-N 3.35Å; L98-R101 VanDerWaalsContact O-N 3.08Å; W99-R101 PolarHBondContact O-N 3.06Å; R101-F105 WeakPolarHBondContact O-CB 3.38Å; R101-F105 PolarHBondContact O-N 3.48Å; R101-F105 VanDerWaalsContact O-N 3.07Å; R101-V150 HydrophobicContact CG-CG2 4.21Å; R101-V150 PolarHBondContact NH2-O 3.24Å
102	I	68.6	Low	64.8	Low	84 Å²	84	68 Å²	68	43%	0.431	31%	0.313	S	S	.	.	H	α-helix	trans	-64.8	-47.3	177.4	-65.7	165.5	0	0	0	110.3	L98 W99 L104 F105 I106	L98-I102 HydrophobicContact CB-CD1 4.48Å; L98-I102 WeakPolarHBondContact O-CG1 2.9Å; L98-I102 PolarHBondContact O-N 3.19Å; W99-I102 PolarHBondContact O-N 2.81Å; I102-L104 VanDerWaalsContact C-N 3.32Å; I102-L104 PolarHBondContact O-N 3.16Å; I102-F105 PolarHBondContact O-N 3.48Å; I102-I106 HydrophobicContact CG2-CD1 3.74Å; I102-I106 HydrophobicContact CG2-CG1 4.42Å; I102-I106 VanDerWaalsContact O-CG1 3.29Å; I102-I106 WeakPolarHBondContact O-CG1 3.19Å; I102-I106 PolarHBondContact O-N 3.39Å
103	F	67.4	Low	65.8	Low	28 Å²	28	69.1 Å²	69.1	12%	0.123	32%	0.319	C	S	.	.	H	α-helix	trans	-61.6	-39.8	178.4	-78.3	-56.4	0	0	0	112.9	L73 M74 W99 I106 F107	L73-F103 HydrophobicContact CB-CD1 4.45Å; L73-F103 HydrophobicContact CB-CD2 4.39Å; L73-F103 HydrophobicContact CB-CE1 4.08Å; L73-F103 HydrophobicContact CB-CE2 3.96Å; L73-F103 HydrophobicContact CB-CZ 3.81Å; L73-F103 HydrophobicContact CD1-CE1 3.77Å; L73-F103 HydrophobicContact CD1-CZ 3.87Å; L73-F103 HydrophobicContact CG-CZ 4.39Å; M74-F103 HydrophobicContact CB-CB 4.32Å; W99-F103 HydrophobicContact CD2-CE2 4.35Å; W99-F103 HydrophobicContact CE3-CD2 4.01Å; W99-F103 HydrophobicContact CE3-CE1 4.34Å; W99-F103 AromaticContact CE3-CE2 3.26Å; W99-F103 HydrophobicContact CE3-CE2 3.26Å; W99-F103 AromaticContact CE3-CZ 3.45Å; W99-F103 HydrophobicContact CE3-CZ 3.45Å; W99-F103 VanDerWaalsContact CE3-CZ 3.45Å; W99-F103 HydrophobicContact CZ3-CE1 4.15Å; W99-F103 AromaticContact CZ3-CE2 3.76Å; W99-F103 HydrophobicContact CZ3-CE2 3.76Å; W99-F103 AromaticContact CZ3-CZ 3.39Å; W99-F103 HydrophobicContact CZ3-CZ 3.39Å; W99-F103 VanDerWaalsContact O-CD2 3.27Å; W99-F103 WeakPolarHBondContact O-CD2 3.19Å; W99-F103 PolarHBondContact O-N 3.36Å; F103-I106 PolarHBondContact O-N 3.26Å; F103-F107 WeakPolarHBondContact O-CB 3.36Å; F103-F107 PolarHBondContact O-N 3.31Å
104	L	64.9	Low	66.9	Low	25 Å²	25	65.4 Å²	65.4	13%	0.131	31%	0.305	C	S	.	.	H	α-helix	trans	-62.3	-45	175.4	-169.4	92.1	0	0	0	112	M74 P100 I102 I106 F107 L108 T146	M74-L104 HydrophobicContact SD-CB 4.44Å; M74-L104 HydrophobicContact SD-CD1 3.78Å; P100-L104 WeakPolarHBondContact O-CB 2.69Å; P100-L104 PolarHBondContact O-N 2.93Å; I102-L104 VanDerWaalsContact C-N 3.32Å; I102-L104 PolarHBondContact O-N 3.16Å; L104-I106 VanDerWaalsContact C-N 3.33Å; L104-I106 PolarHBondContact O-N 3.48Å; L104-F107 WeakPolarHBondContact O-CB 3.28Å; L104-F107 PolarHBondContact O-N 2.97Å; L104-L108 PolarHBondContact O-N 2.57Å; L104-T146 HydrophobicContact CD1-CG2 3.31Å; L104-T146 HydrophobicContact CD2-CG2 3.62Å; L104-T146 WeakPolarHBondContact CD2-OG1 3.34Å; L104-T146 HydrophobicContact CG-CG2 4.01Å
105	F	68.3	Low	68.1	Low	136 Å²	136	61.9 Å²	61.9	60%	0.596	29%	0.285	S	S	*	.	H	α-helix	trans	-63.7	-41.4	178.7	-170.8	-106.3	0	0	0	111.6	R101 I102 F107 L108 I109	R101-F105 WeakPolarHBondContact O-CB 3.38Å; R101-F105 PolarHBondContact O-N 3.48Å; R101-F105 VanDerWaalsContact O-N 3.07Å; I102-F105 PolarHBondContact O-N 3.48Å; F105-F107 VanDerWaalsContact C-N 3.34Å; F105-F107 PolarHBondContact O-N 3.34Å; F105-L108 PolarHBondContact O-N 2.89Å; F105-I109 HydrophobicContact CD1-CD1 3.6Å; F105-I109 HydrophobicContact CE1-CD1 3.33Å; F105-I109 HydrophobicContact CE1-CG1 4.32Å; F105-I109 HydrophobicContact CG-CD1 4.44Å; F105-I109 HydrophobicContact CZ-CD1 3.97Å; F105-I109 WeakPolarHBondContact O-CG1 3.34Å; F105-I109 PolarHBondContact O-N 3.23Å
106	I	72.3	Confident	69	Low	66 Å²	66	61.3 Å²	61.3	34%	0.338	29%	0.289	S	S	.	.	H	α-helix	trans	-60.1	-44.6	173.4	-69	167.3	0	0	0	110.8	I102 F103 L104 L108 I109 I110	I102-I106 HydrophobicContact CG2-CD1 3.74Å; I102-I106 HydrophobicContact CG2-CG1 4.42Å; I102-I106 VanDerWaalsContact O-CG1 3.29Å; I102-I106 WeakPolarHBondContact O-CG1 3.19Å; I102-I106 PolarHBondContact O-N 3.39Å; F103-I106 PolarHBondContact O-N 3.26Å; L104-I106 VanDerWaalsContact C-N 3.33Å; L104-I106 PolarHBondContact O-N 3.48Å; I106-L108 PolarHBondContact O-N 3.46Å; I106-I109 PolarHBondContact O-N 3Å; I106-I110 HydrophobicContact CG2-CD1 3.64Å; I106-I110 HydrophobicContact CG2-CG1 4.34Å; I106-I110 VanDerWaalsContact O-CG1 3.3Å; I106-I110 WeakPolarHBondContact O-CG1 3.38Å; I106-I110 PolarHBondContact O-N 2.93Å
107	F	71.8	Confident	70.1	Confident	13 Å²	13	64.4 Å²	64.4	6%	0.057	31%	0.308	C	S	.	.	H	α-helix	trans	-60.4	-44.7	177.9	175.8	-97.5	0	0	0	112.4	C70 V71 F103 L104 F105 I109 I110 Q111 D142	C70-F107 HydrophobicContact CB-CB 4.35Å; V71-F107 HydrophobicContact CG2-CD2 3.81Å; V71-F107 HydrophobicContact CG2-CE2 3.5Å; V71-F107 HydrophobicContact CG2-CZ 4.03Å; F103-F107 WeakPolarHBondContact O-CB 3.36Å; F103-F107 PolarHBondContact O-N 3.31Å; L104-F107 WeakPolarHBondContact O-CB 3.28Å; L104-F107 PolarHBondContact O-N 2.97Å; F105-F107 VanDerWaalsContact C-N 3.34Å; F105-F107 PolarHBondContact O-N 3.34Å; F107-I109 VanDerWaalsContact C-N 3.34Å; F107-I109 PolarHBondContact O-N 3.46Å; F107-I110 PolarHBondContact O-N 3.06Å; F107-Q111 HydrophobicContact CD1-CG 4.48Å; F107-Q111 HydrophobicContact CE1-CG 4.21Å; F107-Q111 HydrophobicContact CE2-CG 4.43Å; F107-Q111 HydrophobicContact CZ-CG 4.23Å; F107-Q111 WeakPolarHBondContact O-CB 3.37Å; F107-Q111 WeakPolarHBondContact O-CG 3.3Å; F107-Q111 PolarHBondContact O-N 3.22Å; F107-D142 WeakPolarHBondContact CE1-OD2 3.44Å
108	L	69.5	Low	70.8	Confident	51 Å²	51	63.5 Å²	63.5	27%	0.267	31%	0.306	S	S	.	.	H	α-helix	trans	-61.6	-40.8	175.9	-72.6	171.7	0	0	0	112.1	L104 F105 I106 Q111 Y112 I143	L104-L108 PolarHBondContact O-N 2.57Å; F105-L108 PolarHBondContact O-N 2.89Å; I106-L108 PolarHBondContact O-N 3.46Å; L108-Q111 PolarHBondContact O-N 3.2Å; L108-Y112 WeakPolarHBondContact O-CB 2.89Å; L108-Y112 PolarHBondContact O-N 3.48Å; L108-I143 HydrophobicContact CD2-CG1 4.29Å
109	I	74.3	Confident	71.4	Confident	72 Å²	72	65.6 Å²	65.6	37%	0.369	32%	0.322	S	S	.	.	H	α-helix	trans	-63.9	-48	176.2	-70	167.4	0	0	0	110.9	F105 I106 F107 Q111 Y112 L113	F105-I109 HydrophobicContact CD1-CD1 3.6Å; F105-I109 HydrophobicContact CE1-CD1 3.33Å; F105-I109 HydrophobicContact CE1-CG1 4.32Å; F105-I109 HydrophobicContact CG-CD1 4.44Å; F105-I109 HydrophobicContact CZ-CD1 3.97Å; F105-I109 WeakPolarHBondContact O-CG1 3.34Å; F105-I109 PolarHBondContact O-N 3.23Å; I106-I109 PolarHBondContact O-N 3Å; F107-I109 VanDerWaalsContact C-N 3.34Å; F107-I109 PolarHBondContact O-N 3.46Å; I109-Q111 VanDerWaalsContact C-N 3.29Å; I109-Q111 PolarHBondContact O-N 2.8Å; I109-Y112 PolarHBondContact O-N 3.37Å; I109-L113 HydrophobicContact CG2-CD1 3.93Å; I109-L113 HydrophobicContact CG2-CG 4.35Å; I109-L113 WeakPolarHBondContact O-CG 3.11Å; I109-L113 PolarHBondContact O-N 3.1Å
110	I	73.5	Confident	72.1	Confident	20 Å²	20	62.1 Å²	62.1	10%	0.103	31%	0.311	C	S	.	.	H	α-helix	trans	-59.3	-45.2	179.7	-69.1	163.4	0	0	0	110.2	I66 I106 F107 L113 E114	I66-I110 HydrophobicContact CB-CD1 4.43Å; I66-I110 HydrophobicContact CG2-CD1 3.53Å; I106-I110 HydrophobicContact CG2-CD1 3.64Å; I106-I110 HydrophobicContact CG2-CG1 4.34Å; I106-I110 VanDerWaalsContact O-CG1 3.3Å; I106-I110 WeakPolarHBondContact O-CG1 3.38Å; I106-I110 PolarHBondContact O-N 2.93Å; F107-I110 PolarHBondContact O-N 3.06Å; I110-L113 PolarHBondContact O-N 3.26Å; I110-E114 WeakPolarHBondContact O-CB 3.45Å; I110-E114 PolarHBondContact O-N 3.36Å
111	Q	73.7	Confident	72.8	Confident	19 Å²	19	66.7 Å²	66.7	9%	0.089	33%	0.334	C	S	.	.	H	α-helix	trans	-63	-42.6	178	-86.1	-162.3	-6.6	0	0	112.7	F107 L108 I109 L113 E114 Y115 R139	F107-Q111 HydrophobicContact CD1-CG 4.48Å; F107-Q111 HydrophobicContact CE1-CG 4.21Å; F107-Q111 HydrophobicContact CE2-CG 4.43Å; F107-Q111 HydrophobicContact CZ-CG 4.23Å; F107-Q111 WeakPolarHBondContact O-CB 3.37Å; F107-Q111 WeakPolarHBondContact O-CG 3.3Å; F107-Q111 PolarHBondContact O-N 3.22Å; L108-Q111 PolarHBondContact O-N 3.2Å; I109-Q111 VanDerWaalsContact C-N 3.29Å; I109-Q111 PolarHBondContact O-N 2.8Å; Q111-L113 VanDerWaalsContact C-N 3.34Å; Q111-E114 PolarHBondContact O-N 3.44Å; Q111-Y115 PolarHBondContact O-N 3.19Å; Q111-R139 VanDerWaalsContact CB-NH2 3.31Å; Q111-R139 PolarHBondContact O-NH2 3.02Å
112	Y	76	Confident	73.4	Confident	167 Å²	167	67.8 Å²	67.8	66%	0.655	34%	0.341	S	S	*	.	H	α-helix	trans	-60.9	-44.6	174.4	176.2	-99.1	0	0	0	111.4	L108 I109 Y115 S116	L108-Y112 WeakPolarHBondContact O-CB 2.89Å; L108-Y112 PolarHBondContact O-N 3.48Å; I109-Y112 PolarHBondContact O-N 3.37Å; Y112-Y115 PolarHBondContact O-N 3.35Å; Y112-S116 PolarHBondContact O-N 3.48Å
113	L	76.5	Confident	74	Confident	89 Å²	89	69.6 Å²	69.6	47%	0.466	36%	0.357	S	S	.	.	H	α-helix	trans	-61.4	-46.1	175.3	-70.7	172.3	0	0	0	111.4	I109 I110 Q111 Y115 S116 T117	I109-L113 HydrophobicContact CG2-CD1 3.93Å; I109-L113 HydrophobicContact CG2-CG 4.35Å; I109-L113 WeakPolarHBondContact O-CG 3.11Å; I109-L113 PolarHBondContact O-N 3.1Å; I110-L113 PolarHBondContact O-N 3.26Å; Q111-L113 VanDerWaalsContact C-N 3.34Å; L113-Y115 VanDerWaalsContact C-N 3.26Å; L113-Y115 PolarHBondContact O-N 3.01Å; L113-S116 WeakPolarHBondContact CA-OG 3.47Å; L113-S116 PolarHBondContact O-N 3.34Å; L113-S116 PolarHBondContact O-OG 2.73Å; L113-T117 WeakPolarHBondContact O-CG2 3.48Å; L113-T117 PolarHBondContact O-N 2.64Å; L113-T117 PolarHBondContact O-OG1 2.95Å
