A0A5K4FFI7_SCHMA Loading...

4-hydroxybenzoate polyprenyltransferase, mitochondrial

Catalyzes the prenylation of para-hydroxybenzoate (PHB) with an all-trans polyprenyl group. Mediates the second step in the final reaction sequence of coenzyme Q (CoQ) biosynthesis, which is the condensation of the polyisoprenoid side chain with PHB, generating the first membrane-bound Q intermediate.

AlphaFold DB , UniProt , Accession A0A5K4FFI7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 320 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	36.2	Very low	31.5	Very low	232 Å²	232	170.5 Å²	170.5	100%	1.143	88%	0.876	S	S	*	*				0	96.3	0	-157.1	-176.1	-78.2	0	0	107.3
2	L	30.1	Very low	31.3	Very low	180 Å²	180	175.7 Å²	175.7	94%	0.942	88%	0.876	S	S	*	*			trans	-66.9	124.8	-177	-77	141.2	0	0	0	110.1
3	R	33.6	Very low	31.5	Very low	232 Å²	232	170.8 Å²	170.8	88%	0.875	87%	0.868	S	S	*	*			trans	-132.7	114.5	166.6	-83.6	-168.7	175.5	-160.1	-0.5	111.8
4	S	31.9	Very low	31.6	Very low	116 Å²	116	167.9 Å²	167.9	81%	0.811	86%	0.863	S	S	*	*			trans	69.7	94.4	139.6	-151	0	0	0	0	118.7
5	F	26.9	Very low	31.9	Very low	202 Å²	202	172.8 Å²	172.8	89%	0.886	87%	0.866	S	S	*	*			trans	-52.7	149.5	144.7	-85.1	-104.4	0	0	0	112.1
6	S	30	Very low	31.9	Very low	104 Å²	104	174.4 Å²	174.4	73%	0.727	87%	0.866	S	S	*	*			trans	135.7	106.7	137.7	66.1	0	0	0	0	113.2
7	R	31.8	Very low	32.3	Very low	252 Å²	252	172.5 Å²	172.5	95%	0.951	86%	0.859	S	S	*	*			trans	-156.9	102.6	141.4	-107.1	173.3	-166.7	-156.1	2.9	108	G9	R7-G9 PolarHBondContact O-N 3.34Å
8	F	30.7	Very low	32.5	Very low	216 Å²	216	174.8 Å²	174.8	95%	0.947	86%	0.858	S	S	*	*			trans	-64.8	112.4	167.3	-97.6	-102.4	0	0	0	108.5
9	G	32.7	Very low	32.9	Very low	74 Å²	74	173.3 Å²	173.3	76%	0.763	86%	0.86	S	S	*	*			trans	-108.4	110.1	166.7	0	0	0	0	0	108.6	R7 D11	R7-G9 PolarHBondContact O-N 3.34Å; G9-D11 PolarHBondContact O-N 2.81Å
10	S	29.4	Very low	33.3	Very low	100 Å²	100	169.4 Å²	169.4	70%	0.699	85%	0.85	S	S	*	*			trans	-74.6	115	175.1	135.2	0	0	0	0	109
11	D	33.4	Very low	33.7	Very low	167 Å²	167	166.9 Å²	166.9	89%	0.893	85%	0.847	S	S	*	*			trans	-135	90.6	158.5	-90.7	-35.8	0	0	0	109.9	G9 C13	G9-D11 PolarHBondContact O-N 2.81Å; D11-C13 PolarHBondContact O-N 2.84Å
12	R	29.1	Very low	34	Very low	233 Å²	233	165.5 Å²	165.5	88%	0.879	83%	0.831	S	S	*	*			trans	-80.5	99.8	161.2	-90.3	-175.8	-92	-145.5	-5.4	107.8
13	C	33.7	Very low	35	Very low	113 Å²	113	162.3 Å²	162.3	76%	0.764	82%	0.819	S	S	*	*			trans	-137.3	85.2	161	-113.8	0	0	0	0	110.3	D11 R15	D11-C13 PolarHBondContact O-N 2.84Å; C13-R15 PolarHBondContact O-N 3.1Å
14	T	33.5	Very low	35.7	Very low	130 Å²	130	158.3 Å²	158.3	80%	0.798	82%	0.815	S	S	*	*			trans	28.3	90.9	134.2	-18.5	0	0	0	0	116.8
15	R	35.3	Very low	36.7	Very low	241 Å²	241	158 Å²	158	91%	0.909	81%	0.808	S	S	*	*			trans	-110.9	71.1	169.5	-148.6	176.4	-165.5	-177	4.2	109.9	C13	C13-R15 PolarHBondContact O-N 3.1Å
16	F	32.3	Very low	37.9	Very low	199 Å²	199	153.8 Å²	153.8	87%	0.873	80%	0.801	S	S	*	*			trans	-103	91.7	168.1	-103.3	-90.2	0	0	0	107.9
17	L	38.3	Very low	39.4	Very low	141 Å²	141	158.4 Å²	158.4	74%	0.738	81%	0.808	S	S	*	*			trans	-130.1	108	170.5	-77.2	171.6	0	0	0	109.3
18	Y	36.8	Very low	41.2	Very low	215 Å²	215	154.1 Å²	154.1	84%	0.843	80%	0.802	S	S	*	*			trans	39.3	85.1	147.5	-63.9	-87.5	0	0	0	117.7	S20	Y18-S20 PolarHBondContact O-N 2.81Å; Y18-S20 VanDerWaalsContact O-N 3.11Å
19	T	40.1	Very low	43.2	Very low	145 Å²	145	151.9 Å²	151.9	89%	0.89	80%	0.795	S	S	*	*			trans	-73.5	95.7	157.4	-18	0	0	0	0	108.1	C21	T19-C21 PolarHBondContact O-N 3Å; T19-C21 VanDerWaalsContact O-N 3.15Å
20	S	40.7	Very low	45.3	Very low	95 Å²	95	151.6 Å²	151.6	66%	0.664	78%	0.779	S	S	*	*			trans	-66.7	109.6	171	-169.5	0	0	0	0	108.6	Y18 Y22	Y18-S20 PolarHBondContact O-N 2.81Å; Y18-S20 VanDerWaalsContact O-N 3.11Å; S20-Y22 VanDerWaalsContact C-N 3.34Å; S20-Y22 PolarHBondContact O-N 3.28Å
21	C	41.2	Very low	47.9	Very low	118 Å²	118	149.8 Å²	149.8	80%	0.797	77%	0.767	S	S	*	*			trans	-65.7	92.3	170.5	-100.7	0	0	0	0	109	T19 V23	T19-C21 PolarHBondContact O-N 3Å; T19-C21 VanDerWaalsContact O-N 3.15Å; C21-V23 VanDerWaalsContact C-N 3.33Å; C21-V23 PolarHBondContact O-N 3.36Å
22	Y	42.6	Very low	50.3	Low	202 Å²	202	150.7 Å²	150.7	79%	0.792	76%	0.763	S	S	*	*			trans	-66.2	95.5	163.3	-100.2	-93.5	0	0	0	108.1	S20 N24	S20-Y22 VanDerWaalsContact C-N 3.34Å; S20-Y22 PolarHBondContact O-N 3.28Å; Y22-N24 VanDerWaalsContact C-N 3.33Å; Y22-N24 PolarHBondContact O-N 3.16Å