114	E	72.7	Confident	74.3	Confident	12 Å²	12	71.7 Å²	71.7	6%	0.056	38%	0.375	C	S	.	.	H	α-helix	trans	-54	-46.5	177.3	-170.1	-173.1	170.5	0	0	110.3	N64 I110 Q111 S116 T117 L118	N64-E114 PolarHBondContact ND2-OE1 3.47Å; N64-E114 PolarHBondContact OD1-OE1 3.27Å; N64-E114 PolarHBondContact OD1-OE2 3.14Å; I110-E114 WeakPolarHBondContact O-CB 3.45Å; I110-E114 PolarHBondContact O-N 3.36Å; Q111-E114 PolarHBondContact O-N 3.44Å; E114-S116 PolarHBondContact O-N 3.1Å; E114-T117 WeakPolarHBondContact CA-OG1 3.31Å; E114-T117 PolarHBondContact O-N 3.49Å; E114-T117 VanDerWaalsContact O-N 3.15Å; E114-T117 PolarHBondContact O-OG1 2.86Å; E114-L118 WeakPolarHBondContact O-CG 3.46Å; E114-L118 PolarHBondContact O-N 2.94Å
115	Y	75.6	Confident	74.6	Confident	53 Å²	53	72.2 Å²	72.2	21%	0.208	39%	0.386	C	S	.	.	H	α-helix	trans	-64.5	-38.2	177.2	-99.9	-127.2	0	0	0	114.1	Q111 Y112 L113 T117 L118 F131 F132 T135 G136	Q111-Y115 PolarHBondContact O-N 3.19Å; Y112-Y115 PolarHBondContact O-N 3.35Å; L113-Y115 VanDerWaalsContact C-N 3.26Å; L113-Y115 PolarHBondContact O-N 3.01Å; Y115-T117 PolarHBondContact O-N 3.08Å; Y115-L118 HydrophobicContact CD1-CD1 4.49Å; Y115-L118 HydrophobicContact CD2-CD1 3.98Å; Y115-L118 HydrophobicContact CG-CD1 4.04Å; Y115-L118 PolarHBondContact O-N 3.26Å; Y115-F131 HydrophobicContact CD2-CE1 4.43Å; Y115-F131 AromaticContact CE2-CE1 3.9Å; Y115-F131 HydrophobicContact CE2-CE1 3.9Å; Y115-F131 HydrophobicContact CE2-CZ 4.35Å; Y115-F132 HydrophobicContact CD1-CD1 4.15Å; Y115-F132 AromaticContact CD1-CE1 3.74Å; Y115-F132 HydrophobicContact CD1-CE1 3.74Å; Y115-F132 AromaticContact CE1-CD1 3.45Å; Y115-F132 HydrophobicContact CE1-CD1 3.45Å; Y115-F132 VanDerWaalsContact CE1-CD1 3.45Å; Y115-F132 AromaticContact CE1-CE1 3.53Å; Y115-F132 HydrophobicContact CE1-CE1 3.53Å; Y115-F132 AromaticContact CZ-CD1 3.88Å; Y115-T135 WeakPolarHBondContact CE2-OG1 3.42Å; Y115-T135 VanDerWaalsContact CZ-OG1 3.29Å; Y115-T135 WeakPolarHBondContact OH-CB 3.35Å; Y115-T135 PolarHBondContact OH-OG1 2.75Å; Y115-G136 PolarHBondContact OH-N 2.9Å
116	S	75.5	Confident	74.8	Confident	79 Å²	79	70.5 Å²	70.5	55%	0.552	38%	0.382	S	S	*	.	H	α-helix	trans	-67.3	-24.7	175.9	73.2	0	0	0	0	112.7	Y112 L113 E114	Y112-S116 PolarHBondContact O-N 3.48Å; L113-S116 WeakPolarHBondContact CA-OG 3.47Å; L113-S116 PolarHBondContact O-N 3.34Å; L113-S116 PolarHBondContact O-OG 2.73Å; E114-S116 PolarHBondContact O-N 3.1Å
117	T	77.1	Confident	74.6	Confident	88 Å²	88	69.7 Å²	69.7	54%	0.54	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-4.7	179.4	59.2	0	0	0	0	114.2	L113 E114 Y115 T119	L113-T117 WeakPolarHBondContact O-CG2 3.48Å; L113-T117 PolarHBondContact O-N 2.64Å; L113-T117 PolarHBondContact O-OG1 2.95Å; E114-T117 WeakPolarHBondContact CA-OG1 3.31Å; E114-T117 PolarHBondContact O-N 3.49Å; E114-T117 VanDerWaalsContact O-N 3.15Å; E114-T117 PolarHBondContact O-OG1 2.86Å; Y115-T117 PolarHBondContact O-N 3.08Å; T117-T119 PolarHBondContact O-N 3.06Å
118	L	75.2	Confident	74.4	Confident	24 Å²	24	69.4 Å²	69.4	13%	0.126	39%	0.39	C	S	.	.			trans	-65.9	127	179	-66.7	169.2	0	0	0	110.3	E114 Y115 F120 F131 F132	E114-L118 WeakPolarHBondContact O-CG 3.46Å; E114-L118 PolarHBondContact O-N 2.94Å; Y115-L118 HydrophobicContact CD1-CD1 4.49Å; Y115-L118 HydrophobicContact CD2-CD1 3.98Å; Y115-L118 HydrophobicContact CG-CD1 4.04Å; Y115-L118 PolarHBondContact O-N 3.26Å; L118-F120 HydrophobicContact CD2-CD1 4.46Å; L118-F120 HydrophobicContact CD2-CE1 3.68Å; L118-F120 HydrophobicContact CD2-CZ 3.74Å; L118-F120 PolarHBondContact O-N 2.68Å; L118-F131 HydrophobicContact CD1-CD1 4.35Å; L118-F131 HydrophobicContact CD1-CE1 3.6Å; L118-F131 HydrophobicContact CD1-CZ 4.39Å; L118-F131 HydrophobicContact CD2-CE1 4.2Å; L118-F131 HydrophobicContact CD2-CZ 4.37Å; L118-F132 HydrophobicContact CD1-CE1 3.89Å; L118-F132 HydrophobicContact CD1-CZ 3.67Å
119	T	75.3	Confident	74.4	Confident	118 Å²	118	68.1 Å²	68.1	72%	0.724	38%	0.384	S	S	*	.	S	Bend	trans	-84.8	2	178.2	61.8	0	0	0	0	113.1	T117	T117-T119 PolarHBondContact O-N 3.06Å
120	F	78.7	Confident	74.4	Confident	53 Å²	53	66.2 Å²	66.2	23%	0.232	38%	0.375	C	S	.	.	S	Bend	trans	-129.1	141	-172.5	67.8	-104.5	0	0	0	110.8	L118 S124 F131 F132	L118-F120 HydrophobicContact CD2-CD1 4.46Å; L118-F120 HydrophobicContact CD2-CE1 3.68Å; L118-F120 HydrophobicContact CD2-CZ 3.74Å; L118-F120 PolarHBondContact O-N 2.68Å; F120-S124 WeakPolarHBondContact CB-OG 3.45Å; F120-F131 HydrophobicContact CE2-CD1 4.11Å; F120-F131 AromaticContact CZ-CD1 4Å; F120-F131 HydrophobicContact CZ-CD1 4Å; F120-F131 HydrophobicContact CZ-CE1 4.38Å; F120-F131 HydrophobicContact CZ-CG 4.28Å; F120-F132 AromaticContact CD2-CE2 3.93Å; F120-F132 HydrophobicContact CD2-CE2 3.93Å; F120-F132 HydrophobicContact CE2-CD2 4.36Å; F120-F132 AromaticContact CE2-CE2 3.76Å; F120-F132 HydrophobicContact CE2-CE2 3.76Å; F120-F132 HydrophobicContact CE2-CZ 4.45Å
121	N	77.3	Confident	74.3	Confident	116 Å²	116	66.6 Å²	66.6	62%	0.62	38%	0.376	S	S	*	.			trans	-94.3	167.2	-179.1	-69.3	-12.9	0	0	0	111.1	T123 S124 S128	N121-T123 PolarHBondContact O-N 3.29Å; N121-S124 WeakPolarHBondContact O-CB 3.45Å; N121-S124 PolarHBondContact O-N 3.37Å; N121-S124 PolarHBondContact O-OG 2.82Å; N121-S128 WeakPolarHBondContact O-CB 3.34Å; N121-S128 PolarHBondContact O-OG 3.5Å
122	F	78	Confident	74.3	Confident	111 Å²	111	67.9 Å²	67.9	49%	0.487	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-47.8	-37.2	175.8	-175.9	-97.9	0	0	0	113.3	S128 F132 I133	F122-S128 PolarHBondContact O-OG 2.83Å; F122-S128 VanDerWaalsContact O-OG 3.09Å; F122-F132 HydrophobicContact CB-CD2 4.29Å; F122-F132 HydrophobicContact CD2-CB 3.77Å; F122-F132 HydrophobicContact CD2-CD2 4.26Å; F122-F132 HydrophobicContact CD2-CG 4.22Å; F122-F132 HydrophobicContact CE2-CB 4.25Å; F122-I133 HydrophobicContact CE2-CD1 4.36Å; F122-I133 HydrophobicContact CE2-CG1 4.12Å; F122-I133 HydrophobicContact CZ-CD1 4.42Å
123	T	80	Confident	74.3	Confident	122 Å²	122	63.9 Å²	63.9	75%	0.748	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-86.4	-2	-177.2	55	0	0	0	0	115.1	N121 G125	N121-T123 PolarHBondContact O-N 3.29Å; T123-G125 PolarHBondContact O-N 2.74Å
124	S	74.5	Confident	74.1	Confident	72 Å²	72	61.4 Å²	61.4	50%	0.503	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-72	-14.1	-172.9	66.6	0	0	0	0	114.7	F120 N121 S128	F120-S124 WeakPolarHBondContact CB-OG 3.45Å; N121-S124 WeakPolarHBondContact O-CB 3.45Å; N121-S124 PolarHBondContact O-N 3.37Å; N121-S124 PolarHBondContact O-OG 2.82Å; S124-S128 PolarHBondContact N-OG 3.44Å; S124-S128 WeakPolarHBondContact OG-CB 3.25Å; S124-S128 PolarHBondContact OG-OG 3.01Å
125	G	71.6	Confident	74	Confident	35 Å²	35	61.2 Å²	61.2	36%	0.361	36%	0.362	S	S	.	.			trans	169.5	171	173.5	0	0	0	0	0	111.7	T123 G127 S128 S129	T123-G125 PolarHBondContact O-N 2.74Å; G125-G127 PolarHBondContact O-N 3.29Å; G125-S128 PolarHBondContact N-OG 3.48Å; G125-S128 PolarHBondContact O-N 3.31Å; G125-S128 VanDerWaalsContact O-N 3.15Å; G125-S128 PolarHBondContact O-OG 3.14Å; G125-S129 PolarHBondContact O-N 3.04Å; G125-S129 VanDerWaalsContact O-N 3.11Å; G125-S129 PolarHBondContact O-OG 3.28Å
126	I	71.8	Confident	74	Confident	100 Å²	100	59.8 Å²	59.8	51%	0.513	36%	0.363	S	S	.	.	H	α-helix	trans	-62.2	-34.8	176.5	-118.2	157.8	0	0	0	111.3	S128 S129 I130 T212	I126-S128 VanDerWaalsContact C-N 3.34Å; I126-S128 PolarHBondContact O-N 2.94Å; I126-S129 WeakPolarHBondContact CA-OG 3.48Å; I126-S129 PolarHBondContact O-N 2.81Å; I126-S129 PolarHBondContact O-OG 3.42Å; I126-I130 HydrophobicContact CG2-CD1 3.99Å; I126-I130 WeakPolarHBondContact O-CB 2.94Å; I126-I130 WeakPolarHBondContact O-CD1 3.07Å; I126-I130 WeakPolarHBondContact O-CG1 3.39Å; I126-I130 PolarHBondContact O-N 2.93Å; I126-T212 HydrophobicContact CG2-CG2 3.79Å
127	G	68.1	Low	73.9	Confident	49 Å²	49	63.1 Å²	63.1	51%	0.505	37%	0.368	S	S	.	.	H	α-helix	trans	-64.1	-37.2	175.3	0	0	0	0	0	112.9	G125 F131	G125-G127 PolarHBondContact O-N 3.29Å; G127-F131 WeakPolarHBondContact O-CB 3.41Å; G127-F131 PolarHBondContact O-N 3.01Å
128	S	67	Low	73.7	Confident	8 Å²	8	60.1 Å²	60.1	6%	0.056	35%	0.351	C	S	.	.	H	α-helix	trans	-70.3	-44.7	176.7	59.7	0	0	0	0	111.7	N121 F122 S124 G125 I126 I130 F131 F132	N121-S128 WeakPolarHBondContact O-CB 3.34Å; N121-S128 PolarHBondContact O-OG 3.5Å; F122-S128 PolarHBondContact O-OG 2.83Å; F122-S128 VanDerWaalsContact O-OG 3.09Å; S124-S128 PolarHBondContact N-OG 3.44Å; S124-S128 WeakPolarHBondContact OG-CB 3.25Å; S124-S128 PolarHBondContact OG-OG 3.01Å; G125-S128 PolarHBondContact N-OG 3.48Å; G125-S128 PolarHBondContact O-N 3.31Å; G125-S128 VanDerWaalsContact O-N 3.15Å; G125-S128 PolarHBondContact O-OG 3.14Å; I126-S128 VanDerWaalsContact C-N 3.34Å; I126-S128 PolarHBondContact O-N 2.94Å; S128-I130 VanDerWaalsContact C-N 3.34Å; S128-I130 PolarHBondContact O-N 2.74Å; S128-F131 WeakPolarHBondContact O-CB 3.48Å; S128-F131 PolarHBondContact O-N 3.07Å; S128-F132 WeakPolarHBondContact O-CD2 3.44Å; S128-F132 PolarHBondContact O-N 3.44Å
129	S	69.7	Low	73.5	Confident	23 Å²	23	60.7 Å²	60.7	16%	0.161	35%	0.351	C	S	.	.	H	α-helix	trans	-62.2	-43.8	179.3	57.6	0	0	0	0	111.1	G125 I126 F131 F132 I133	G125-S129 PolarHBondContact O-N 3.04Å; G125-S129 VanDerWaalsContact O-N 3.11Å; G125-S129 PolarHBondContact O-OG 3.28Å; I126-S129 WeakPolarHBondContact CA-OG 3.48Å; I126-S129 PolarHBondContact O-N 2.81Å; I126-S129 PolarHBondContact O-OG 3.42Å; S129-F131 PolarHBondContact O-N 3.31Å; S129-F132 PolarHBondContact O-N 3.35Å; S129-I133 WeakPolarHBondContact O-CB 3.46Å; S129-I133 WeakPolarHBondContact O-CD1 3.28Å; S129-I133 WeakPolarHBondContact O-CG1 3.36Å; S129-I133 PolarHBondContact O-N 3.32Å
130	I	73.5	Confident	73.3	Confident	33 Å²	33	58.6 Å²	58.6	17%	0.169	34%	0.338	C	S	.	.	H	α-helix	trans	-60.2	-45.3	174.2	-66.2	165.2	0	0	0	110.9	I126 S128 F132 I133 A134 I205 I209	I126-I130 HydrophobicContact CG2-CD1 3.99Å; I126-I130 WeakPolarHBondContact O-CB 2.94Å; I126-I130 WeakPolarHBondContact O-CD1 3.07Å; I126-I130 WeakPolarHBondContact O-CG1 3.39Å; I126-I130 PolarHBondContact O-N 2.93Å; S128-I130 VanDerWaalsContact C-N 3.34Å; S128-I130 PolarHBondContact O-N 2.74Å; I130-F132 PolarHBondContact O-N 2.97Å; I130-I133 PolarHBondContact O-N 2.97Å; I130-A134 VanDerWaalsContact O-CB 3.31Å; I130-A134 WeakPolarHBondContact O-CB 3.39Å; I130-A134 PolarHBondContact O-N 3.33Å; I130-I205 HydrophobicContact CG2-CG2 4.15Å; I130-I209 HydrophobicContact CD1-CG1 4.13Å; I130-I209 HydrophobicContact CG2-CD1 4.12Å; I130-I209 HydrophobicContact CG2-CG1 4.47Å