23	V	50.8	Low	52.9	Low	114 Å²	114	143.8 Å²	143.8	69%	0.691	75%	0.75	S	S	*	*			trans	-67	99.6	164.9	-178.5	0	0	0	0	106.4	C21 T25	C21-V23 VanDerWaalsContact C-N 3.33Å; C21-V23 PolarHBondContact O-N 3.36Å; V23-T25 HydrophobicContact CG1-CG2 4.11Å; V23-T25 PolarHBondContact O-N 3.15Å
24	N	49.4	Very low	55.5	Low	148 Å²	148	140.5 Å²	140.5	79%	0.791	73%	0.728	S	S	*	*			trans	-63.5	82	167.1	-90.2	-38.9	0	0	0	108.2	Y22 P26	Y22-N24 VanDerWaalsContact C-N 3.33Å; Y22-N24 PolarHBondContact O-N 3.16Å; N24-P26 WeakPolarHBondContact O-CD 3.37Å
25	T	52.3	Low	58.2	Low	109 Å²	109	138.9 Å²	138.9	67%	0.669	71%	0.712	S	S	*	*			trans	-65	123.5	166.9	39.9	0	0	0	0	107.2	V23 K27	V23-T25 HydrophobicContact CG1-CG2 4.11Å; V23-T25 PolarHBondContact O-N 3.15Å; T25-K27 PolarHBondContact O-N 3.48Å; T25-K27 VanDerWaalsContact O-N 3.12Å
26	P	52.8	Low	61	Low	113 Å²	113	130.6 Å²	130.6	73%	0.734	69%	0.685	S	S	*	*			trans	-58.1	123.6	176	21.5	-29.6	0	0	0	107.8	N24 I28	N24-P26 WeakPolarHBondContact O-CD 3.37Å; P26-I28 PolarHBondContact O-N 3.2Å
27	K	60.6	Low	63.9	Low	202 Å²	202	125.7 Å²	125.7	88%	0.878	67%	0.667	S	S	*	*			trans	-58.9	105.1	172.2	-79.2	-176.9	178	176.8	0	107.4	T25 Q29	T25-K27 PolarHBondContact O-N 3.48Å; T25-K27 VanDerWaalsContact O-N 3.12Å; K27-Q29 PolarHBondContact O-N 2.98Å
28	I	69	Low	66.6	Low	162 Å²	162	123.3 Å²	123.3	83%	0.831	66%	0.655	S	S	*	*			trans	-58.8	114.1	176.2	-61.6	173.9	0	0	0	106.8	P26	P26-I28 PolarHBondContact O-N 3.2Å
29	Q	72.8	Confident	69.5	Low	169 Å²	169	113.9 Å²	113.9	79%	0.79	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-67.2	137.4	174.9	-70.6	-171.2	-19.5	0	0	109	K27 S31	K27-Q29 PolarHBondContact O-N 2.98Å; Q29-S31 PolarHBondContact O-N 3.19Å
30	P	76.4	Confident	72.2	Confident	68 Å²	68	109.1 Å²	109.1	44%	0.442	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-60.6	136.2	178.9	22.9	-30.6	0	0	0	109.9	Q35	P30-Q35 HydrophobicContact CB-CG 4.17Å; P30-Q35 HydrophobicContact CG-CG 4.06Å; P30-Q35 PolarHBondContact O-NE2 2.8Å
31	S	84.6	Confident	74.9	Confident	62 Å²	62	109.4 Å²	109.4	43%	0.434	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-58.5	157.5	176.4	66.8	0	0	0	0	111.2	Q29 S33 S34 Q35	Q29-S31 PolarHBondContact O-N 3.19Å; S31-S33 PolarHBondContact O-N 2.93Å; S31-S33 PolarHBondContact OG-OG 2.9Å; S31-S34 WeakPolarHBondContact O-CB 3.21Å; S31-S34 PolarHBondContact O-N 3.45Å; S31-S34 WeakPolarHBondContact OG-CB 3Å; S31-S34 PolarHBondContact OG-N 3.46Å; S31-S34 VanDerWaalsContact OG-N 3.1Å; S31-Q35 WeakPolarHBondContact O-CG 3.29Å; S31-Q35 PolarHBondContact O-N 3.42Å
32	K	83.3	Confident	77.6	Confident	186 Å²	186	106 Å²	106	81%	0.809	55%	0.549	S	S	*	.	H	α-helix	trans	-53.9	-38.1	173.7	-71.5	-176.8	178	179.3	0	112.2	Q35 L36	K32-Q35 PolarHBondContact O-N 2.92Å; K32-L36 WeakPolarHBondContact O-CB 3.43Å; K32-L36 PolarHBondContact O-N 2.96Å
33	S	84.9	Confident	80.2	Confident	88 Å²	88	96.4 Å²	96.4	62%	0.615	51%	0.511	S	S	*	.	H	α-helix	trans	-65.5	-40.9	176.1	54.4	0	0	0	0	112.6	S31 L36 L37	S31-S33 PolarHBondContact O-N 2.93Å; S31-S33 PolarHBondContact OG-OG 2.9Å; S33-L36 PolarHBondContact O-N 3.01Å; S33-L37 WeakPolarHBondContact O-CB 3.48Å; S33-L37 PolarHBondContact O-N 3.14Å
34	S	88.5	Confident	82.4	Confident	44 Å²	44	91 Å²	91	31%	0.308	48%	0.479	S	S	.	.	H	α-helix	trans	-64.7	-42.5	175.5	178	0	0	0	0	111.7	S31 L36 L37 N38	S31-S34 WeakPolarHBondContact O-CB 3.21Å; S31-S34 PolarHBondContact O-N 3.45Å; S31-S34 WeakPolarHBondContact OG-CB 3Å; S31-S34 PolarHBondContact OG-N 3.46Å; S31-S34 VanDerWaalsContact OG-N 3.1Å; S34-L36 VanDerWaalsContact C-N 3.34Å; S34-L36 PolarHBondContact O-N 3.45Å; S34-L37 PolarHBondContact O-N 3.09Å; S34-N38 WeakPolarHBondContact O-CB 3.35Å; S34-N38 PolarHBondContact O-N 3.34Å; S34-N38 PolarHBondContact O-ND2 2.88Å
35	Q	90.1	Very high	84.7	Confident	96 Å²	96	85.1 Å²	85.1	45%	0.449	45%	0.445	S	S	.	.	H	α-helix	trans	-63.4	-40.4	176.3	-65.5	174.9	7.3	0	0	112.2	P30 S31 K32 N38 S39	P30-Q35 HydrophobicContact CB-CG 4.17Å; P30-Q35 HydrophobicContact CG-CG 4.06Å; P30-Q35 PolarHBondContact O-NE2 2.8Å; S31-Q35 WeakPolarHBondContact O-CG 3.29Å; S31-Q35 PolarHBondContact O-N 3.42Å; K32-Q35 PolarHBondContact O-N 2.92Å; Q35-N38 PolarHBondContact O-N 2.82Å; Q35-S39 PolarHBondContact O-N 3.09Å; Q35-S39 PolarHBondContact O-OG 3.18Å