131	F	72.9	Confident	73	Confident	28 Å²	28	60 Å²	60	12%	0.123	35%	0.345	C	S	.	.	H	α-helix	trans	-56.2	-51	176.9	174.6	-90.4	0	0	0	111.3	Y115 L118 F120 G127 S128 S129 I133 A134 T135	Y115-F131 HydrophobicContact CD2-CE1 4.43Å; Y115-F131 AromaticContact CE2-CE1 3.9Å; Y115-F131 HydrophobicContact CE2-CE1 3.9Å; Y115-F131 HydrophobicContact CE2-CZ 4.35Å; L118-F131 HydrophobicContact CD1-CD1 4.35Å; L118-F131 HydrophobicContact CD1-CE1 3.6Å; L118-F131 HydrophobicContact CD1-CZ 4.39Å; L118-F131 HydrophobicContact CD2-CE1 4.2Å; L118-F131 HydrophobicContact CD2-CZ 4.37Å; F120-F131 HydrophobicContact CE2-CD1 4.11Å; F120-F131 AromaticContact CZ-CD1 4Å; F120-F131 HydrophobicContact CZ-CD1 4Å; F120-F131 HydrophobicContact CZ-CE1 4.38Å; F120-F131 HydrophobicContact CZ-CG 4.28Å; G127-F131 WeakPolarHBondContact O-CB 3.41Å; G127-F131 PolarHBondContact O-N 3.01Å; S128-F131 WeakPolarHBondContact O-CB 3.48Å; S128-F131 PolarHBondContact O-N 3.07Å; S129-F131 PolarHBondContact O-N 3.31Å; F131-I133 PolarHBondContact O-N 3.43Å; F131-A134 PolarHBondContact O-N 2.94Å; F131-T135 HydrophobicContact CD2-CG2 4.18Å; F131-T135 HydrophobicContact CE1-CG2 4.33Å; F131-T135 HydrophobicContact CE2-CG2 3.84Å; F131-T135 HydrophobicContact CZ-CG2 3.93Å; F131-T135 WeakPolarHBondContact O-CB 3.24Å; F131-T135 PolarHBondContact O-N 2.88Å; F131-T135 PolarHBondContact O-OG1 3.44Å
132	F	73.8	Confident	72.7	Confident	45 Å²	45	56.1 Å²	56.1	20%	0.197	33%	0.325	C	S	.	.	H	α-helix	trans	-64	-38.7	179.5	-81.9	-72.5	0	0	0	112.6	Y115 L118 F120 F122 S128 S129 I130 G136	Y115-F132 HydrophobicContact CD1-CD1 4.15Å; Y115-F132 AromaticContact CD1-CE1 3.74Å; Y115-F132 HydrophobicContact CD1-CE1 3.74Å; Y115-F132 AromaticContact CE1-CD1 3.45Å; Y115-F132 HydrophobicContact CE1-CD1 3.45Å; Y115-F132 VanDerWaalsContact CE1-CD1 3.45Å; Y115-F132 AromaticContact CE1-CE1 3.53Å; Y115-F132 HydrophobicContact CE1-CE1 3.53Å; Y115-F132 AromaticContact CZ-CD1 3.88Å; L118-F132 HydrophobicContact CD1-CE1 3.89Å; L118-F132 HydrophobicContact CD1-CZ 3.67Å; F120-F132 AromaticContact CD2-CE2 3.93Å; F120-F132 HydrophobicContact CD2-CE2 3.93Å; F120-F132 HydrophobicContact CE2-CD2 4.36Å; F120-F132 AromaticContact CE2-CE2 3.76Å; F120-F132 HydrophobicContact CE2-CE2 3.76Å; F120-F132 HydrophobicContact CE2-CZ 4.45Å; F122-F132 HydrophobicContact CB-CD2 4.29Å; F122-F132 HydrophobicContact CD2-CB 3.77Å; F122-F132 HydrophobicContact CD2-CD2 4.26Å; F122-F132 HydrophobicContact CD2-CG 4.22Å; F122-F132 HydrophobicContact CE2-CB 4.25Å; S128-F132 WeakPolarHBondContact O-CD2 3.44Å; S128-F132 PolarHBondContact O-N 3.44Å; S129-F132 PolarHBondContact O-N 3.35Å; I130-F132 PolarHBondContact O-N 2.97Å; F132-G136 WeakPolarHBondContact O-CA 3.43Å; F132-G136 PolarHBondContact O-N 3.01Å
133	I	75.7	Confident	72.4	Confident	84 Å²	84	55.6 Å²	55.6	43%	0.431	33%	0.326	S	S	.	.	H	α-helix	trans	-64.6	-54.9	176.2	-69.5	164.8	0	0	0	109.7	F122 S129 I130 F131 T135 G136 F137	F122-I133 HydrophobicContact CE2-CD1 4.36Å; F122-I133 HydrophobicContact CE2-CG1 4.12Å; F122-I133 HydrophobicContact CZ-CD1 4.42Å; S129-I133 WeakPolarHBondContact O-CB 3.46Å; S129-I133 WeakPolarHBondContact O-CD1 3.28Å; S129-I133 WeakPolarHBondContact O-CG1 3.36Å; S129-I133 PolarHBondContact O-N 3.32Å; I130-I133 PolarHBondContact O-N 2.97Å; F131-I133 PolarHBondContact O-N 3.43Å; I133-T135 PolarHBondContact O-N 3.49Å; I133-G136 PolarHBondContact O-N 3.05Å; I133-F137 HydrophobicContact CG2-CD2 3.75Å; I133-F137 HydrophobicContact CG2-CE2 3.83Å; I133-F137 VanDerWaalsContact O-CD2 3.28Å; I133-F137 WeakPolarHBondContact O-CD2 3.44Å; I133-F137 PolarHBondContact O-N 3.36Å
134	A	71.2	Confident	72.1	Confident	36 Å²	36	55.5 Å²	55.5	30%	0.298	32%	0.32	S	S	.	.	H	α-helix	trans	-60.8	-50.4	-176.9	0	0	0	0	0	112	I130 F131 G136 F137 C138	I130-A134 VanDerWaalsContact O-CB 3.31Å; I130-A134 WeakPolarHBondContact O-CB 3.39Å; I130-A134 PolarHBondContact O-N 3.33Å; F131-A134 PolarHBondContact O-N 2.94Å; A134-G136 VanDerWaalsContact C-N 3.34Å; A134-G136 PolarHBondContact O-N 3.19Å; A134-F137 PolarHBondContact O-N 3.11Å; A134-C138 PolarHBondContact O-N 3.38Å; A134-C138 VanDerWaalsContact O-N 3.07Å; A134-C138 PolarHBondContact O-SG 3.35Å
135	T	72.3	Confident	72	Confident	8 Å²	8	54.3 Å²	54.3	5%	0.049	31%	0.31	C	S	.	.	H	α-helix	trans	-70.6	-31	179.8	53.3	0	0	0	0	112.4	Y115 F131 I133 R139	Y115-T135 WeakPolarHBondContact CE2-OG1 3.42Å; Y115-T135 VanDerWaalsContact CZ-OG1 3.29Å; Y115-T135 WeakPolarHBondContact OH-CB 3.35Å; Y115-T135 PolarHBondContact OH-OG1 2.75Å; F131-T135 HydrophobicContact CD2-CG2 4.18Å; F131-T135 HydrophobicContact CE1-CG2 4.33Å; F131-T135 HydrophobicContact CE2-CG2 3.84Å; F131-T135 HydrophobicContact CZ-CG2 3.93Å; F131-T135 WeakPolarHBondContact O-CB 3.24Å; F131-T135 PolarHBondContact O-N 2.88Å; F131-T135 PolarHBondContact O-OG1 3.44Å; I133-T135 PolarHBondContact O-N 3.49Å; T135-R139 WeakPolarHBondContact O-CB 3.46Å; T135-R139 WeakPolarHBondContact O-CG 3.3Å; T135-R139 PolarHBondContact O-N 2.94Å
136	G	75.6	Confident	71.8	Confident	23 Å²	23	53.6 Å²	53.6	24%	0.237	30%	0.298	C	S	.	.	H	α-helix	trans	-63.4	-46.1	171.7	0	0	0	0	0	112.5	Y115 F132 I133 A134 R139 T140	Y115-G136 PolarHBondContact OH-N 2.9Å; F132-G136 WeakPolarHBondContact O-CA 3.43Å; F132-G136 PolarHBondContact O-N 3.01Å; I133-G136 PolarHBondContact O-N 3.05Å; A134-G136 VanDerWaalsContact C-N 3.34Å; A134-G136 PolarHBondContact O-N 3.19Å; G136-R139 WeakPolarHBondContact O-CB 3.35Å; G136-R139 PolarHBondContact O-N 2.97Å; G136-T140 WeakPolarHBondContact O-CG2 3.46Å; G136-T140 PolarHBondContact O-N 3.35Å; G136-T140 PolarHBondContact O-OG1 3.14Å
137	F	72	Confident	71.5	Confident	149 Å²	149	52.2 Å²	52.2	65%	0.654	30%	0.296	S	S	*	.	H	α-helix	trans	-64	-41.2	175.7	-89.8	-76.2	0	0	0	112.8	I133 A134 R139 T140 H141	I133-F137 HydrophobicContact CG2-CD2 3.75Å; I133-F137 HydrophobicContact CG2-CE2 3.83Å; I133-F137 VanDerWaalsContact O-CD2 3.28Å; I133-F137 WeakPolarHBondContact O-CD2 3.44Å; I133-F137 PolarHBondContact O-N 3.36Å; A134-F137 PolarHBondContact O-N 3.11Å; F137-R139 VanDerWaalsContact C-N 3.28Å; F137-R139 PolarHBondContact O-N 2.99Å; F137-T140 PolarHBondContact O-N 3.01Å; F137-T140 PolarHBondContact O-OG1 3.38Å; F137-H141 PolarHBondContact O-N 3.27Å; F137-H141 VanDerWaalsContact O-N 3.17Å
138	C	73	Confident	71.5	Confident	25 Å²	25	55 Å²	55	17%	0.169	30%	0.299	C	S	.	.	H	α-helix	trans	-64.8	-36	175.8	-51.9	0	0	0	0	110.6	C41 A134 H141 D142	C41-C138 HydrophobicContact CB-CB 4.06Å; C41-C138 WeakPolarHBondContact CB-SG 3.38Å; C41-C138 WeakPolarHBondContact SG-CB 3.06Å; C41-C138 CovalentContact SG-SG 2.07Å; C41-C138 PolarHBondContact SG-SG 3.4Å; A134-C138 PolarHBondContact O-N 3.38Å; A134-C138 VanDerWaalsContact O-N 3.07Å; A134-C138 PolarHBondContact O-SG 3.35Å; C138-H141 PolarHBondContact O-N 3.34Å; C138-D142 VanDerWaalsContact O-CG 3.24Å; C138-D142 PolarHBondContact O-N 3.15Å
139	R	72.5	Confident	71.3	Confident	37 Å²	37	58.8 Å²	58.8	14%	0.14	32%	0.318	C	S	.	.	H	α-helix	trans	-67.9	-42.3	175.7	-82	-177.6	-174.3	154.2	13.4	115	Q111 T135 G136 F137 H141 D142 I143	Q111-R139 VanDerWaalsContact CB-NH2 3.31Å; Q111-R139 PolarHBondContact O-NH2 3.02Å; T135-R139 WeakPolarHBondContact O-CB 3.46Å; T135-R139 WeakPolarHBondContact O-CG 3.3Å; T135-R139 PolarHBondContact O-N 2.94Å; G136-R139 WeakPolarHBondContact O-CB 3.35Å; G136-R139 PolarHBondContact O-N 2.97Å; F137-R139 VanDerWaalsContact C-N 3.28Å; F137-R139 PolarHBondContact O-N 2.99Å; R139-H141 PolarHBondContact O-N 3.1Å; R139-D142 PolarHBondContact O-N 3.12Å; R139-I143 WeakPolarHBondContact O-CB 3.2Å; R139-I143 VanDerWaalsContact O-CG1 3.28Å; R139-I143 WeakPolarHBondContact O-CG1 3.49Å; R139-I143 PolarHBondContact O-N 3.47Å
140	T	70.3	Confident	71	Confident	73 Å²	73	60 Å²	60	45%	0.448	32%	0.324	S	S	.	.	H	α-helix	trans	-63.5	-38.5	177.7	54.4	0	0	0	0	110	G136 F137 I143 L144	G136-T140 WeakPolarHBondContact O-CG2 3.46Å; G136-T140 PolarHBondContact O-N 3.35Å; G136-T140 PolarHBondContact O-OG1 3.14Å; F137-T140 PolarHBondContact O-N 3.01Å; F137-T140 PolarHBondContact O-OG1 3.38Å; T140-I143 PolarHBondContact O-N 3.46Å; T140-L144 VanDerWaalsContact O-CB 3.29Å; T140-L144 WeakPolarHBondContact O-CB 3.35Å; T140-L144 VanDerWaalsContact O-CG 3.25Å; T140-L144 WeakPolarHBondContact O-CG 3.43Å; T140-L144 PolarHBondContact O-N 3.44Å
141	H	71.2	Confident	70.6	Confident	82 Å²	82	63.8 Å²	63.8	38%	0.38	34%	0.344	S	S	.	.	H	α-helix	trans	-61.5	-46.3	171.8	179.3	-81	0	0	0	111.7	M1 F137 C138 R139 I143 L144 V145	M1-H141 PolarHBondContact N-NE2 3.38Å; F137-H141 PolarHBondContact O-N 3.27Å; F137-H141 VanDerWaalsContact O-N 3.17Å; C138-H141 PolarHBondContact O-N 3.34Å; R139-H141 PolarHBondContact O-N 3.1Å; H141-I143 PolarHBondContact O-N 2.95Å; H141-L144 PolarHBondContact O-N 3.2Å; H141-V145 VanDerWaalsContact O-CB 3.24Å; H141-V145 WeakPolarHBondContact O-CB 3.44Å; H141-V145 WeakPolarHBondContact O-CG2 3.43Å; H141-V145 PolarHBondContact O-N 2.59Å
142	D	71.1	Confident	70.2	Confident	35 Å²	35	68.5 Å²	68.5	19%	0.187	37%	0.371	C	S	.	.	H	α-helix	trans	-63.4	-42.9	178.3	-66.3	-26	0	0	0	111.4	F107 C138 R139 L144 T146	F107-D142 WeakPolarHBondContact CE1-OD2 3.44Å; C138-D142 VanDerWaalsContact O-CG 3.24Å; C138-D142 PolarHBondContact O-N 3.15Å; R139-D142 PolarHBondContact O-N 3.12Å; D142-L144 VanDerWaalsContact C-N 3.35Å; D142-L144 PolarHBondContact O-N 2.52Å; D142-T146 HydrophobicContact CB-CG2 4.47Å; D142-T146 WeakPolarHBondContact O-CB 3.38Å; D142-T146 WeakPolarHBondContact O-CG2 3.5Å; D142-T146 PolarHBondContact O-N 3.38Å; D142-T146 VanDerWaalsContact O-N 3.14Å; D142-T146 PolarHBondContact O-OG1 3.05Å