36	L	93.1	Very high	86.8	Confident	66 Å²	66	83.1 Å²	83.1	35%	0.346	43%	0.428	S	S	.	.	H	α-helix	trans	-65.3	-45.5	176.6	-175.6	63.2	0	0	0	111.4	K32 S33 S34 N38 S39 Y40 L120	K32-L36 WeakPolarHBondContact O-CB 3.43Å; K32-L36 PolarHBondContact O-N 2.96Å; S33-L36 PolarHBondContact O-N 3.01Å; S34-L36 VanDerWaalsContact C-N 3.34Å; S34-L36 PolarHBondContact O-N 3.45Å; L36-N38 PolarHBondContact O-N 2.81Å; L36-S39 WeakPolarHBondContact O-CB 3.49Å; L36-S39 PolarHBondContact O-N 3.28Å; L36-S39 VanDerWaalsContact O-N 3.13Å; L36-Y40 HydrophobicContact CD1-CE2 3.96Å; L36-Y40 HydrophobicContact CD2-CE2 4.4Å; L36-Y40 HydrophobicContact CG-CD2 4.3Å; L36-Y40 HydrophobicContact CG-CE2 3.83Å; L36-Y40 VanDerWaalsContact O-CD2 3.28Å; L36-Y40 WeakPolarHBondContact O-CD2 3.39Å; L36-Y40 PolarHBondContact O-N 3.13Å; L36-Y40 VanDerWaalsContact O-N 3.16Å; L36-L120 HydrophobicContact CD1-CD2 3.52Å
37	L	94.1	Very high	88.7	Confident	97 Å²	97	81.3 Å²	81.3	51%	0.508	42%	0.422	S	S	.	.	H	α-helix	trans	-59.6	-46.2	175.9	-174.5	64.4	0	0	0	111.4	S33 S34 S39 Y40 F41	S33-L37 WeakPolarHBondContact O-CB 3.48Å; S33-L37 PolarHBondContact O-N 3.14Å; S34-L37 PolarHBondContact O-N 3.09Å; L37-S39 PolarHBondContact O-N 3.03Å; L37-Y40 PolarHBondContact O-N 3.21Å; L37-Y40 VanDerWaalsContact O-N 3.1Å; L37-F41 HydrophobicContact CD1-CD2 4.03Å; L37-F41 HydrophobicContact CD1-CE2 3.68Å; L37-F41 HydrophobicContact CD2-CE2 4.48Å; L37-F41 HydrophobicContact CG-CD2 4.04Å; L37-F41 HydrophobicContact CG-CE2 3.9Å; L37-F41 WeakPolarHBondContact O-CD2 3.26Å; L37-F41 PolarHBondContact O-N 3.46Å
38	N	95	Very high	90.1	Very high	90 Å²	90	76.9 Å²	76.9	48%	0.481	40%	0.4	S	S	.	.	H	α-helix	trans	-58.5	-35.8	176	-70.4	-21.3	0	0	0	111.9	S34 Q35 L36 F41 E42	S34-N38 WeakPolarHBondContact O-CB 3.35Å; S34-N38 PolarHBondContact O-N 3.34Å; S34-N38 PolarHBondContact O-ND2 2.88Å; Q35-N38 PolarHBondContact O-N 2.82Å; L36-N38 PolarHBondContact O-N 2.81Å; N38-F41 PolarHBondContact O-N 3.24Å; N38-E42 WeakPolarHBondContact O-CB 3.45Å; N38-E42 PolarHBondContact O-N 3.14Å
39	S	97	Very high	91.3	Very high	18 Å²	18	72 Å²	72	13%	0.126	38%	0.379	C	S	.	.	H	α-helix	trans	-66.1	-40	176.2	-61.4	0	0	0	0	112.2	Q35 L36 L37 E42 L43 P114 S119	Q35-S39 PolarHBondContact O-N 3.09Å; Q35-S39 PolarHBondContact O-OG 3.18Å; L36-S39 WeakPolarHBondContact O-CB 3.49Å; L36-S39 PolarHBondContact O-N 3.28Å; L36-S39 VanDerWaalsContact O-N 3.13Å; L37-S39 PolarHBondContact O-N 3.03Å; S39-E42 PolarHBondContact O-N 3.23Å; S39-L43 WeakPolarHBondContact O-CB 3.4Å; S39-L43 PolarHBondContact O-N 2.81Å; S39-P114 VanDerWaalsContact O-CG 3.22Å; S39-P114 WeakPolarHBondContact O-CG 3.45Å; S39-S119 WeakPolarHBondContact CB-OG 3.33Å; S39-S119 PolarHBondContact OG-OG 2.81Å
40	Y	97.9	Very high	92.5	Very high	44 Å²	44	64.3 Å²	64.3	17%	0.173	34%	0.343	C	S	.	.	H	α-helix	trans	-65.7	-39.9	172.6	-72.7	-68	0	0	0	112.1	L36 L37 E42 L43 G44 L120 Q124 F128	L36-Y40 HydrophobicContact CD1-CE2 3.96Å; L36-Y40 HydrophobicContact CD2-CE2 4.4Å; L36-Y40 HydrophobicContact CG-CD2 4.3Å; L36-Y40 HydrophobicContact CG-CE2 3.83Å; L36-Y40 VanDerWaalsContact O-CD2 3.28Å; L36-Y40 WeakPolarHBondContact O-CD2 3.39Å; L36-Y40 PolarHBondContact O-N 3.13Å; L36-Y40 VanDerWaalsContact O-N 3.16Å; L37-Y40 PolarHBondContact O-N 3.21Å; L37-Y40 VanDerWaalsContact O-N 3.1Å; Y40-E42 VanDerWaalsContact C-N 3.33Å; Y40-E42 PolarHBondContact O-N 2.93Å; Y40-L43 PolarHBondContact O-N 3.2Å; Y40-G44 PolarHBondContact O-N 3.32Å; Y40-L120 HydrophobicContact CD1-CD1 3.77Å; Y40-L120 HydrophobicContact CD1-CD2 4.33Å; Y40-L120 HydrophobicContact CD2-CD2 4.39Å; Y40-L120 HydrophobicContact CE1-CD1 3.96Å; Y40-L120 HydrophobicContact CE1-CD2 3.89Å; Y40-L120 HydrophobicContact CE2-CD2 3.99Å; Y40-L120 HydrophobicContact CG-CD1 4.24Å; Y40-Q124 HydrophobicContact CE1-CB 4.44Å; Y40-Q124 WeakPolarHBondContact OH-CB 3.44Å; Y40-F128 HydrophobicContact CD1-CB 3.94Å; Y40-F128 AromaticContact CD1-CD1 3.91Å; Y40-F128 HydrophobicContact CD1-CD1 3.91Å; Y40-F128 AromaticContact CD1-CD2 3.98Å; Y40-F128 HydrophobicContact CD1-CD2 3.98Å; Y40-F128 HydrophobicContact CD1-CE1 4.3Å; Y40-F128 HydrophobicContact CD1-CE2 4.41Å; Y40-F128 AromaticContact CD1-CG 3.7Å; Y40-F128 HydrophobicContact CD1-CG 3.7Å; Y40-F128 HydrophobicContact CE1-CB 3.85Å; Y40-F128 HydrophobicContact CE1-CG 4.14Å; Y40-F128 WeakPolarHBondContact O-CE1 3.44Å; Y40-F128 WeakPolarHBondContact O-CZ 3.36Å
41	F	96.9	Very high	93.5	Very high	101 Å²	101	61.2 Å²	61.2	44%	0.443	32%	0.324	S	S	.	.	H	α-helix	trans	-63.8	-39	176.9	-88.3	-115.6	0	0	0	112.8	L37 N38 R45 F46	L37-F41 HydrophobicContact CD1-CD2 4.03Å; L37-F41 HydrophobicContact CD1-CE2 3.68Å; L37-F41 HydrophobicContact CD2-CE2 4.48Å; L37-F41 HydrophobicContact CG-CD2 4.04Å; L37-F41 HydrophobicContact CG-CE2 3.9Å; L37-F41 WeakPolarHBondContact O-CD2 3.26Å; L37-F41 PolarHBondContact O-N 3.46Å; N38-F41 PolarHBondContact O-N 3.24Å; F41-R45 PolarHBondContact O-N 3.22Å; F41-R45 VanDerWaalsContact O-N 3.12Å; F41-F46 HydrophobicContact CB-CD2 4.33Å; F41-F46 HydrophobicContact CD1-CB 3.94Å; F41-F46 AromaticContact CD1-CD2 3.97Å; F41-F46 HydrophobicContact CD1-CD2 3.97Å; F41-F46 HydrophobicContact CD1-CG 4.41Å; F41-F46 HydrophobicContact CD2-CD2 4.45Å; F41-F46 HydrophobicContact CE1-CB 4.5Å; F41-F46 HydrophobicContact CE1-CD2 4.39Å; F41-F46 HydrophobicContact CG-CD2 4Å; F41-F46 PolarHBondContact O-N 2.83Å
42	E	96.9	Very high	94.2	Very high	48 Å²	48	59.1 Å²	59.1	22%	0.224	31%	0.309	C	S	.	.	H	α-helix	trans	-70.7	-41.6	176.1	-174.3	59.4	-158.8	0	0	111.6	N38 S39 Y40 G44 R45 R48 P114	N38-E42 WeakPolarHBondContact O-CB 3.45Å; N38-E42 PolarHBondContact O-N 3.14Å; S39-E42 PolarHBondContact O-N 3.23Å; Y40-E42 VanDerWaalsContact C-N 3.33Å; Y40-E42 PolarHBondContact O-N 2.93Å; E42-G44 VanDerWaalsContact C-N 3.32Å; E42-G44 PolarHBondContact O-N 2.75Å; E42-R45 WeakPolarHBondContact O-CD 3.26Å; E42-R45 PolarHBondContact O-N 2.87Å; E42-R45 VanDerWaalsContact O-N 3.1Å; E42-R45 PolarHBondContact O-NH1 3.4Å; E42-R45 IonicContact OE1-NH1 3.78Å; E42-R45 PolarHBondContact OE1-NH1 3.24Å; E42-R48 IonicContact OE1-CZ 3.21Å; E42-R48 VanDerWaalsContact OE1-CZ 3.26Å; E42-R48 IonicContact OE1-NE 3.09Å; E42-R48 PolarHBondContact OE1-NE 3.43Å; E42-R48 IonicContact OE1-NH2 3.87Å; E42-R48 PolarHBondContact OE1-NH2 2.88Å; E42-R48 IonicContact OE2-NE 2.71Å; E42-P114 HydrophobicContact CB-CG 4.09Å; E42-P114 HydrophobicContact CG-CG 4.22Å
43	L	98.1	Very high	94.9	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-58.9	-44.2	175.9	-179.4	60.1	0	0	0	111.1	S39 Y40 R45 T94 D97 P114 L115 L120 A125 F128	S39-L43 WeakPolarHBondContact O-CB 3.4Å; S39-L43 PolarHBondContact O-N 2.81Å; Y40-L43 PolarHBondContact O-N 3.2Å; L43-R45 VanDerWaalsContact C-N 3.27Å; L43-R45 PolarHBondContact O-N 3.26Å; L43-T94 HydrophobicContact CD2-CG2 4.1Å; L43-T94 HydrophobicContact CG-CG2 4.34Å; L43-D97 HydrophobicContact CD1-CB 3.94Å; L43-P114 HydrophobicContact CB-CB 4.43Å; L43-P114 HydrophobicContact CB-CG 4.06Å; L43-L115 HydrophobicContact CD1-CD1 4.28Å; L43-L115 HydrophobicContact CD1-CG 4.34Å; L43-L120 HydrophobicContact CB-CD1 4.21Å; L43-L120 HydrophobicContact CD2-CD1 3.68Å; L43-A125 HydrophobicContact CD2-CB 3.93Å; L43-F128 HydrophobicContact CB-CE1 4.31Å; L43-F128 HydrophobicContact CD2-CD1 3.77Å; L43-F128 HydrophobicContact CD2-CE1 4.23Å; L43-F128 HydrophobicContact CG-CD1 4.25Å; L43-F128 HydrophobicContact CG-CE1 4.25Å
44	G	97.5	Very high	95.6	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.01	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-6.3	176.8	0	0	0	0	0	115.5	Y40 E42 F46 S90	Y40-G44 PolarHBondContact O-N 3.32Å; E42-G44 VanDerWaalsContact C-N 3.32Å; E42-G44 PolarHBondContact O-N 2.75Å; G44-F46 PolarHBondContact O-N 3.42Å; G44-S90 WeakPolarHBondContact CA-OG 3.19Å; G44-S90 WeakPolarHBondContact O-CA 3.3Å; G44-S90 WeakPolarHBondContact O-CB 3.36Å; G44-S90 PolarHBondContact O-OG 2.96Å
45	R	97.3	Very high	96.1	Very high	23 Å²	23	50 Å²	50	9%	0.087	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	28	-175.2	-55.6	-64.9	-178	-118	-20.5	114.5	F41 E42 L43 A47 R48 C93 D97 R113	F41-R45 PolarHBondContact O-N 3.22Å; F41-R45 VanDerWaalsContact O-N 3.12Å; E42-R45 WeakPolarHBondContact O-CD 3.26Å; E42-R45 PolarHBondContact O-N 2.87Å; E42-R45 VanDerWaalsContact O-N 3.1Å; E42-R45 PolarHBondContact O-NH1 3.4Å; E42-R45 IonicContact OE1-NH1 3.78Å; E42-R45 PolarHBondContact OE1-NH1 3.24Å; L43-R45 VanDerWaalsContact C-N 3.27Å; L43-R45 PolarHBondContact O-N 3.26Å; R45-A47 PolarHBondContact O-N 3.29Å; R45-R48 HydrophobicContact CB-CB 4.46Å; R45-R48 CarbonylContact O-C 3.58Å; R45-R48 PolarHBondContact O-N 3.11Å; R45-C93 HydrophobicContact CG-CB 4.03Å; R45-C93 VanDerWaalsContact CG-SG 3.6Å; R45-D97 IonicContact CZ-OD2 2.77Å; R45-D97 IonicContact NH2-OD1 3.42Å; R45-D97 PolarHBondContact NH2-OD1 3.31Å; R45-D97 IonicContact NH2-OD2 3Å; R45-D97 PolarHBondContact NH2-OD2 3.23Å; R45-R113 VanDerWaalsContact NH2-CD 3.28Å