143	I	73.4	Confident	69.5	Low	100 Å²	100	69.8 Å²	69.8	51%	0.513	37%	0.374	S	S	.	.	H	α-helix	trans	-67.9	-32.5	178.4	-66.4	165.9	0	0	0	112.1	L108 R139 T140 H141 P147	L108-I143 HydrophobicContact CD2-CG1 4.29Å; R139-I143 WeakPolarHBondContact O-CB 3.2Å; R139-I143 VanDerWaalsContact O-CG1 3.28Å; R139-I143 WeakPolarHBondContact O-CG1 3.49Å; R139-I143 PolarHBondContact O-N 3.47Å; T140-I143 PolarHBondContact O-N 3.46Å; H141-I143 PolarHBondContact O-N 2.95Å; I143-P147 WeakPolarHBondContact O-CD 3.45Å; I143-P147 WeakPolarHBondContact O-CG 3.46Å
144	L	73	Confident	68.7	Low	120 Å²	120	70 Å²	70	63%	0.628	38%	0.376	S	S	*	.	H	α-helix	trans	-85.8	-44.1	-179.2	-72.4	172.1	0	0	0	113.3	T140 H141 D142 P147 L148	T140-L144 VanDerWaalsContact O-CB 3.29Å; T140-L144 WeakPolarHBondContact O-CB 3.35Å; T140-L144 VanDerWaalsContact O-CG 3.25Å; T140-L144 WeakPolarHBondContact O-CG 3.43Å; T140-L144 PolarHBondContact O-N 3.44Å; H141-L144 PolarHBondContact O-N 3.2Å; D142-L144 VanDerWaalsContact C-N 3.35Å; D142-L144 PolarHBondContact O-N 2.52Å; L144-P147 WeakPolarHBondContact O-CD 3.25Å; L144-L148 WeakPolarHBondContact O-CD1 3.43Å
145	V	71.4	Confident	68.1	Low	48 Å²	48	71.4 Å²	71.4	29%	0.291	38%	0.382	S	S	.	.	H	α-helix	trans	-80.2	-32	-173.7	176.3	0	0	0	0	111.4	H141 L148 L149	H141-V145 VanDerWaalsContact O-CB 3.24Å; H141-V145 WeakPolarHBondContact O-CB 3.44Å; H141-V145 WeakPolarHBondContact O-CG2 3.43Å; H141-V145 PolarHBondContact O-N 2.59Å; V145-L148 WeakPolarHBondContact O-CB 3.29Å; V145-L148 PolarHBondContact O-N 3.17Å; V145-L149 HydrophobicContact CG1-CD1 3.93Å; V145-L149 HydrophobicContact CG1-CG 4.19Å; V145-L149 PolarHBondContact O-N 3.43Å
146	T	68	Low	67.3	Low	19 Å²	19	74.8 Å²	74.8	12%	0.117	40%	0.4	C	S	.	.	H	α-helix	trans	-70.2	-37.9	-175.3	66.1	0	0	0	0	113.7	L104 D142 L148 L149 V150	L104-T146 HydrophobicContact CD1-CG2 3.31Å; L104-T146 HydrophobicContact CD2-CG2 3.62Å; L104-T146 WeakPolarHBondContact CD2-OG1 3.34Å; L104-T146 HydrophobicContact CG-CG2 4.01Å; D142-T146 HydrophobicContact CB-CG2 4.47Å; D142-T146 WeakPolarHBondContact O-CB 3.38Å; D142-T146 WeakPolarHBondContact O-CG2 3.5Å; D142-T146 PolarHBondContact O-N 3.38Å; D142-T146 VanDerWaalsContact O-N 3.14Å; D142-T146 PolarHBondContact O-OG1 3.05Å; T146-L148 VanDerWaalsContact C-N 3.32Å; T146-L148 PolarHBondContact O-N 3.3Å; T146-L149 PolarHBondContact O-N 2.88Å; T146-V150 WeakPolarHBondContact O-CB 3.35Å; T146-V150 WeakPolarHBondContact O-CG2 3.4Å; T146-V150 PolarHBondContact O-N 3.48Å
147	P	66	Low	66	Low	71 Å²	71	78.2 Å²	78.2	46%	0.461	42%	0.416	S	S	.	.	H	α-helix	trans	-66.7	-34.7	172.9	-19	34	0	0	0	111.9	I143 L144 V150 L151	I143-P147 WeakPolarHBondContact O-CD 3.45Å; I143-P147 WeakPolarHBondContact O-CG 3.46Å; L144-P147 WeakPolarHBondContact O-CD 3.25Å; P147-V150 PolarHBondContact O-N 3.44Å; P147-L151 VanDerWaalsContact O-CB 3.28Å; P147-L151 WeakPolarHBondContact O-CB 3.29Å; P147-L151 PolarHBondContact O-N 3.02Å
148	L	67.5	Low	65.1	Low	108 Å²	108	77.3 Å²	77.3	57%	0.565	42%	0.418	S	S	*	.	H	α-helix	trans	-63.6	-44.6	174.8	-89.4	155.8	0	0	0	111.7	L144 V145 T146 L151 N152	L144-L148 WeakPolarHBondContact O-CD1 3.43Å; V145-L148 WeakPolarHBondContact O-CB 3.29Å; V145-L148 PolarHBondContact O-N 3.17Å; T146-L148 VanDerWaalsContact C-N 3.32Å; T146-L148 PolarHBondContact O-N 3.3Å; L148-L151 PolarHBondContact O-N 2.93Å; L148-N152 PolarHBondContact O-N 2.94Å
149	L	63.2	Low	64.2	Low	88 Å²	88	82.2 Å²	82.2	46%	0.461	44%	0.441	S	S	.	.	H	α-helix	trans	-63.6	-48.9	171	-71	172	0	0	0	110.1	V145 T146 L151 N152 W153	V145-L149 HydrophobicContact CG1-CD1 3.93Å; V145-L149 HydrophobicContact CG1-CG 4.19Å; V145-L149 PolarHBondContact O-N 3.43Å; T146-L149 PolarHBondContact O-N 2.88Å; L149-L151 PolarHBondContact O-N 3.2Å; L149-L151 VanDerWaalsContact O-N 3.16Å; L149-N152 PolarHBondContact O-N 3.41Å; L149-N152 VanDerWaalsContact O-N 3.1Å; L149-W153 PolarHBondContact O-N 2.91Å
150	V	63.9	Low	63.3	Low	48 Å²	48	82 Å²	82	29%	0.291	45%	0.445	S	S	.	.	H	α-helix	trans	-56.4	-38.1	179.2	167.8	0	0	0	0	112.2	R101 T146 P147 W153 L154	R101-V150 HydrophobicContact CG-CG2 4.21Å; R101-V150 PolarHBondContact NH2-O 3.24Å; T146-V150 WeakPolarHBondContact O-CB 3.35Å; T146-V150 WeakPolarHBondContact O-CG2 3.4Å; T146-V150 PolarHBondContact O-N 3.48Å; P147-V150 PolarHBondContact O-N 3.44Å; V150-W153 CarbonylContact O-C 3.43Å; V150-W153 PolarHBondContact O-N 3.07Å; V150-L154 WeakPolarHBondContact O-CD1 3.44Å; V150-L154 PolarHBondContact O-N 2.99Å
151	L	64.3	Low	62.6	Low	113 Å²	113	82 Å²	82	59%	0.592	44%	0.442	S	S	*	.	H	α-helix	trans	-68.2	-43.7	177.4	-170.9	64	0	0	0	112.1	P147 L148 L149 W153 L154	P147-L151 VanDerWaalsContact O-CB 3.28Å; P147-L151 WeakPolarHBondContact O-CB 3.29Å; P147-L151 PolarHBondContact O-N 3.02Å; L148-L151 PolarHBondContact O-N 2.93Å; L149-L151 PolarHBondContact O-N 3.2Å; L149-L151 VanDerWaalsContact O-N 3.16Å; L151-W153 PolarHBondContact O-N 2.07Å; L151-L154 HydrophobicContact CD1-CD1 4.34Å; L151-L154 PolarHBondContact O-N 3.45Å; L151-L154 VanDerWaalsContact O-N 3.07Å
152	N	64	Low	61.8	Low	126 Å²	126	81.9 Å²	81.9	67%	0.674	45%	0.448	S	S	*	.	H	α-helix	trans	-65	-18	174.1	-74.4	-17.1	0	0	0	113.1	L148 L149	L148-N152 PolarHBondContact O-N 2.94Å; L149-N152 PolarHBondContact O-N 3.41Å; L149-N152 VanDerWaalsContact O-N 3.1Å
153	W	60	Low	61.2	Low	72 Å²	72	85.3 Å²	85.3	27%	0.273	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	14	177.1	-68.2	62.8	0	0	0	112.3	L78 H81 R97 L149 V150 L151	L78-W153 HydrophobicContact CD2-CH2 3.98Å; L78-W153 HydrophobicContact CD2-CZ2 3.68Å; H81-W153 HydrophobicContact CB-CH2 4.45Å; H81-W153 HydrophobicContact CB-CZ3 4.32Å; H81-W153 AromaticContact CD2-CZ3 3.58Å; H81-W153 AromaticContact CE1-CZ3 3.59Å; H81-W153 AromaticContact CG-CZ3 3.59Å; H81-W153 AromaticContact ND1-CH2 3.96Å; H81-W153 AromaticContact ND1-CZ3 3.59Å; H81-W153 AromaticContact NE2-CZ3 3.6Å; R97-W153 PolarHBondContact NH1-O 2.91Å; L149-W153 PolarHBondContact O-N 2.91Å; V150-W153 CarbonylContact O-C 3.43Å; V150-W153 PolarHBondContact O-N 3.07Å; L151-W153 PolarHBondContact O-N 2.07Å
154	L	59.5	Low	60.5	Low	89 Å²	89	85.7 Å²	85.7	47%	0.466	46%	0.463	S	S	.	.	S	Bend	trans	-62.2	149.7	162.2	-104.2	75.6	0	0	0	109.2	R97 V150 L151 D156	R97-L154 PolarHBondContact NH1-O 3.1Å; V150-L154 WeakPolarHBondContact O-CD1 3.44Å; V150-L154 PolarHBondContact O-N 2.99Å; L151-L154 HydrophobicContact CD1-CD1 4.34Å; L151-L154 PolarHBondContact O-N 3.45Å; L151-L154 VanDerWaalsContact O-N 3.07Å; L154-D156 PolarHBondContact O-N 3.47Å; L154-D156 VanDerWaalsContact O-N 3.13Å
155	P	57.8	Low	59.6	Low	66 Å²	66	88 Å²	88	43%	0.429	46%	0.464	S	S	.	.			trans	-54.6	125.2	171.1	-19.5	30.8	0	0	0	107.2	Y93 T157	Y93-P155 HydrophobicContact CE1-CG 4.17Å; Y93-P155 WeakPolarHBondContact OH-CA 2.96Å; Y93-P155 VanDerWaalsContact OH-CB 3.28Å; Y93-P155 WeakPolarHBondContact OH-CB 3.46Å; P155-T157 PolarHBondContact O-N 3.35Å
156	D	55.6	Low	58.9	Low	79 Å²	79	91.6 Å²	91.6	42%	0.422	48%	0.477	S	S	.	.			trans	-47.5	103.6	152.3	-97.2	-24.8	0	0	0	104.5	L154 D158 S160 K164	L154-D156 PolarHBondContact O-N 3.47Å; L154-D156 VanDerWaalsContact O-N 3.13Å; D156-D158 PolarHBondContact O-N 3.15Å; D156-S160 WeakPolarHBondContact CB-OG 3.3Å; D156-S160 PolarHBondContact OD1-OG 3.43Å; D156-K164 IonicContact OD1-NZ 2.8Å; D156-K164 IonicContact OD2-NZ 3.59Å; D156-K164 PolarHBondContact OD2-NZ 2.9Å
157	T	48.5	Very low	58.5	Low	95 Å²	95	95 Å²	95	58%	0.583	49%	0.494	S	S	*	.			trans	-53.2	145.4	177.4	48	0	0	0	0	106.9	P155 I159 S160	P155-T157 PolarHBondContact O-N 3.35Å; T157-I159 PolarHBondContact O-N 2.84Å; T157-S160 PolarHBondContact O-N 3.28Å
158	D	52.2	Low	57.8	Low	130 Å²	130	98.3 Å²	98.3	70%	0.695	50%	0.501	S	S	*	.	H	α-helix	trans	-49.6	-20	-169.9	-64.2	-49.8	0	0	0	114.5	D156 L161 T162	D156-D158 PolarHBondContact O-N 3.15Å; D158-L161 PolarHBondContact O-N 3.49Å; D158-T162 PolarHBondContact O-N 3.12Å; D158-T162 PolarHBondContact O-OG1 3.21Å
159	I	55.2	Low	57.1	Low	127 Å²	127	99.2 Å²	99.2	65%	0.651	50%	0.503	S	S	*	.	H	α-helix	trans	-62	-38.5	172.7	-57.1	168.2	0	0	0	113.6	T157 T162 L163	T157-I159 PolarHBondContact O-N 2.84Å; I159-T162 PolarHBondContact O-OG1 3.49Å; I159-L163 WeakPolarHBondContact O-CB 3.43Å; I159-L163 PolarHBondContact O-N 3.47Å
160	S	54.1	Low	56.7	Low	32 Å²	32	104.2 Å²	104.2	22%	0.224	52%	0.517	C	S	.	.	H	α-helix	trans	-78.8	-25.9	-179.7	92.2	0	0	0	0	112.1	D156 T157 K164	D156-S160 WeakPolarHBondContact CB-OG 3.3Å; D156-S160 PolarHBondContact OD1-OG 3.43Å; T157-S160 PolarHBondContact O-N 3.28Å; S160-K164 VanDerWaalsContact O-CB 3.25Å; S160-K164 WeakPolarHBondContact O-CB 3.43Å; S160-K164 VanDerWaalsContact O-CG 3.22Å; S160-K164 WeakPolarHBondContact O-CG 3.01Å; S160-K164 PolarHBondContact O-N 3.44Å
161	L	55.5	Low	56.3	Low	74 Å²	74	107.2 Å²	107.2	39%	0.387	53%	0.531	S	S	.	.	H	α-helix	trans	-74.3	-38.2	175.8	-83.8	164.1	0	0	0	112.7	D158 R165	D158-L161 PolarHBondContact O-N 3.49Å; L161-R165 WeakPolarHBondContact O-CB 3.43Å; L161-R165 WeakPolarHBondContact O-CG 3.46Å; L161-R165 PolarHBondContact O-N 2.95Å
162	T	55	Low	55.5	Low	80 Å²	80	110.6 Å²	110.6	49%	0.491	54%	0.536	S	S	.	.	H	α-helix	trans	-64.3	-47.7	172.5	47.7	0	0	0	0	110.3	D158 I159 K164 R165 E166	D158-T162 PolarHBondContact O-N 3.12Å; D158-T162 PolarHBondContact O-OG1 3.21Å; I159-T162 PolarHBondContact O-OG1 3.49Å; T162-K164 PolarHBondContact O-N 3.33Å; T162-R165 PolarHBondContact O-N 3.45Å; T162-R165 VanDerWaalsContact O-N 3.15Å; T162-E166 WeakPolarHBondContact O-CG 3.38Å; T162-E166 PolarHBondContact O-N 3.46Å
163	L	58.3	Low	54.8	Low	107 Å²	107	114.6 Å²	114.6	56%	0.56	54%	0.543	S	S	*	.	H	α-helix	trans	-65.7	-38.1	-179.8	-152.1	147	0	0	0	112.7	I159 L167	I159-L163 WeakPolarHBondContact O-CB 3.43Å; I159-L163 PolarHBondContact O-N 3.47Å; L163-L167 HydrophobicContact CD2-CD1 3.67Å; L163-L167 WeakPolarHBondContact O-CB 3.43Å; L163-L167 PolarHBondContact O-N 2.9Å
164	K	57.7	Low	54.1	Low	107 Å²	107	119.4 Å²	119.4	47%	0.465	57%	0.568	S	S	.	*	H	α-helix	trans	-67.4	-31.9	172.8	-79.9	173.6	-175.6	171.8	0	113.4	D156 S160 T162 K168	D156-K164 IonicContact OD1-NZ 2.8Å; D156-K164 IonicContact OD2-NZ 3.59Å; D156-K164 PolarHBondContact OD2-NZ 2.9Å; S160-K164 VanDerWaalsContact O-CB 3.25Å; S160-K164 WeakPolarHBondContact O-CB 3.43Å; S160-K164 VanDerWaalsContact O-CG 3.22Å; S160-K164 WeakPolarHBondContact O-CG 3.01Å; S160-K164 PolarHBondContact O-N 3.44Å; T162-K164 PolarHBondContact O-N 3.33Å; K164-K168 WeakPolarHBondContact O-CB 3.41Å; K164-K168 WeakPolarHBondContact O-CG 3.14Å; K164-K168 PolarHBondContact O-N 3.3Å; K164-K168 VanDerWaalsContact O-N 3.11Å
165	R	55.1	Low	53.7	Low	170 Å²	170	121.6 Å²	121.6	64%	0.642	59%	0.589	S	S	*	*	H	α-helix	trans	-70.4	-46.1	176	-82.6	178.8	-176.1	155.4	3.1	110.7	L161 T162 K168 E169	L161-R165 WeakPolarHBondContact O-CB 3.43Å; L161-R165 WeakPolarHBondContact O-CG 3.46Å; L161-R165 PolarHBondContact O-N 2.95Å; T162-R165 PolarHBondContact O-N 3.45Å; T162-R165 VanDerWaalsContact O-N 3.15Å; R165-K168 PolarHBondContact O-N 3.38Å; R165-E169 PolarHBondContact O-N 2.9Å; R165-E169 VanDerWaalsContact O-N 3.09Å
166	E	55.3	Low	53.4	Low	122 Å²	122	121 Å²	121	57%	0.57	60%	0.596	S	S	*	*	H	α-helix	trans	-60.6	-48.7	176.7	-59.3	-137.1	159.6	0	0	110.7	T162 K168 E169 Y170	T162-E166 WeakPolarHBondContact O-CG 3.38Å; T162-E166 PolarHBondContact O-N 3.46Å; E166-K168 VanDerWaalsContact C-N 3.3Å; E166-K168 PolarHBondContact O-N 2.98Å; E166-E169 PolarHBondContact O-N 3.47Å; E166-Y170 WeakPolarHBondContact O-CD2 3.33Å; E166-Y170 PolarHBondContact O-N 2.84Å; E166-Y170 VanDerWaalsContact O-N 3.11Å
167	L	59.5	Low	52.8	Low	92 Å²	92	126.7 Å²	126.7	48%	0.482	62%	0.617	S	S	.	*	H	α-helix	trans	-58.1	-38.1	175.8	-109.6	134.5	0	0	0	113.3	L163 E169 Y170 L171	L163-L167 HydrophobicContact CD2-CD1 3.67Å; L163-L167 WeakPolarHBondContact O-CB 3.43Å; L163-L167 PolarHBondContact O-N 2.9Å; L167-E169 VanDerWaalsContact C-N 3.31Å; L167-E169 PolarHBondContact O-N 3.48Å; L167-Y170 PolarHBondContact O-N 3.47Å; L167-L171 HydrophobicContact CD2-CD1 3.74Å; L167-L171 WeakPolarHBondContact O-CB 3.45Å; L167-L171 WeakPolarHBondContact O-CD1 3.28Å; L167-L171 WeakPolarHBondContact O-CG 3.35Å; L167-L171 PolarHBondContact O-N 3.48Å
168	K	52.2	Low	53	Low	140 Å²	140	128.6 Å²	128.6	61%	0.609	62%	0.619	S	S	*	*	H	α-helix	trans	-72.8	-19.3	177.6	-90.1	-176	176.4	-179.5	0	114.2	K164 R165 E166 R172	K164-K168 WeakPolarHBondContact O-CB 3.41Å; K164-K168 WeakPolarHBondContact O-CG 3.14Å; K164-K168 PolarHBondContact O-N 3.3Å; K164-K168 VanDerWaalsContact O-N 3.11Å; R165-K168 PolarHBondContact O-N 3.38Å; E166-K168 VanDerWaalsContact C-N 3.3Å; E166-K168 PolarHBondContact O-N 2.98Å; K168-R172 WeakPolarHBondContact O-CB 3.31Å; K168-R172 PolarHBondContact O-NE 3.25Å
169	E	52.6	Low	52.9	Low	127 Å²	127	132.3 Å²	132.3	59%	0.593	62%	0.623	S	S	*	*	H	α-helix	trans	-82.5	-34.8	172.3	-72.8	177.4	176.6	0	0	110.4	R165 E166 L167	R165-E169 PolarHBondContact O-N 2.9Å; R165-E169 VanDerWaalsContact O-N 3.09Å; E166-E169 PolarHBondContact O-N 3.47Å; L167-E169 VanDerWaalsContact C-N 3.31Å; L167-E169 PolarHBondContact O-N 3.48Å
170	Y	54.3	Low	52.7	Low	192 Å²	192	136.6 Å²	136.6	75%	0.753	63%	0.633	S	S	*	*	H	α-helix	trans	-72.1	-33.8	171.2	-72.9	-73.6	0	0	0	113.9	E166 L167 R172	E166-Y170 WeakPolarHBondContact O-CD2 3.33Å; E166-Y170 PolarHBondContact O-N 2.84Å; E166-Y170 VanDerWaalsContact O-N 3.11Å; L167-Y170 PolarHBondContact O-N 3.47Å; Y170-R172 VanDerWaalsContact C-N 3.35Å
171	L	56.5	Low	52.6	Low	112 Å²	112	141.3 Å²	141.3	59%	0.586	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-81.8	-5.1	178	-80.5	152.9	0	0	0	114.2	L167 Y173	L167-L171 HydrophobicContact CD2-CD1 3.74Å; L167-L171 WeakPolarHBondContact O-CB 3.45Å; L167-L171 WeakPolarHBondContact O-CD1 3.28Å; L167-L171 WeakPolarHBondContact O-CG 3.35Å; L167-L171 PolarHBondContact O-N 3.48Å; L171-Y173 PolarHBondContact O-N 2.97Å
172	R	47.5	Very low	52.5	Low	183 Å²	183	144.8 Å²	144.8	69%	0.691	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-80.1	3.5	-174.5	-138.3	175.2	-85.2	-161.2	0.1	114.4	K168 Y170	K168-R172 WeakPolarHBondContact O-CB 3.31Å; K168-R172 PolarHBondContact O-NE 3.25Å; Y170-R172 VanDerWaalsContact C-N 3.35Å
173	Y	47.9	Very low	52.6	Low	210 Å²	210	148.2 Å²	148.2	82%	0.824	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-107.1	1.4	178.7	-69.9	-79.9	0	0	0	114.6	L171	L171-Y173 PolarHBondContact O-N 2.97Å
174	E	46.9	Very low	52.7	Low	174 Å²	174	153.1 Å²	153.1	81%	0.813	69%	0.693	S	S	*	*			trans	-102.7	68	172.9	-66.8	-151.8	165.8	0	0	112.4	G176	E174-G176 PolarHBondContact O-N 3.41Å; E174-G176 VanDerWaalsContact O-N 3.12Å
175	C	51.2	Low	52.9	Low	134 Å²	134	155.8 Å²	155.8	91%	0.905	71%	0.712	S	S	*	*			trans	-77.5	75.2	151.7	-79.2	0	0	0	0	108.2
176	G	50.9	Low	52.6	Low	55 Å²	55	153.6 Å²	153.6	57%	0.567	72%	0.72	S	S	*	*			trans	-105.6	128.5	170.2	0	0	0	0	0	109.9	E174 E178	E174-G176 PolarHBondContact O-N 3.41Å; E174-G176 VanDerWaalsContact O-N 3.12Å; G176-E178 PolarHBondContact O-N 3Å
177	F	42.9	Very low	53.1	Low	198 Å²	198	154.1 Å²	154.1	87%	0.868	72%	0.72	S	S	*	*			trans	-58.6	96.8	175.3	-79.1	-96.7	0	0	0	111.2	R179	F177-R179 VanDerWaalsContact C-N 3.3Å; F177-R179 PolarHBondContact O-N 3.44Å
178	E	52.6	Low	53.9	Low	135 Å²	135	152.4 Å²	152.4	63%	0.631	72%	0.716	S	S	*	*			trans	-74.1	87.2	164	-74	-167.7	-115.5	0	0	109.2	G176 Y180 K181	G176-E178 PolarHBondContact O-N 3Å; E178-Y180 PolarHBondContact O-N 3.41Å; E178-K181 HydrophobicContact CB-CG 4.36Å; E178-K181 WeakPolarHBondContact OE1-CE 3.47Å; E178-K181 IonicContact OE1-NZ 3.92Å; E178-K181 PolarHBondContact OE1-NZ 3.38Å; E178-K181 WeakPolarHBondContact OE2-CE 3.31Å; E178-K181 WeakPolarHBondContact OE2-CG 3.27Å; E178-K181 IonicContact OE2-NZ 2.76Å
179	R	50.1	Low	55.1	Low	207 Å²	207	151.1 Å²	151.1	78%	0.781	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	116.7	164.5	-60.9	-170.8	-166.1	-164.3	4.6	107	F177	F177-R179 VanDerWaalsContact C-N 3.3Å; F177-R179 PolarHBondContact O-N 3.44Å
180	Y	51.8	Low	56.2	Low	217 Å²	217	151.1 Å²	151.1	85%	0.851	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	75.3	66.4	176.8	-45.2	-78.9	0	0	0	116.5	E178 I182	E178-Y180 PolarHBondContact O-N 3.41Å; Y180-I182 PolarHBondContact O-N 3.05Å
181	K	50.3	Low	57	Low	131 Å²	131	148.9 Å²	148.9	57%	0.57	71%	0.714	S	S	*	*			trans	-68.7	115.4	153.8	-83.8	-170.6	-178.7	175.3	0	109.4	E178 N183	E178-K181 HydrophobicContact CB-CG 4.36Å; E178-K181 WeakPolarHBondContact OE1-CE 3.47Å; E178-K181 IonicContact OE1-NZ 3.92Å; E178-K181 PolarHBondContact OE1-NZ 3.38Å; E178-K181 WeakPolarHBondContact OE2-CE 3.31Å; E178-K181 WeakPolarHBondContact OE2-CG 3.27Å; E178-K181 IonicContact OE2-NZ 2.76Å; K181-N183 VanDerWaalsContact C-N 3.32Å; K181-N183 PolarHBondContact O-N 2.98Å
182	I	53.8	Low	57.8	Low	147 Å²	147	148.3 Å²	148.3	75%	0.754	71%	0.707	S	S	*	*			trans	-63.1	98.4	160.8	-57.1	167.7	0	0	0	105.8	Y180 R184	Y180-I182 PolarHBondContact O-N 3.05Å; I182-R184 HydrophobicContact CG2-CB 4.25Å; I182-R184 WeakPolarHBondContact CG2-O 3.46Å; I182-R184 PolarHBondContact O-N 3.21Å
183	N	57.7	Low	59.2	Low	152 Å²	152	144.1 Å²	144.1	81%	0.813	70%	0.698	S	S	*	*			trans	-67.4	17.6	178.1	-84.7	-0.1	0	0	0	113.8	K181	K181-N183 VanDerWaalsContact C-N 3.32Å; K181-N183 PolarHBondContact O-N 2.98Å
184	R	59.5	Low	60.4	Low	210 Å²	210	139.9 Å²	139.9	79%	0.792	69%	0.689	S	S	*	*	S	Bend	trans	-129.5	118	-176.3	-54.7	-173.4	-169.1	-136.5	3.5	107.5	I182	I182-R184 HydrophobicContact CG2-CB 4.25Å; I182-R184 WeakPolarHBondContact CG2-O 3.46Å; I182-R184 PolarHBondContact O-N 3.21Å
185	L	62.2	Low	61.6	Low	164 Å²	164	134.9 Å²	134.9	86%	0.859	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-56.5	145.1	160.6	-101.1	82	0	0	0	108.2	F187	L185-F187 PolarHBondContact O-N 3.49Å; L185-F187 VanDerWaalsContact O-N 3.14Å
186	P	50	Low	62.9	Low	124 Å²	124	132.2 Å²	132.2	81%	0.805	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-55.9	124	172.7	24.5	-32.6	0	0	0	108.7
187	F	64	Low	64	Low	132 Å²	132	131.3 Å²	131.3	58%	0.579	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-75.4	125.3	-177.7	-179.6	-107.9	0	0	0	109.9	L185 L189 F192	L185-F187 PolarHBondContact O-N 3.49Å; L185-F187 VanDerWaalsContact O-N 3.14Å; F187-L189 HydrophobicContact CD1-CD2 3.93Å; F187-L189 HydrophobicContact CE1-CD2 3.9Å; F187-L189 PolarHBondContact O-N 3.15Å; F187-F192 HydrophobicContact CE1-CB 3.5Å; F187-F192 VanDerWaalsContact CE1-CB 3.5Å; F187-F192 HydrophobicContact CE1-CD1 4.04Å; F187-F192 HydrophobicContact CE1-CD2 4.29Å; F187-F192 AromaticContact CE1-CG 3.71Å; F187-F192 HydrophobicContact CE1-CG 3.71Å; F187-F192 HydrophobicContact CE2-CB 4.07Å; F187-F192 HydrophobicContact CE2-CD2 4.31Å; F187-F192 HydrophobicContact CE2-CG 4.38Å; F187-F192 HydrophobicContact CZ-CB 3.19Å; F187-F192 HydrophobicContact CZ-CD1 4.02Å; F187-F192 AromaticContact CZ-CD2 3.46Å; F187-F192 HydrophobicContact CZ-CD2 3.46Å; F187-F192 VanDerWaalsContact CZ-CD2 3.46Å; F187-F192 HydrophobicContact CZ-CE2 4.23Å; F187-F192 AromaticContact CZ-CG 3.29Å; F187-F192 HydrophobicContact CZ-CG 3.29Å
188	S	76.3	Confident	65.5	Low	56 Å²	56	126.6 Å²	126.6	39%	0.392	61%	0.612	S	S	.	*			trans	-85.1	109.2	172.2	43.9	0	0	0	0	109.5	N190 F191 F192	S188-N190 PolarHBondContact O-N 3.12Å; S188-N190 VanDerWaalsContact O-N 3.15Å; S188-F191 PolarHBondContact O-N 2.81Å; S188-F191 VanDerWaalsContact O-N 3.12Å; S188-F191 WeakPolarHBondContact OG-CD2 3.4Å; S188-F192 PolarHBondContact O-N 2.84Å
189	L	77.4	Confident	66.6	Low	113 Å²	113	123.4 Å²	123.4	59%	0.592	60%	0.601	S	S	*	*	H	α-helix	trans	-54.1	-33.8	177.8	-68	173.5	0	0	0	112.3	F187 F191 F192 L193	F187-L189 HydrophobicContact CD1-CD2 3.93Å; F187-L189 HydrophobicContact CE1-CD2 3.9Å; F187-L189 PolarHBondContact O-N 3.15Å; L189-F191 VanDerWaalsContact C-N 3.33Å; L189-F191 PolarHBondContact O-N 3.18Å; L189-F192 WeakPolarHBondContact O-CB 3.08Å; L189-F192 PolarHBondContact O-N 3.14Å; L189-F192 VanDerWaalsContact O-N 3.14Å; L189-L193 WeakPolarHBondContact O-CG 3.45Å; L189-L193 PolarHBondContact O-N 3.02Å