46	F	95.5	Very high	96.5	Very high	67 Å²	67	47.2 Å²	47.2	29%	0.294	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-32.1	179.6	-61.5	-52.4	0	0	0	112.7	F41 G44 R48 I86 S90 F128	F41-F46 HydrophobicContact CB-CD2 4.33Å; F41-F46 HydrophobicContact CD1-CB 3.94Å; F41-F46 AromaticContact CD1-CD2 3.97Å; F41-F46 HydrophobicContact CD1-CD2 3.97Å; F41-F46 HydrophobicContact CD1-CG 4.41Å; F41-F46 HydrophobicContact CD2-CD2 4.45Å; F41-F46 HydrophobicContact CE1-CB 4.5Å; F41-F46 HydrophobicContact CE1-CD2 4.39Å; F41-F46 HydrophobicContact CG-CD2 4Å; F41-F46 PolarHBondContact O-N 2.83Å; G44-F46 PolarHBondContact O-N 3.42Å; F46-R48 VanDerWaalsContact C-N 3.26Å; F46-R48 PolarHBondContact O-N 3.36Å; F46-I86 HydrophobicContact CD1-CG2 4.03Å; F46-I86 HydrophobicContact CE1-CG2 3.77Å; F46-S90 WeakPolarHBondContact CZ-OG 3.46Å; F46-F128 AromaticContact CE2-CZ 3.93Å; F46-F128 HydrophobicContact CE2-CZ 3.93Å; F46-F128 HydrophobicContact CZ-CZ 4.31Å
47	A	92.2	Very high	96.8	Very high	75 Å²	75	44.1 Å²	44.1	62%	0.62	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-7.2	174.7	0	0	0	0	0	114	R45 P49	R45-A47 PolarHBondContact O-N 3.29Å; A47-P49 WeakPolarHBondContact O-CD 3.36Å
48	R	90.9	Very high	97	Very high	109 Å²	109	39.5 Å²	39.5	41%	0.411	20%	0.196	S	C	.	.			trans	-126	68.4	-177.5	-56.1	-172.3	-161.1	-155.2	6	110.6	E42 R45 F46 T50	E42-R48 IonicContact OE1-CZ 3.21Å; E42-R48 VanDerWaalsContact OE1-CZ 3.26Å; E42-R48 IonicContact OE1-NE 3.09Å; E42-R48 PolarHBondContact OE1-NE 3.43Å; E42-R48 IonicContact OE1-NH2 3.87Å; E42-R48 PolarHBondContact OE1-NH2 2.88Å; E42-R48 IonicContact OE2-NE 2.71Å; R45-R48 HydrophobicContact CB-CB 4.46Å; R45-R48 CarbonylContact O-C 3.58Å; R45-R48 PolarHBondContact O-N 3.11Å; F46-R48 VanDerWaalsContact C-N 3.26Å; F46-R48 PolarHBondContact O-N 3.36Å; R48-T50 PolarHBondContact O-N 2.91Å
49	P	95.1	Very high	97.2	Very high	59 Å²	59	35.5 Å²	35.5	38%	0.383	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-5.5	-165.5	30.3	-38.1	0	0	0	114.5	A47 G51 T52 W53	A47-P49 WeakPolarHBondContact O-CD 3.36Å; P49-G51 VanDerWaalsContact C-N 3.28Å; P49-G51 PolarHBondContact O-N 2.7Å; P49-T52 WeakPolarHBondContact O-CA 3.43Å; P49-T52 WeakPolarHBondContact O-CB 3.37Å; P49-T52 PolarHBondContact O-N 3.21Å; P49-W53 VanDerWaalsContact O-CD1 3.27Å; P49-W53 PolarHBondContact O-N 3.42Å
50	T	97.6	Very high	97.3	Very high	8 Å²	8	34.8 Å²	34.8	5%	0.049	17%	0.17	C	C	.	.	H	α-helix	trans	-52.5	-46.4	-179.6	-54.2	0	0	0	0	112	R48 T52 W53 L54 F299 K300	R48-T50 PolarHBondContact O-N 2.91Å; T50-T52 VanDerWaalsContact C-N 3.28Å; T50-T52 PolarHBondContact O-N 3.42Å; T50-W53 PolarHBondContact O-N 3.5Å; T50-L54 HydrophobicContact CG2-CD1 4.04Å; T50-L54 HydrophobicContact CG2-CG 4.47Å; T50-L54 VanDerWaalsContact O-CG 3.31Å; T50-L54 WeakPolarHBondContact O-CG 3.44Å; T50-L54 PolarHBondContact O-N 3.36Å; T50-F299 HydrophobicContact CG2-CD1 3.73Å; T50-F299 HydrophobicContact CG2-CE1 3.56Å; T50-F299 HydrophobicContact CG2-CZ 4.34Å; T50-K300 HydrophobicContact CG2-CG 4.47Å
51	G	97.6	Very high	97.3	Very high	3 Å²	3	32.8 Å²	32.8	3%	0.031	16%	0.162	C	C	.	.	H	α-helix	trans	-65.1	-33	178.9	0	0	0	0	0	113	P49 L54 L55	P49-G51 VanDerWaalsContact C-N 3.28Å; P49-G51 PolarHBondContact O-N 2.7Å; G51-L54 PolarHBondContact O-N 2.96Å; G51-L55 PolarHBondContact O-N 3.47Å
52	T	98.6	Very high	97.4	Very high	19 Å²	19	28 Å²	28	12%	0.117	14%	0.141	C	C	.	.	H	α-helix	trans	-67.3	-43.7	175	-55.6	0	0	0	0	111.1	P49 T50 L54 L55 Y56 I86	P49-T52 WeakPolarHBondContact O-CA 3.43Å; P49-T52 WeakPolarHBondContact O-CB 3.37Å; P49-T52 PolarHBondContact O-N 3.21Å; T50-T52 VanDerWaalsContact C-N 3.28Å; T50-T52 PolarHBondContact O-N 3.42Å; T52-L54 VanDerWaalsContact C-N 3.34Å; T52-L54 PolarHBondContact O-N 2.96Å; T52-L55 PolarHBondContact O-N 3.01Å; T52-Y56 VanDerWaalsContact O-CB 3.27Å; T52-Y56 WeakPolarHBondContact O-CB 3.3Å; T52-Y56 PolarHBondContact O-N 2.89Å; T52-I86 HydrophobicContact CG2-CB 4.28Å; T52-I86 HydrophobicContact CG2-CG1 3.65Å