190	N	76.2	Confident	67.8	Low	128 Å²	128	117.8 Å²	117.8	68%	0.684	59%	0.586	S	S	*	*	H	α-helix	trans	-59.9	-40	179.4	-59.8	0.9	0	0	0	112.9	S188 F192 L194	S188-N190 PolarHBondContact O-N 3.12Å; S188-N190 VanDerWaalsContact O-N 3.15Å; N190-F192 VanDerWaalsContact C-N 3.33Å; N190-L194 PolarHBondContact O-N 3.48Å
191	F	71.4	Confident	68.8	Low	145 Å²	145	110.9 Å²	110.9	64%	0.636	56%	0.561	S	S	*	*	H	α-helix	trans	-74.3	-28.3	179.3	-73.4	-92	0	0	0	112.1	S188 L189 S195	S188-F191 PolarHBondContact O-N 2.81Å; S188-F191 VanDerWaalsContact O-N 3.12Å; S188-F191 WeakPolarHBondContact OG-CD2 3.4Å; L189-F191 VanDerWaalsContact C-N 3.33Å; L189-F191 PolarHBondContact O-N 3.18Å; F191-S195 PolarHBondContact O-N 3.49Å; F191-S195 PolarHBondContact O-OG 3.05Å
192	F	73.7	Confident	69.9	Low	99 Å²	99	107 Å²	107	43%	0.434	55%	0.546	S	S	.	.	H	α-helix	trans	-71.5	-45.8	174.8	-178.4	-120.1	0	0	0	112.6	F187 S188 L189 N190 L194 S195 I196	F187-F192 HydrophobicContact CE1-CB 3.5Å; F187-F192 VanDerWaalsContact CE1-CB 3.5Å; F187-F192 HydrophobicContact CE1-CD1 4.04Å; F187-F192 HydrophobicContact CE1-CD2 4.29Å; F187-F192 AromaticContact CE1-CG 3.71Å; F187-F192 HydrophobicContact CE1-CG 3.71Å; F187-F192 HydrophobicContact CE2-CB 4.07Å; F187-F192 HydrophobicContact CE2-CD2 4.31Å; F187-F192 HydrophobicContact CE2-CG 4.38Å; F187-F192 HydrophobicContact CZ-CB 3.19Å; F187-F192 HydrophobicContact CZ-CD1 4.02Å; F187-F192 AromaticContact CZ-CD2 3.46Å; F187-F192 HydrophobicContact CZ-CD2 3.46Å; F187-F192 VanDerWaalsContact CZ-CD2 3.46Å; F187-F192 HydrophobicContact CZ-CE2 4.23Å; F187-F192 AromaticContact CZ-CG 3.29Å; F187-F192 HydrophobicContact CZ-CG 3.29Å; S188-F192 PolarHBondContact O-N 2.84Å; L189-F192 WeakPolarHBondContact O-CB 3.08Å; L189-F192 PolarHBondContact O-N 3.14Å; L189-F192 VanDerWaalsContact O-N 3.14Å; N190-F192 VanDerWaalsContact C-N 3.33Å; F192-L194 VanDerWaalsContact C-N 3.35Å; F192-L194 PolarHBondContact O-N 3.26Å; F192-S195 WeakPolarHBondContact O-CB 3.28Å; F192-S195 PolarHBondContact O-N 3.42Å; F192-S195 VanDerWaalsContact O-N 3.12Å; F192-I196 HydrophobicContact CD1-CD1 3.72Å; F192-I196 HydrophobicContact CD2-CD1 4.3Å; F192-I196 HydrophobicContact CE1-CD1 3.3Å; F192-I196 HydrophobicContact CE1-CG1 4.47Å; F192-I196 HydrophobicContact CE2-CD1 3.95Å; F192-I196 HydrophobicContact CE2-CG1 4.37Å; F192-I196 HydrophobicContact CG-CD1 4.23Å; F192-I196 HydrophobicContact CZ-CD1 3.45Å; F192-I196 VanDerWaalsContact CZ-CD1 3.45Å; F192-I196 HydrophobicContact CZ-CG1 4.31Å; F192-I196 PolarHBondContact O-N 3.12Å
193	L	75.7	Confident	70.8	Confident	96 Å²	96	103.6 Å²	103.6	50%	0.503	53%	0.532	S	S	.	.	H	α-helix	trans	-58.6	-49	176.5	-71.4	171.1	0	0	0	110	L189 S195 I196 T197	L189-L193 WeakPolarHBondContact O-CG 3.45Å; L189-L193 PolarHBondContact O-N 3.02Å; L193-S195 PolarHBondContact O-N 3.42Å; L193-S195 VanDerWaalsContact O-N 3.15Å; L193-I196 PolarHBondContact O-N 3.35Å; L193-T197 PolarHBondContact O-N 2.94Å; L193-T197 PolarHBondContact O-OG1 3.05Å
194	L	73.3	Confident	71.4	Confident	121 Å²	121	97.4 Å²	97.4	63%	0.634	50%	0.498	S	S	*	.	H	α-helix	trans	-53.7	-39.4	175.5	-174.1	69.4	0	0	0	113.1	N190 F192 F198	N190-L194 PolarHBondContact O-N 3.48Å; F192-L194 VanDerWaalsContact C-N 3.35Å; F192-L194 PolarHBondContact O-N 3.26Å; L194-F198 WeakPolarHBondContact O-CB 3.45Å; L194-F198 PolarHBondContact O-N 3.29Å
195	S	73.1	Confident	72	Confident	69 Å²	69	90.8 Å²	90.8	48%	0.483	48%	0.478	S	S	.	.	H	α-helix	trans	-69.7	-40	178.7	-56.1	0	0	0	0	112.1	F191 F192 L193 V199	F191-S195 PolarHBondContact O-N 3.49Å; F191-S195 PolarHBondContact O-OG 3.05Å; F192-S195 WeakPolarHBondContact O-CB 3.28Å; F192-S195 PolarHBondContact O-N 3.42Å; F192-S195 VanDerWaalsContact O-N 3.12Å; L193-S195 PolarHBondContact O-N 3.42Å; L193-S195 VanDerWaalsContact O-N 3.15Å; S195-V199 WeakPolarHBondContact O-CG2 3.33Å; S195-V199 PolarHBondContact O-N 3.05Å; S195-V199 VanDerWaalsContact O-N 3.16Å
196	I	78.7	Confident	72.5	Confident	78 Å²	78	87.4 Å²	87.4	40%	0.4	46%	0.46	S	S	.	.	H	α-helix	trans	-66.1	-45.1	175.1	-69.2	168.8	0	0	0	110.2	F192 L193 F198 V199 L200	F192-I196 HydrophobicContact CD1-CD1 3.72Å; F192-I196 HydrophobicContact CD2-CD1 4.3Å; F192-I196 HydrophobicContact CE1-CD1 3.3Å; F192-I196 HydrophobicContact CE1-CG1 4.47Å; F192-I196 HydrophobicContact CE2-CD1 3.95Å; F192-I196 HydrophobicContact CE2-CG1 4.37Å; F192-I196 HydrophobicContact CG-CD1 4.23Å; F192-I196 HydrophobicContact CZ-CD1 3.45Å; F192-I196 VanDerWaalsContact CZ-CD1 3.45Å; F192-I196 HydrophobicContact CZ-CG1 4.31Å; F192-I196 PolarHBondContact O-N 3.12Å; L193-I196 PolarHBondContact O-N 3.35Å; I196-F198 VanDerWaalsContact C-N 3.29Å; I196-F198 PolarHBondContact O-N 2.94Å; I196-V199 PolarHBondContact O-N 3.49Å; I196-L200 WeakPolarHBondContact O-CB 3.34Å; I196-L200 PolarHBondContact O-N 2.9Å
197	T	72.8	Confident	73.3	Confident	35 Å²	35	85.9 Å²	85.9	22%	0.215	44%	0.444	C	S	.	.	H	α-helix	trans	-58.9	-43.4	178.9	-40.8	0	0	0	0	110.9	L193 V199 L200 F201 L237	L193-T197 PolarHBondContact O-N 2.94Å; L193-T197 PolarHBondContact O-OG1 3.05Å; T197-V199 PolarHBondContact O-N 3.31Å; T197-L200 PolarHBondContact O-N 3.41Å; T197-F201 HydrophobicContact CG2-CD2 3.82Å; T197-F201 HydrophobicContact CG2-CE2 3.43Å; T197-F201 VanDerWaalsContact CG2-CE2 3.43Å; T197-F201 HydrophobicContact CG2-CZ 4.29Å; T197-F201 WeakPolarHBondContact O-CD2 3.27Å; T197-F201 PolarHBondContact O-N 3.14Å; T197-L237 HydrophobicContact CG2-CD2 3.33Å
198	F	74.4	Confident	73.5	Confident	100 Å²	100	81.7 Å²	81.7	44%	0.439	43%	0.427	S	S	.	.	H	α-helix	trans	-60.4	-45.4	176.1	-175.7	-96.4	0	0	0	112.4	L2 L194 I196 L200 F201 D202	L2-F198 HydrophobicContact CD1-CD1 3.71Å; L2-F198 HydrophobicContact CD1-CE1 3.32Å; L2-F198 HydrophobicContact CD1-CZ 4.38Å; L194-F198 WeakPolarHBondContact O-CB 3.45Å; L194-F198 PolarHBondContact O-N 3.29Å; I196-F198 VanDerWaalsContact C-N 3.29Å; I196-F198 PolarHBondContact O-N 2.94Å; F198-L200 VanDerWaalsContact C-N 3.29Å; F198-L200 PolarHBondContact O-N 3.5Å; F198-F201 PolarHBondContact O-N 3.37Å; F198-D202 WeakPolarHBondContact CE1-OD2 3.49Å; F198-D202 WeakPolarHBondContact CZ-OD2 3.44Å; F198-D202 WeakPolarHBondContact O-CB 3.19Å; F198-D202 PolarHBondContact O-N 2.76Å
199	V	75.4	Confident	73	Confident	68 Å²	68	80.5 Å²	80.5	41%	0.412	42%	0.416	S	S	.	.	H	α-helix	trans	-62.4	-38.4	175.9	171.7	0	0	0	0	111.5	S195 I196 T197 D202 V203	S195-V199 WeakPolarHBondContact O-CG2 3.33Å; S195-V199 PolarHBondContact O-N 3.05Å; S195-V199 VanDerWaalsContact O-N 3.16Å; I196-V199 PolarHBondContact O-N 3.49Å; T197-V199 PolarHBondContact O-N 3.31Å; V199-D202 PolarHBondContact O-N 2.84Å; V199-V203 VanDerWaalsContact O-CG2 3.27Å; V199-V203 WeakPolarHBondContact O-CG2 3.11Å; V199-V203 PolarHBondContact O-N 3.37Å
200	L	76.2	Confident	72.5	Confident	89 Å²	89	77.1 Å²	77.1	47%	0.466	41%	0.405	S	S	.	.	H	α-helix	trans	-66.9	-45.1	-179.2	-152.4	159.3	0	0	0	111.1	I196 T197 F198 V203 E204 I233	I196-L200 WeakPolarHBondContact O-CB 3.34Å; I196-L200 PolarHBondContact O-N 2.9Å; T197-L200 PolarHBondContact O-N 3.41Å; F198-L200 VanDerWaalsContact C-N 3.29Å; F198-L200 PolarHBondContact O-N 3.5Å; L200-V203 PolarHBondContact O-N 3.09Å; L200-E204 PolarHBondContact O-N 2.73Å; L200-I233 HydrophobicContact CD2-CD1 4.3Å
201	F	72	Confident	71.8	Confident	72 Å²	72	75.7 Å²	75.7	32%	0.316	40%	0.395	S	S	.	.	H	α-helix	trans	-64.4	-41.5	174.5	-72.8	-60.3	0	0	0	113	T197 F198 V203 E204 I205 I233 L237	T197-F201 HydrophobicContact CG2-CD2 3.82Å; T197-F201 HydrophobicContact CG2-CE2 3.43Å; T197-F201 VanDerWaalsContact CG2-CE2 3.43Å; T197-F201 HydrophobicContact CG2-CZ 4.29Å; T197-F201 WeakPolarHBondContact O-CD2 3.27Å; T197-F201 PolarHBondContact O-N 3.14Å; F198-F201 PolarHBondContact O-N 3.37Å; F201-V203 VanDerWaalsContact C-N 3.3Å; F201-V203 PolarHBondContact O-N 3.18Å; F201-E204 PolarHBondContact O-N 3.16Å; F201-I205 VanDerWaalsContact O-CG1 3.31Å; F201-I205 WeakPolarHBondContact O-CG1 3.36Å; F201-I205 PolarHBondContact O-N 2.99Å; F201-I233 HydrophobicContact CD1-CG2 4.48Å; F201-I233 HydrophobicContact CE1-CG2 4.12Å; F201-L237 HydrophobicContact CE1-CD1 3.47Å; F201-L237 VanDerWaalsContact CE1-CD1 3.47Å; F201-L237 HydrophobicContact CE2-CD1 4.07Å; F201-L237 HydrophobicContact CE2-CD2 4.35Å; F201-L237 HydrophobicContact CZ-CD1 3.11Å; F201-L237 HydrophobicContact CZ-CD2 4.15Å; F201-L237 HydrophobicContact CZ-CG 4.25Å
202	D	73.5	Confident	71.3	Confident	48 Å²	48	71.3 Å²	71.3	26%	0.257	38%	0.38	S	S	.	.	H	α-helix	trans	-60.3	-41.7	176.9	-84.8	-0	0	0	0	111.1	F198 V199 I205 I206	F198-D202 WeakPolarHBondContact CE1-OD2 3.49Å; F198-D202 WeakPolarHBondContact CZ-OD2 3.44Å; F198-D202 WeakPolarHBondContact O-CB 3.19Å; F198-D202 PolarHBondContact O-N 2.76Å; V199-D202 PolarHBondContact O-N 2.84Å; D202-I205 PolarHBondContact O-N 2.8Å; D202-I206 WeakPolarHBondContact O-CD1 3.17Å; D202-I206 VanDerWaalsContact O-CG1 3.28Å; D202-I206 WeakPolarHBondContact O-CG1 3.38Å; D202-I206 PolarHBondContact O-N 3.04Å; D202-I206 VanDerWaalsContact O-N 3.14Å
203	V	73.3	Confident	70.8	Confident	76 Å²	76	70.4 Å²	70.4	46%	0.461	39%	0.386	S	S	.	.	H	α-helix	trans	-66.2	-41.2	176.7	170.6	0	0	0	0	111.6	V199 L200 F201 I205 I206 I207	V199-V203 VanDerWaalsContact O-CG2 3.27Å; V199-V203 WeakPolarHBondContact O-CG2 3.11Å; V199-V203 PolarHBondContact O-N 3.37Å; L200-V203 PolarHBondContact O-N 3.09Å; F201-V203 VanDerWaalsContact C-N 3.3Å; F201-V203 PolarHBondContact O-N 3.18Å; V203-I205 PolarHBondContact O-N 3.03Å; V203-I206 PolarHBondContact O-N 3.15Å; V203-I207 HydrophobicContact CG1-CD1 3.91Å; V203-I207 WeakPolarHBondContact O-CG1 3.45Å; V203-I207 PolarHBondContact O-N 3.48Å
204	E	71.4	Confident	70	Confident	22 Å²	22	67.5 Å²	67.5	10%	0.103	37%	0.374	C	S	.	.	H	α-helix	trans	-61.5	-44.5	177.1	-172.2	-172.5	172.8	0	0	111.7	L200 F201 I206 I207 L208 L230 I233	L200-E204 PolarHBondContact O-N 2.73Å; F201-E204 PolarHBondContact O-N 3.16Å; E204-I206 VanDerWaalsContact C-N 3.31Å; E204-I206 PolarHBondContact O-N 3.45Å; E204-I207 PolarHBondContact O-N 3.11Å; E204-I207 VanDerWaalsContact O-N 3.12Å; E204-L208 HydrophobicContact CG-CD1 4.3Å; E204-L208 WeakPolarHBondContact O-CG 3.38Å; E204-L208 PolarHBondContact O-N 3.44Å; E204-L230 WeakPolarHBondContact OE1-CA 3.47Å; E204-L230 WeakPolarHBondContact OE1-CB 3.45Å; E204-I233 HydrophobicContact CG-CD1 4.05Å; E204-I233 WeakPolarHBondContact OE2-CD1 3.43Å
205	I	70.6	Confident	69.1	Low	72 Å²	72	66.8 Å²	66.8	37%	0.369	38%	0.376	S	S	.	.	H	α-helix	trans	-61.8	-41.6	178.2	-66.6	165.2	0	0	0	110.5	I130 F201 D202 V203 I207 L208 I209	I130-I205 HydrophobicContact CG2-CG2 4.15Å; F201-I205 VanDerWaalsContact O-CG1 3.31Å; F201-I205 WeakPolarHBondContact O-CG1 3.36Å; F201-I205 PolarHBondContact O-N 2.99Å; D202-I205 PolarHBondContact O-N 2.8Å; V203-I205 PolarHBondContact O-N 3.03Å; I205-I207 VanDerWaalsContact C-N 3.3Å; I205-I207 PolarHBondContact O-N 3.01Å; I205-L208 PolarHBondContact O-N 2.97Å; I205-I209 HydrophobicContact CG2-CD1 3.98Å; I205-I209 HydrophobicContact CG2-CG1 4.47Å; I205-I209 VanDerWaalsContact O-CG1 3.27Å; I205-I209 WeakPolarHBondContact O-CG1 3.46Å; I205-I209 PolarHBondContact O-N 2.96Å
206	I	73.8	Confident	68.4	Low	93 Å²	93	69.6 Å²	69.6	48%	0.477	39%	0.391	S	S	.	.	H	α-helix	trans	-60	-42.4	175.4	-68.3	164.2	0	0	0	110.9	D202 V203 E204 I209 A210	D202-I206 WeakPolarHBondContact O-CD1 3.17Å; D202-I206 VanDerWaalsContact O-CG1 3.28Å; D202-I206 WeakPolarHBondContact O-CG1 3.38Å; D202-I206 PolarHBondContact O-N 3.04Å; D202-I206 VanDerWaalsContact O-N 3.14Å; V203-I206 PolarHBondContact O-N 3.15Å; E204-I206 VanDerWaalsContact C-N 3.31Å; E204-I206 PolarHBondContact O-N 3.45Å; I206-I209 PolarHBondContact O-N 3.33Å; I206-A210 PolarHBondContact O-N 2.79Å
207	I	67	Low	67.2	Low	92 Å²	92	69.5 Å²	69.5	47%	0.472	41%	0.408	S	S	.	.	H	α-helix	trans	-66.3	-42.9	178.1	-66.8	166.2	0	0	0	110.8	V203 E204 I205 I209 A210 M211	V203-I207 HydrophobicContact CG1-CD1 3.91Å; V203-I207 WeakPolarHBondContact O-CG1 3.45Å; V203-I207 PolarHBondContact O-N 3.48Å; E204-I207 PolarHBondContact O-N 3.11Å; E204-I207 VanDerWaalsContact O-N 3.12Å; I205-I207 VanDerWaalsContact C-N 3.3Å; I205-I207 PolarHBondContact O-N 3.01Å; I207-I209 VanDerWaalsContact C-N 3.34Å; I207-I209 PolarHBondContact O-N 3.35Å; I207-A210 PolarHBondContact O-N 3.42Å; I207-M211 WeakPolarHBondContact O-CG 3.24Å; I207-M211 PolarHBondContact O-N 2.92Å
208	L	67.2	Low	66.4	Low	44 Å²	44	73.8 Å²	73.8	23%	0.23	43%	0.429	C	S	.	.	H	α-helix	trans	-59.8	-44	175.7	-75	170.4	0	0	0	111.5	E204 I205 A210 M211 T212 L230	E204-L208 HydrophobicContact CG-CD1 4.3Å; E204-L208 WeakPolarHBondContact O-CG 3.38Å; E204-L208 PolarHBondContact O-N 3.44Å; I205-L208 PolarHBondContact O-N 2.97Å; L208-A210 PolarHBondContact O-N 3.18Å; L208-M211 PolarHBondContact O-N 3.38Å; L208-T212 VanDerWaalsContact O-CG2 3.24Å; L208-T212 WeakPolarHBondContact O-CG2 3.2Å; L208-T212 PolarHBondContact O-N 3.09Å; L208-T212 VanDerWaalsContact O-N 3.09Å; L208-L230 HydrophobicContact CD1-CD1 4.29Å
209	I	65.9	Low	65.8	Low	30 Å²	30	72.2 Å²	72.2	15%	0.154	42%	0.423	C	S	.	.	H	α-helix	trans	-59.4	-48.4	176.1	-68.6	166.7	0	0	0	110.5	I48 I130 I205 I206 I207 M211 T212 S213	I48-I209 HydrophobicContact CD1-CD1 3.83Å; I48-I209 HydrophobicContact CG1-CD1 4.01Å; I130-I209 HydrophobicContact CD1-CG1 4.13Å; I130-I209 HydrophobicContact CG2-CD1 4.12Å; I130-I209 HydrophobicContact CG2-CG1 4.47Å; I205-I209 HydrophobicContact CG2-CD1 3.98Å; I205-I209 HydrophobicContact CG2-CG1 4.47Å; I205-I209 VanDerWaalsContact O-CG1 3.27Å; I205-I209 WeakPolarHBondContact O-CG1 3.46Å; I205-I209 PolarHBondContact O-N 2.96Å; I206-I209 PolarHBondContact O-N 3.33Å; I207-I209 VanDerWaalsContact C-N 3.34Å; I207-I209 PolarHBondContact O-N 3.35Å; I209-M211 VanDerWaalsContact C-N 3.28Å; I209-M211 PolarHBondContact O-N 3.42Å; I209-T212 PolarHBondContact O-N 3.32Å; I209-T212 PolarHBondContact O-OG1 3.27Å; I209-S213 PolarHBondContact O-N 3.03Å
210	A	65.9	Low	65.2	Low	43 Å²	43	75.4 Å²	75.4	36%	0.355	44%	0.438	S	S	.	.	H	α-helix	trans	-58	-41.4	179.2	0	0	0	0	0	111.9	I206 I207 L208 S213	I206-A210 PolarHBondContact O-N 2.79Å; I207-A210 PolarHBondContact O-N 3.42Å; L208-A210 PolarHBondContact O-N 3.18Å; A210-S213 PolarHBondContact O-N 2.86Å; A210-S213 PolarHBondContact O-OG 3.5Å
211	M	62.3	Low	64.9	Low	98 Å²	98	77.7 Å²	77.7	48%	0.483	45%	0.45	S	S	.	.	H	α-helix	trans	-67.5	-35.6	178.7	-68.3	-59.4	106.6	0	0	113.2	I207 L208 I209 S213 S214 A222	I207-M211 WeakPolarHBondContact O-CG 3.24Å; I207-M211 PolarHBondContact O-N 2.92Å; L208-M211 PolarHBondContact O-N 3.38Å; I209-M211 VanDerWaalsContact C-N 3.28Å; I209-M211 PolarHBondContact O-N 3.42Å; M211-S213 VanDerWaalsContact C-N 3.26Å; M211-S213 PolarHBondContact O-N 3.02Å; M211-S214 PolarHBondContact O-N 3.26Å; M211-A222 HydrophobicContact CB-CB 4.42Å
212	T	61.1	Low	64.6	Low	53 Å²	53	75.3 Å²	75.3	33%	0.325	44%	0.444	S	S	.	.	H	α-helix	trans	-70.8	-19.5	-179.9	63.6	0	0	0	0	113.9	I126 L208 I209 S214	I126-T212 HydrophobicContact CG2-CG2 3.79Å; L208-T212 VanDerWaalsContact O-CG2 3.24Å; L208-T212 WeakPolarHBondContact O-CG2 3.2Å; L208-T212 PolarHBondContact O-N 3.09Å; L208-T212 VanDerWaalsContact O-N 3.09Å; I209-T212 PolarHBondContact O-N 3.32Å; I209-T212 PolarHBondContact O-OG1 3.27Å; T212-S214 VanDerWaalsContact C-N 3.29Å; T212-S214 PolarHBondContact O-N 3.45Å
213	S	63.2	Low	64.5	Low	80 Å²	80	76.4 Å²	76.4	56%	0.559	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-1.2	-179.6	69.3	0	0	0	0	115.1	I209 A210 M211	I209-S213 PolarHBondContact O-N 3.03Å; A210-S213 PolarHBondContact O-N 2.86Å; A210-S213 PolarHBondContact O-OG 3.5Å; M211-S213 VanDerWaalsContact C-N 3.26Å; M211-S213 PolarHBondContact O-N 3.02Å
214	S	58.9	Low	64.7	Low	35 Å²	35	76.6 Å²	76.6	25%	0.245	45%	0.45	C	S	.	.	S	Bend	trans	-77.9	142	179.9	173.1	0	0	0	0	112.5	M211 T212 Q219	M211-S214 PolarHBondContact O-N 3.26Å; T212-S214 VanDerWaalsContact C-N 3.29Å; T212-S214 PolarHBondContact O-N 3.45Å; S214-Q219 VanDerWaalsContact O-CG 3.29Å; S214-Q219 WeakPolarHBondContact O-CG 3.3Å; S214-Q219 PolarHBondContact O-NE2 2.98Å
215	P	55	Low	64.9	Low	105 Å²	105	80.5 Å²	80.5	68%	0.682	47%	0.471	S	S	*	.			trans	-65.1	136.3	179.6	25.4	-33.4	0	0	0	113.8	G217 L218	P215-G217 PolarHBondContact O-N 3.47Å; P215-L218 PolarHBondContact O-N 2.94Å
216	V	57	Low	65.1	Low	129 Å²	129	77.5 Å²	77.5	78%	0.782	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-0.8	-21.1	172.5	-167.6	0	0	0	0	121.5
217	G	55	Low	65	Low	75 Å²	75	77.3 Å²	77.3	77%	0.773	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-34.1	-177.6	0	0	0	0	0	116.1	P215	P215-G217 PolarHBondContact O-N 3.47Å
218	L	55.6	Low	65.7	Low	125 Å²	125	77 Å²	77	65%	0.654	46%	0.456	S	S	*	.	S	Bend	trans	-92.4	-3.7	179.6	-86.8	122.1	0	0	0	113.6	P215 L220 A222	P215-L218 PolarHBondContact O-N 2.94Å; L218-L220 PolarHBondContact O-N 3.48Å; L218-A222 WeakPolarHBondContact O-CB 3.27Å; L218-A222 PolarHBondContact O-N 3.22Å; L218-A222 VanDerWaalsContact O-N 3.17Å
219	Q	60.9	Low	66.1	Low	67 Å²	67	79.1 Å²	79.1	31%	0.313	47%	0.467	S	S	.	.	H	α-helix	trans	-65.2	-41.2	-168.9	-70.1	-177.9	-19.9	0	0	112.7	S214 A222 I223	S214-Q219 VanDerWaalsContact O-CG 3.29Å; S214-Q219 WeakPolarHBondContact O-CG 3.3Å; S214-Q219 PolarHBondContact O-NE2 2.98Å; Q219-A222 PolarHBondContact O-N 2.73Å; Q219-I223 HydrophobicContact CB-CD1 4.28Å; Q219-I223 VanDerWaalsContact O-CB 3.28Å; Q219-I223 WeakPolarHBondContact O-CB 3.35Å; Q219-I223 VanDerWaalsContact O-CD1 3.27Å; Q219-I223 WeakPolarHBondContact O-CD1 3.35Å; Q219-I223 WeakPolarHBondContact O-CG1 3.46Å; Q219-I223 PolarHBondContact O-N 3.34Å
220	L	63.5	Low	66.6	Low	136 Å²	136	80.7 Å²	80.7	71%	0.712	48%	0.475	S	S	*	.	H	α-helix	trans	-65.2	-47.8	-177.3	-78.9	164.7	0	0	0	112.5	L218 A222 I223 V224	L218-L220 PolarHBondContact O-N 3.48Å; L220-A222 VanDerWaalsContact C-N 3.34Å; L220-A222 PolarHBondContact O-N 3.35Å; L220-I223 PolarHBondContact O-N 3.45Å; L220-V224 WeakPolarHBondContact O-CB 3.28Å; L220-V224 VanDerWaalsContact O-CG2 3.26Å; L220-V224 WeakPolarHBondContact O-CG2 3.29Å; L220-V224 PolarHBondContact O-N 3.18Å
221	N	70	Confident	67.4	Low	136 Å²	136	82.4 Å²	82.4	73%	0.727	48%	0.481	S	S	*	.	H	α-helix	trans	-66.2	-37.8	178.3	-77.5	3.2	0	0	0	111.9	L225	N221-L225 VanDerWaalsContact O-CB 3.3Å; N221-L225 WeakPolarHBondContact O-CB 3.42Å; N221-L225 PolarHBondContact O-N 2.98Å
222	A	65.7	Low	68.2	Low	22 Å²	22	84.2 Å²	84.2	18%	0.182	49%	0.487	C	S	.	.	H	α-helix	trans	-68.6	-38.8	177.3	0	0	0	0	0	112.4	M211 L218 Q219 L220 L225 G226	M211-A222 HydrophobicContact CB-CB 4.42Å; L218-A222 WeakPolarHBondContact O-CB 3.27Å; L218-A222 PolarHBondContact O-N 3.22Å; L218-A222 VanDerWaalsContact O-N 3.17Å; Q219-A222 PolarHBondContact O-N 2.73Å; L220-A222 VanDerWaalsContact C-N 3.34Å; L220-A222 PolarHBondContact O-N 3.35Å; A222-L225 PolarHBondContact O-N 3.46Å; A222-G226 PolarHBondContact O-N 2.98Å
223	I	70.2	Confident	68.9	Low	72 Å²	72	83.5 Å²	83.5	37%	0.369	48%	0.481	S	S	.	.	H	α-helix	trans	-67.3	-43.6	175.5	-68.7	162.7	0	0	0	110.6	Q219 L220 L225 G226 N227	Q219-I223 HydrophobicContact CB-CD1 4.28Å; Q219-I223 VanDerWaalsContact O-CB 3.28Å; Q219-I223 WeakPolarHBondContact O-CB 3.35Å; Q219-I223 VanDerWaalsContact O-CD1 3.27Å; Q219-I223 WeakPolarHBondContact O-CD1 3.35Å; Q219-I223 WeakPolarHBondContact O-CG1 3.46Å; Q219-I223 PolarHBondContact O-N 3.34Å; L220-I223 PolarHBondContact O-N 3.45Å; I223-L225 VanDerWaalsContact C-N 3.35Å; I223-G226 PolarHBondContact O-N 3.07Å; I223-N227 WeakPolarHBondContact O-CB 3.07Å; I223-N227 VanDerWaalsContact O-CG 3.27Å; I223-N227 PolarHBondContact O-N 3.17Å; I223-N227 PolarHBondContact O-ND2 2.88Å
224	V	78.5	Confident	69.6	Low	79 Å²	79	84.3 Å²	84.3	48%	0.479	48%	0.478	S	S	.	.	H	α-helix	trans	-62.1	-43.8	175.8	171.7	0	0	0	0	110.6	L220 N227 I228	L220-V224 WeakPolarHBondContact O-CB 3.28Å; L220-V224 VanDerWaalsContact O-CG2 3.26Å; L220-V224 WeakPolarHBondContact O-CG2 3.29Å; L220-V224 PolarHBondContact O-N 3.18Å; V224-N227 PolarHBondContact O-N 2.68Å; V224-I228 HydrophobicContact CG1-CD1 3.91Å; V224-I228 VanDerWaalsContact O-CG1 3.28Å; V224-I228 WeakPolarHBondContact O-CG1 3.18Å; V224-I228 PolarHBondContact O-N 3.28Å