53	W	98.7	Very high	97.5	Very high	97 Å²	97	25.7 Å²	25.7	37%	0.367	13%	0.131	S	C	.	.	H	α-helix	trans	-59.4	-45.4	173.4	-80.1	104.2	0	0	0	111.9	P49 T50 L55 Y56 L57 K303 L307	P49-W53 VanDerWaalsContact O-CD1 3.27Å; P49-W53 PolarHBondContact O-N 3.42Å; T50-W53 PolarHBondContact O-N 3.5Å; W53-L55 VanDerWaalsContact C-N 3.27Å; W53-L55 PolarHBondContact O-N 3.36Å; W53-Y56 HydrophobicContact CE3-CD1 4.17Å; W53-Y56 HydrophobicContact CZ3-CD1 4.09Å; W53-Y56 HydrophobicContact CZ3-CE1 4.33Å; W53-Y56 PolarHBondContact O-N 3.12Å; W53-Y56 VanDerWaalsContact O-N 3.15Å; W53-L57 HydrophobicContact CB-CD1 4.42Å; W53-L57 HydrophobicContact CE3-CD2 4.32Å; W53-L57 HydrophobicContact CE3-CG 4.36Å; W53-L57 WeakPolarHBondContact O-CB 3.44Å; W53-L57 WeakPolarHBondContact O-CD1 3.29Å; W53-L57 WeakPolarHBondContact O-CG 3.42Å; W53-L57 PolarHBondContact O-N 3.19Å; W53-K303 HydrophobicContact CB-CB 4.04Å; W53-L307 HydrophobicContact CZ3-CD2 4.06Å
54	L	98.7	Very high	97.5	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-66.2	-28.7	-179.7	-66.5	171.8	0	0	0	113	T50 G51 T52 P58 F179 W209 Y213 F299	T50-L54 HydrophobicContact CG2-CD1 4.04Å; T50-L54 HydrophobicContact CG2-CG 4.47Å; T50-L54 VanDerWaalsContact O-CG 3.31Å; T50-L54 WeakPolarHBondContact O-CG 3.44Å; T50-L54 PolarHBondContact O-N 3.36Å; G51-L54 PolarHBondContact O-N 2.96Å; T52-L54 VanDerWaalsContact C-N 3.34Å; T52-L54 PolarHBondContact O-N 2.96Å; L54-P58 VanDerWaalsContact O-CD 3.26Å; L54-P58 WeakPolarHBondContact O-CD 3.45Å; L54-F179 HydrophobicContact CB-CD1 4.07Å; L54-F179 HydrophobicContact CB-CE1 3.93Å; L54-W209 HydrophobicContact CD2-CH2 3.61Å; L54-W209 HydrophobicContact CD2-CZ2 3.76Å; L54-W209 HydrophobicContact CD2-CZ3 4.33Å; L54-Y213 HydrophobicContact CD1-CD2 4.02Å; L54-Y213 HydrophobicContact CD1-CE1 4.39Å; L54-Y213 HydrophobicContact CD1-CE2 3.81Å; L54-Y213 HydrophobicContact CD1-CG 4.49Å; L54-Y213 HydrophobicContact CD2-CD1 4.22Å; L54-Y213 HydrophobicContact CD2-CE1 3.94Å; L54-F299 HydrophobicContact CD1-CD2 4.15Å; L54-F299 HydrophobicContact CD1-CE1 4.15Å; L54-F299 HydrophobicContact CD1-CE2 3.51Å; L54-F299 HydrophobicContact CD1-CZ 3.5Å
55	L	98.7	Very high	97.6	Very high	28 Å²	28	26 Å²	26	15%	0.147	13%	0.132	C	C	.	.	H	α-helix	trans	-76.5	-36.5	171.2	-179.5	63	0	0	0	112.2	G51 T52 W53 C59 M88 R89 F179	G51-L55 PolarHBondContact O-N 3.47Å; T52-L55 PolarHBondContact O-N 3.01Å; W53-L55 VanDerWaalsContact C-N 3.27Å; W53-L55 PolarHBondContact O-N 3.36Å; L55-C59 PolarHBondContact O-SG 2.9Å; L55-M88 HydrophobicContact CD2-CB 4.31Å; L55-R89 HydrophobicContact CD2-CB 3.89Å; L55-F179 HydrophobicContact CB-CD1 4.35Å; L55-F179 HydrophobicContact CB-CE1 4.27Å; L55-F179 HydrophobicContact CD1-CD2 4.49Å; L55-F179 HydrophobicContact CD1-CG 4.42Å
56	Y	98.9	Very high	97.6	Very high	39 Å²	39	25.5 Å²	25.5	15%	0.153	13%	0.133	C	C	.	.	H	α-helix	trans	-76.5	-39.5	-175.1	177.5	-129.3	0	0	0	113.4	T52 W53 C59 T60 L78 F81 G82 S85	T52-Y56 VanDerWaalsContact O-CB 3.27Å; T52-Y56 WeakPolarHBondContact O-CB 3.3Å; T52-Y56 PolarHBondContact O-N 2.89Å; W53-Y56 HydrophobicContact CE3-CD1 4.17Å; W53-Y56 HydrophobicContact CZ3-CD1 4.09Å; W53-Y56 HydrophobicContact CZ3-CE1 4.33Å; W53-Y56 PolarHBondContact O-N 3.12Å; W53-Y56 VanDerWaalsContact O-N 3.15Å; Y56-C59 HydrophobicContact CD2-CB 4.39Å; Y56-C59 WeakPolarHBondContact O-CA 3.45Å; Y56-C59 WeakPolarHBondContact O-CB 3.42Å; Y56-C59 PolarHBondContact O-N 3.05Å; Y56-T60 HydrophobicContact CD1-CG2 3.87Å; Y56-T60 HydrophobicContact CD2-CG2 3.93Å; Y56-T60 HydrophobicContact CE1-CG2 3.42Å; Y56-T60 VanDerWaalsContact CE1-CG2 3.42Å; Y56-T60 HydrophobicContact CE2-CG2 3.47Å; Y56-T60 VanDerWaalsContact CE2-CG2 3.47Å; Y56-T60 HydrophobicContact CG-CG2 4.11Å; Y56-T60 PolarHBondContact O-N 3Å; Y56-T60 VanDerWaalsContact O-N 3.16Å; Y56-L78 WeakPolarHBondContact CE2-O 3.15Å; Y56-L78 PolarHBondContact OH-O 2.76Å; Y56-F81 HydrophobicContact CD2-CB 4.28Å; Y56-F81 HydrophobicContact CE2-CB 3.97Å; Y56-G82 VanDerWaalsContact CE2-CA 3.46Å; Y56-G82 VanDerWaalsContact CE2-N 3.26Å; Y56-S85 WeakPolarHBondContact CA-OG 3.38Å
57	L	98.9	Very high	97.7	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-60	-41	-172	-71	161.2	0	0	0	113.8	W53 C59 T60 W61 W209 K303 L307	W53-L57 HydrophobicContact CB-CD1 4.42Å; W53-L57 HydrophobicContact CE3-CD2 4.32Å; W53-L57 HydrophobicContact CE3-CG 4.36Å; W53-L57 WeakPolarHBondContact O-CB 3.44Å; W53-L57 WeakPolarHBondContact O-CD1 3.29Å; W53-L57 WeakPolarHBondContact O-CG 3.42Å; W53-L57 PolarHBondContact O-N 3.19Å; L57-C59 PolarHBondContact O-N 3.22Å; L57-T60 PolarHBondContact O-N 3.15Å; L57-T60 PolarHBondContact O-OG1 3.39Å; L57-W61 HydrophobicContact CB-CZ2 4.13Å; L57-W61 PolarHBondContact O-N 3.17Å; L57-W61 PolarHBondContact O-NE1 2.71Å; L57-W209 HydrophobicContact CB-CH2 4.5Å; L57-W209 HydrophobicContact CD1-CH2 4.22Å; L57-K303 HydrophobicContact CD1-CB 4.37Å; L57-K303 WeakPolarHBondContact CD1-O 3.41Å; L57-L307 HydrophobicContact CD2-CD2 3.71Å; L57-L307 HydrophobicContact CD2-CG 3.95Å