225	L	76.1	Confident	70.8	Confident	105 Å²	105	87 Å²	87	55%	0.55	49%	0.49	S	S	.	.	H	α-helix	trans	-63.7	-43.1	176.6	-172.7	65.8	0	0	0	112	N221 A222 I223 N227 I228 L229	N221-L225 VanDerWaalsContact O-CB 3.3Å; N221-L225 WeakPolarHBondContact O-CB 3.42Å; N221-L225 PolarHBondContact O-N 2.98Å; A222-L225 PolarHBondContact O-N 3.46Å; I223-L225 VanDerWaalsContact C-N 3.35Å; L225-N227 VanDerWaalsContact C-N 3.35Å; L225-N227 PolarHBondContact O-N 3.17Å; L225-I228 PolarHBondContact O-N 3.29Å; L225-L229 WeakPolarHBondContact O-CG 3.28Å; L225-L229 PolarHBondContact O-N 2.96Å
226	G	73.6	Confident	71.9	Confident	8 Å²	8	85.3 Å²	85.3	8%	0.082	48%	0.477	C	S	.	.	H	α-helix	trans	-60.5	-42	175.2	0	0	0	0	0	112.6	A222 I223 L229 L230	A222-G226 PolarHBondContact O-N 2.98Å; I223-G226 PolarHBondContact O-N 3.07Å; G226-L229 PolarHBondContact O-N 3.45Å; G226-L230 WeakPolarHBondContact O-CB 3.42Å; G226-L230 PolarHBondContact O-N 3.49Å
227	N	72.1	Confident	72.9	Confident	89 Å²	89	81.5 Å²	81.5	48%	0.476	45%	0.452	S	S	.	.	H	α-helix	trans	-66.6	-37.7	176.1	-72.1	-27.4	0	0	0	112.4	I223 V224 L225 L229 L230 V231	I223-N227 WeakPolarHBondContact O-CB 3.07Å; I223-N227 VanDerWaalsContact O-CG 3.27Å; I223-N227 PolarHBondContact O-N 3.17Å; I223-N227 PolarHBondContact O-ND2 2.88Å; V224-N227 PolarHBondContact O-N 2.68Å; L225-N227 VanDerWaalsContact C-N 3.35Å; L225-N227 PolarHBondContact O-N 3.17Å; N227-L229 VanDerWaalsContact C-N 3.35Å; N227-L230 PolarHBondContact O-N 3.18Å; N227-V231 VanDerWaalsContact O-CG2 3.28Å; N227-V231 WeakPolarHBondContact O-CG2 3.48Å; N227-V231 PolarHBondContact O-N 3.47Å
228	I	81.9	Confident	74.2	Confident	85 Å²	85	84.9 Å²	84.9	44%	0.436	45%	0.452	S	S	.	.	H	α-helix	trans	-64	-42.5	175.2	-68.1	163.4	0	0	0	110.4	V224 L225 V231 F232	V224-I228 HydrophobicContact CG1-CD1 3.91Å; V224-I228 VanDerWaalsContact O-CG1 3.28Å; V224-I228 WeakPolarHBondContact O-CG1 3.18Å; V224-I228 PolarHBondContact O-N 3.28Å; L225-I228 PolarHBondContact O-N 3.29Å; I228-V231 PolarHBondContact O-N 3.47Å; I228-F232 HydrophobicContact CG2-CD2 4.08Å; I228-F232 HydrophobicContact CG2-CE2 4.37Å; I228-F232 PolarHBondContact O-N 2.94Å
229	L	76.5	Confident	75.6	Confident	90 Å²	90	85.8 Å²	85.8	47%	0.471	46%	0.456	S	S	.	.	H	α-helix	trans	-63.6	-43.9	177	-70.7	173.1	0	0	0	112	L225 G226 N227 V231 F232 I233	L225-L229 WeakPolarHBondContact O-CG 3.28Å; L225-L229 PolarHBondContact O-N 2.96Å; G226-L229 PolarHBondContact O-N 3.45Å; N227-L229 VanDerWaalsContact C-N 3.35Å; L229-V231 PolarHBondContact O-N 3.36Å; L229-F232 WeakPolarHBondContact O-CB 3.38Å; L229-F232 PolarHBondContact O-N 3.09Å; L229-I233 WeakPolarHBondContact O-CG1 3.41Å; L229-I233 PolarHBondContact O-N 3.25Å
230	L	75.7	Confident	76.2	Confident	62 Å²	62	91.7 Å²	91.7	33%	0.325	48%	0.483	S	S	.	.	H	α-helix	trans	-61.5	-43.5	177.2	-171	154.3	0	0	0	111.7	E204 L208 G226 N227 F232 I233 L234	E204-L230 WeakPolarHBondContact OE1-CA 3.47Å; E204-L230 WeakPolarHBondContact OE1-CB 3.45Å; L208-L230 HydrophobicContact CD1-CD1 4.29Å; G226-L230 WeakPolarHBondContact O-CB 3.42Å; G226-L230 PolarHBondContact O-N 3.49Å; N227-L230 PolarHBondContact O-N 3.18Å; L230-F232 VanDerWaalsContact C-N 3.34Å; L230-F232 PolarHBondContact O-N 3.25Å; L230-I233 PolarHBondContact O-N 3.42Å; L230-L234 HydrophobicContact CD2-CD1 3.48Å; L230-L234 VanDerWaalsContact CD2-CD1 3.48Å; L230-L234 HydrophobicContact CD2-CG 4.02Å; L230-L234 WeakPolarHBondContact O-CB 3.28Å; L230-L234 WeakPolarHBondContact O-CG 3.28Å; L230-L234 PolarHBondContact O-N 3.42Å
231	V	82	Confident	76.8	Confident	80 Å²	80	89.5 Å²	89.5	49%	0.485	47%	0.472	S	S	.	.	H	α-helix	trans	-63.2	-40.5	175.5	171	0	0	0	0	111.3	N227 I228 L229 L234 L235	N227-V231 VanDerWaalsContact O-CG2 3.28Å; N227-V231 WeakPolarHBondContact O-CG2 3.48Å; N227-V231 PolarHBondContact O-N 3.47Å; I228-V231 PolarHBondContact O-N 3.47Å; L229-V231 PolarHBondContact O-N 3.36Å; V231-L234 PolarHBondContact O-N 2.86Å; V231-L235 HydrophobicContact CG1-CD1 4Å; V231-L235 HydrophobicContact CG1-CG 4.47Å; V231-L235 WeakPolarHBondContact O-CB 3.47Å; V231-L235 VanDerWaalsContact O-CG 3.3Å; V231-L235 WeakPolarHBondContact O-CG 3.26Å; V231-L235 PolarHBondContact O-N 2.91Å
232	F	80	Confident	77.2	Confident	135 Å²	135	87 Å²	87	59%	0.592	46%	0.458	S	S	*	.	H	α-helix	trans	-60.7	-45.3	175.9	-106.4	-84.3	0	0	0	112.1	I228 L229 L230 L235 T236	I228-F232 HydrophobicContact CG2-CD2 4.08Å; I228-F232 HydrophobicContact CG2-CE2 4.37Å; I228-F232 PolarHBondContact O-N 2.94Å; L229-F232 WeakPolarHBondContact O-CB 3.38Å; L229-F232 PolarHBondContact O-N 3.09Å; L230-F232 VanDerWaalsContact C-N 3.34Å; L230-F232 PolarHBondContact O-N 3.25Å; F232-L235 PolarHBondContact O-N 3.02Å; F232-T236 PolarHBondContact O-N 3.27Å; F232-T236 PolarHBondContact O-OG1 3Å; F232-T236 VanDerWaalsContact O-OG1 3.07Å
233	I	74.6	Confident	77.8	Confident	39 Å²	39	90.6 Å²	90.6	20%	0.2	47%	0.474	C	S	.	.	H	α-helix	trans	-67.1	-44.1	-179.4	-68.5	164.5	0	0	0	110.3	L200 F201 E204 L229 L230 L235 T236 L237	L200-I233 HydrophobicContact CD2-CD1 4.3Å; F201-I233 HydrophobicContact CD1-CG2 4.48Å; F201-I233 HydrophobicContact CE1-CG2 4.12Å; E204-I233 HydrophobicContact CG-CD1 4.05Å; E204-I233 WeakPolarHBondContact OE2-CD1 3.43Å; L229-I233 WeakPolarHBondContact O-CG1 3.41Å; L229-I233 PolarHBondContact O-N 3.25Å; L230-I233 PolarHBondContact O-N 3.42Å; I233-L235 VanDerWaalsContact C-N 3.29Å; I233-L235 PolarHBondContact O-N 2.99Å; I233-T236 PolarHBondContact O-N 3.39Å; I233-T236 VanDerWaalsContact O-N 3.17Å; I233-L237 HydrophobicContact CG2-CD1 3.82Å; I233-L237 VanDerWaalsContact O-CD1 3.3Å; I233-L237 WeakPolarHBondContact O-CD1 3.36Å; I233-L237 VanDerWaalsContact O-CG 3.28Å; I233-L237 WeakPolarHBondContact O-CG 3.3Å; I233-L237 PolarHBondContact O-N 3.45Å
234	L	78.2	Confident	78.3	Confident	96 Å²	96	91.7 Å²	91.7	50%	0.503	48%	0.48	S	S	.	.	H	α-helix	trans	-58.6	-39	173.8	-74.2	-178.5	0	0	0	112.8	L230 V231 L238	L230-L234 HydrophobicContact CD2-CD1 3.48Å; L230-L234 VanDerWaalsContact CD2-CD1 3.48Å; L230-L234 HydrophobicContact CD2-CG 4.02Å; L230-L234 WeakPolarHBondContact O-CB 3.28Å; L230-L234 WeakPolarHBondContact O-CG 3.28Å; L230-L234 PolarHBondContact O-N 3.42Å; V231-L234 PolarHBondContact O-N 2.86Å; L234-L238 WeakPolarHBondContact O-CB 3.46Å; L234-L238 PolarHBondContact O-N 3.35Å; L234-L238 VanDerWaalsContact O-N 3.09Å
235	L	84.1	Confident	78.3	Confident	93 Å²	93	92.5 Å²	92.5	49%	0.487	48%	0.48	S	S	.	.	H	α-helix	trans	-66.7	-42.8	174.9	-75.1	168.1	0	0	0	111.7	V231 F232 I233 L237 L238 I239	V231-L235 HydrophobicContact CG1-CD1 4Å; V231-L235 HydrophobicContact CG1-CG 4.47Å; V231-L235 WeakPolarHBondContact O-CB 3.47Å; V231-L235 VanDerWaalsContact O-CG 3.3Å; V231-L235 WeakPolarHBondContact O-CG 3.26Å; V231-L235 PolarHBondContact O-N 2.91Å; F232-L235 PolarHBondContact O-N 3.02Å; I233-L235 VanDerWaalsContact C-N 3.29Å; I233-L235 PolarHBondContact O-N 2.99Å; L235-L237 VanDerWaalsContact C-N 3.32Å; L235-L237 PolarHBondContact O-N 3.35Å; L235-L238 PolarHBondContact O-N 3.48Å; L235-I239 WeakPolarHBondContact O-CD1 3.3Å; L235-I239 VanDerWaalsContact O-CG1 3.26Å; L235-I239 WeakPolarHBondContact O-CG1 3.26Å; L235-I239 PolarHBondContact O-N 3.43Å
236	T	78.7	Confident	78.4	Confident	69 Å²	69	91.7 Å²	91.7	42%	0.423	48%	0.475	S	S	.	.	H	α-helix	trans	-59.4	-43.9	176.1	-56.4	0	0	0	0	111.3	F232 I233 L238 I239 E240	F232-T236 PolarHBondContact O-N 3.27Å; F232-T236 PolarHBondContact O-OG1 3Å; F232-T236 VanDerWaalsContact O-OG1 3.07Å; I233-T236 PolarHBondContact O-N 3.39Å; I233-T236 VanDerWaalsContact O-N 3.17Å; T236-L238 VanDerWaalsContact C-N 3.32Å; T236-L238 PolarHBondContact O-N 3Å; T236-I239 PolarHBondContact O-N 2.97Å; T236-E240 PolarHBondContact O-N 2.93Å
237	L	77.6	Confident	78.8	Confident	48 Å²	48	97.6 Å²	97.6	25%	0.251	50%	0.503	S	S	.	.	H	α-helix	trans	-68.4	-27.6	178.4	-68.4	156.3	0	0	0	114.3	T197 F201 I233 L235 I239	T197-L237 HydrophobicContact CG2-CD2 3.33Å; F201-L237 HydrophobicContact CE1-CD1 3.47Å; F201-L237 VanDerWaalsContact CE1-CD1 3.47Å; F201-L237 HydrophobicContact CE2-CD1 4.07Å; F201-L237 HydrophobicContact CE2-CD2 4.35Å; F201-L237 HydrophobicContact CZ-CD1 3.11Å; F201-L237 HydrophobicContact CZ-CD2 4.15Å; F201-L237 HydrophobicContact CZ-CG 4.25Å; I233-L237 HydrophobicContact CG2-CD1 3.82Å; I233-L237 VanDerWaalsContact O-CD1 3.3Å; I233-L237 WeakPolarHBondContact O-CD1 3.36Å; I233-L237 VanDerWaalsContact O-CG 3.28Å; I233-L237 WeakPolarHBondContact O-CG 3.3Å; I233-L237 PolarHBondContact O-N 3.45Å; L235-L237 VanDerWaalsContact C-N 3.32Å; L235-L237 PolarHBondContact O-N 3.35Å; L237-I239 VanDerWaalsContact C-N 3.28Å
238	L	82.4	Confident	79.3	Confident	147 Å²	147	98.3 Å²	98.3	77%	0.77	51%	0.505	S	S	*	.	H	α-helix	trans	-75.6	-23.1	175.8	-167.8	110.6	0	0	0	111.7	L234 L235 T236	L234-L238 WeakPolarHBondContact O-CB 3.46Å; L234-L238 PolarHBondContact O-N 3.35Å; L234-L238 VanDerWaalsContact O-N 3.09Å; L235-L238 PolarHBondContact O-N 3.48Å; T236-L238 VanDerWaalsContact C-N 3.32Å; T236-L238 PolarHBondContact O-N 3Å
239	I	85.4	Confident	79	Confident	144 Å²	144	99.4 Å²	99.4	74%	0.738	51%	0.511	S	S	*	.	H	α-helix	trans	-85.6	-28.3	179.9	-66.4	163.5	0	0	0	111.5	L235 T236 L237	L235-I239 WeakPolarHBondContact O-CD1 3.3Å; L235-I239 VanDerWaalsContact O-CG1 3.26Å; L235-I239 WeakPolarHBondContact O-CG1 3.26Å; L235-I239 PolarHBondContact O-N 3.43Å; T236-I239 PolarHBondContact O-N 2.97Å; L237-I239 VanDerWaalsContact C-N 3.28Å
240	E	73.3	Confident	79.3	Confident	190 Å²	190	100.3 Å²	100.3	89%	0.888	52%	0.515	S	S	*	.			trans	-84.5	0	177.8	-70.4	176.3	167.6	0	0	113.2	T236	T236-E240 PolarHBondContact O-N 2.93Å

Retrieved 240 of 240 residues in 197.1 ms (Link to these results)

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