58	P	98.9	Very high	97.9	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-58.7	-31.1	172.3	-26.8	36.9	0	0	0	114.2	L54 W61 S62 N180 G182 A183 W209	L54-P58 VanDerWaalsContact O-CD 3.26Å; L54-P58 WeakPolarHBondContact O-CD 3.45Å; P58-W61 HydrophobicContact CB-CE3 4.1Å; P58-W61 HydrophobicContact CB-CZ3 4.2Å; P58-W61 HydrophobicContact CG-CE3 4.36Å; P58-W61 HydrophobicContact CG-CH2 4.25Å; P58-W61 HydrophobicContact CG-CZ3 4.05Å; P58-S62 PolarHBondContact O-N 3.24Å; P58-S62 PolarHBondContact O-OG 3.02Å; P58-N180 VanDerWaalsContact CG-OD1 3.25Å; P58-N180 WeakPolarHBondContact CG-OD1 3.32Å; P58-G182 CarbonylContact O-C 3.38Å; P58-A183 WeakPolarHBondContact O-CA 3.32Å; P58-A183 PolarHBondContact O-N 3.37Å; P58-W209 HydrophobicContact CG-CZ3 4.46Å
59	C	98.9	Very high	98.1	Very high	6 Å²	6	21.1 Å²	21.1	4%	0.041	12%	0.119	C	C	.	.	H	α-helix	trans	-65.8	-45	172.1	-46.9	0	0	0	0	110.9	L55 Y56 L57 W61 S62 I63 F81 G182	L55-C59 PolarHBondContact O-SG 2.9Å; Y56-C59 HydrophobicContact CD2-CB 4.39Å; Y56-C59 WeakPolarHBondContact O-CA 3.45Å; Y56-C59 WeakPolarHBondContact O-CB 3.42Å; Y56-C59 PolarHBondContact O-N 3.05Å; L57-C59 PolarHBondContact O-N 3.22Å; C59-W61 VanDerWaalsContact C-N 3.33Å; C59-W61 PolarHBondContact O-N 3.24Å; C59-S62 PolarHBondContact O-N 3.03Å; C59-S62 PolarHBondContact O-OG 3.06Å; C59-I63 WeakPolarHBondContact O-CB 3.46Å; C59-I63 WeakPolarHBondContact O-CD1 3.07Å; C59-I63 WeakPolarHBondContact O-CG1 3.23Å; C59-I63 PolarHBondContact O-N 2.79Å; C59-F81 HydrophobicContact CB-CB 4Å; C59-F81 HydrophobicContact CB-CD1 3.47Å; C59-F81 VanDerWaalsContact CB-CD1 3.47Å; C59-F81 HydrophobicContact CB-CE1 4.22Å; C59-F81 HydrophobicContact CB-CG 4.03Å; C59-G182 WeakPolarHBondContact SG-CA 3.28Å
60	T	98.9	Very high	98.1	Very high	3 Å²	3	20.3 Å²	20.3	2%	0.018	12%	0.122	C	C	.	.	H	α-helix	trans	-68.3	-34.7	-177.7	73.4	0	0	0	0	112.1	Y56 L57 A64 L78 F310	Y56-T60 HydrophobicContact CD1-CG2 3.87Å; Y56-T60 HydrophobicContact CD2-CG2 3.93Å; Y56-T60 HydrophobicContact CE1-CG2 3.42Å; Y56-T60 VanDerWaalsContact CE1-CG2 3.42Å; Y56-T60 HydrophobicContact CE2-CG2 3.47Å; Y56-T60 VanDerWaalsContact CE2-CG2 3.47Å; Y56-T60 HydrophobicContact CG-CG2 4.11Å; Y56-T60 PolarHBondContact O-N 3Å; Y56-T60 VanDerWaalsContact O-N 3.16Å; L57-T60 PolarHBondContact O-N 3.15Å; L57-T60 PolarHBondContact O-OG1 3.39Å; T60-A64 VanDerWaalsContact O-CB 3.31Å; T60-A64 WeakPolarHBondContact O-CB 3.42Å; T60-A64 PolarHBondContact O-N 3.35Å; T60-L78 HydrophobicContact CG2-CD2 3.72Å; T60-F310 WeakPolarHBondContact O-CE2 3.3Å; T60-F310 WeakPolarHBondContact OG1-CD2 3.43Å; T60-F310 WeakPolarHBondContact OG1-CG 3.2Å
61	W	98.9	Very high	98.1	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.008	14%	0.144	C	C	.	.	H	α-helix	trans	-60.5	-47.6	175.9	-53.7	-21.7	0	0	0	111.8	L57 P58 C59 A64 L65 L202 W209 G306 Y309 I313	L57-W61 HydrophobicContact CB-CZ2 4.13Å; L57-W61 PolarHBondContact O-N 3.17Å; L57-W61 PolarHBondContact O-NE1 2.71Å; P58-W61 HydrophobicContact CB-CE3 4.1Å; P58-W61 HydrophobicContact CB-CZ3 4.2Å; P58-W61 HydrophobicContact CG-CE3 4.36Å; P58-W61 HydrophobicContact CG-CH2 4.25Å; P58-W61 HydrophobicContact CG-CZ3 4.05Å; C59-W61 VanDerWaalsContact C-N 3.33Å; C59-W61 PolarHBondContact O-N 3.24Å; W61-A64 PolarHBondContact O-N 2.92Å; W61-L65 WeakPolarHBondContact O-CB 3.41Å; W61-L65 WeakPolarHBondContact O-CG 3.4Å; W61-L65 PolarHBondContact O-N 3.37Å; W61-L202 HydrophobicContact CB-CD1 4.16Å; W61-L202 HydrophobicContact CB-CD2 4.28Å; W61-L202 HydrophobicContact CE3-CD1 4.03Å; W61-W209 HydrophobicContact CH2-CD2 4.18Å; W61-W209 AromaticContact CH2-CE3 3.33Å; W61-W209 HydrophobicContact CH2-CE3 3.33Å; W61-W209 HydrophobicContact CH2-CH2 4.1Å; W61-W209 AromaticContact CH2-CZ3 3.27Å; W61-W209 HydrophobicContact CH2-CZ3 3.27Å; W61-W209 AromaticContact CZ2-CE3 3.98Å; W61-W209 HydrophobicContact CZ2-CE3 3.98Å; W61-W209 AromaticContact CZ2-CH2 3.87Å; W61-W209 HydrophobicContact CZ2-CH2 3.87Å; W61-W209 AromaticContact CZ2-CZ3 3.46Å; W61-W209 HydrophobicContact CZ2-CZ3 3.46Å; W61-W209 VanDerWaalsContact CZ2-CZ3 3.46Å; W61-W209 HydrophobicContact CZ3-CE3 4.33Å; W61-W209 HydrophobicContact CZ3-CZ3 4.41Å; W61-G306 PolarHBondContact NE1-O 3.41Å; W61-Y309 HydrophobicContact CB-CE1 4.36Å; W61-Y309 AromaticContact CD1-CD1 3.94Å; W61-Y309 AromaticContact CD2-CD1 3.61Å; W61-Y309 HydrophobicContact CD2-CD1 3.61Å; W61-Y309 HydrophobicContact CD2-CE1 4.01Å; W61-Y309 AromaticContact CE2-CD1 3.71Å; W61-Y309 HydrophobicContact CE3-CD1 4.05Å; W61-Y309 HydrophobicContact CE3-CE1 4.14Å; W61-Y309 AromaticContact CG-CD1 3.81Å; W61-Y309 HydrophobicContact CG-CD1 3.81Å; W61-Y309 HydrophobicContact CG-CE1 4.1Å; W61-Y309 HydrophobicContact CZ2-CD1 4.22Å; W61-Y309 HydrophobicContact CZ3-CD1 4.5Å; W61-Y309 AromaticContact NE1-CD1 3.88Å; W61-I313 HydrophobicContact CB-CD1 3.74Å; W61-I313 HydrophobicContact CG-CD1 4.23Å
62	S	98.8	Very high	98.1	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-72.5	-37.8	-177.5	62.4	0	0	0	0	112.4	P58 C59 A64 L65 A66 G182 A183 G186 Y187	P58-S62 PolarHBondContact O-N 3.24Å; P58-S62 PolarHBondContact O-OG 3.02Å; C59-S62 PolarHBondContact O-N 3.03Å; C59-S62 PolarHBondContact O-OG 3.06Å; S62-A64 VanDerWaalsContact C-N 3.33Å; S62-A64 PolarHBondContact O-N 3.47Å; S62-L65 PolarHBondContact O-N 2.97Å; S62-A66 VanDerWaalsContact O-CB 3.26Å; S62-A66 WeakPolarHBondContact O-CB 3.46Å; S62-A66 PolarHBondContact O-N 3.35Å; S62-G182 PolarHBondContact OG-O 3.38Å; S62-A183 WeakPolarHBondContact CB-O 3.39Å; S62-G186 VanDerWaalsContact OG-CA 3.24Å; S62-G186 WeakPolarHBondContact OG-CA 3.49Å; S62-Y187 PolarHBondContact OG-N 3Å
63	I	98.8	Very high	98.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.1	-43.5	172.1	-68	164	0	0	0	110.4	C59 A66 A67 P73 M77 L78 F81 V190	C59-I63 WeakPolarHBondContact O-CB 3.46Å; C59-I63 WeakPolarHBondContact O-CD1 3.07Å; C59-I63 WeakPolarHBondContact O-CG1 3.23Å; C59-I63 PolarHBondContact O-N 2.79Å; I63-A66 PolarHBondContact O-N 2.82Å; I63-A67 PolarHBondContact O-N 2.85Å; I63-P73 HydrophobicContact CG2-CB 3.93Å; I63-M77 HydrophobicContact CD1-CB 4.1Å; I63-M77 HydrophobicContact CG1-CB 4.43Å; I63-M77 HydrophobicContact CG2-CB 4.19Å; I63-L78 HydrophobicContact CB-CD2 4.36Å; I63-L78 HydrophobicContact CD1-CD2 4.12Å; I63-L78 HydrophobicContact CG2-CD2 4.1Å; I63-L78 HydrophobicContact CG2-CG 4.27Å; I63-F81 HydrophobicContact CD1-CB 4.25Å; I63-F81 HydrophobicContact CD1-CD2 3.85Å; I63-F81 HydrophobicContact CD1-CE2 4.3Å; I63-F81 HydrophobicContact CD1-CG 3.99Å; I63-V190 HydrophobicContact CB-CG2 4.41Å; I63-V190 HydrophobicContact CG1-CG2 4.3Å; I63-V190 HydrophobicContact CG2-CG2 4.07Å
64	A	98.7	Very high	98	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-69	-39	177.3	0	0	0	0	0	113	T60 W61 S62 A66 A67 P73 F310 I313 V314 K317	T60-A64 VanDerWaalsContact O-CB 3.31Å; T60-A64 WeakPolarHBondContact O-CB 3.42Å; T60-A64 PolarHBondContact O-N 3.35Å; W61-A64 PolarHBondContact O-N 2.92Å; S62-A64 VanDerWaalsContact C-N 3.33Å; S62-A64 PolarHBondContact O-N 3.47Å; A64-A66 VanDerWaalsContact C-N 3.28Å; A64-A66 PolarHBondContact O-N 3.44Å; A64-A67 WeakPolarHBondContact O-CB 3.49Å; A64-A67 PolarHBondContact O-N 3.34Å; A64-P73 HydrophobicContact CB-CB 4.14Å; A64-P73 HydrophobicContact CB-CG 4.39Å; A64-F310 HydrophobicContact CB-CD2 4.25Å; A64-F310 HydrophobicContact CB-CE2 3.93Å; A64-I313 HydrophobicContact CB-CB 4.25Å; A64-I313 HydrophobicContact CB-CG2 3.52Å; A64-V314 HydrophobicContact CB-CG2 4.05Å; A64-K317 WeakPolarHBondContact O-CE 3.4Å
65	L	98.5	Very high	98	Very high	7 Å²	7	34 Å²	34	4%	0.037	20%	0.196	C	C	.	.	H	α-helix	trans	-65.8	-32.6	174.9	-79	162.8	0	0	0	112.6	W61 S62 A67 Y187 I198 L202 V259 A263 I313 K317	W61-L65 WeakPolarHBondContact O-CB 3.41Å; W61-L65 WeakPolarHBondContact O-CG 3.4Å; W61-L65 PolarHBondContact O-N 3.37Å; S62-L65 PolarHBondContact O-N 2.97Å; L65-A67 VanDerWaalsContact C-N 3.31Å; L65-Y187 HydrophobicContact CB-CE2 4.37Å; L65-I198 HydrophobicContact CB-CG2 4.38Å; L65-I198 HydrophobicContact CD1-CG2 4.18Å; L65-L202 HydrophobicContact CD1-CD1 3.96Å; L65-L202 HydrophobicContact CD1-CD2 3.71Å; L65-L202 HydrophobicContact CD1-CG 4.38Å; L65-V259 HydrophobicContact CD1-CG1 3.65Å; L65-V259 HydrophobicContact CD2-CG1 4.03Å; L65-A263 HydrophobicContact CD2-CB 4.25Å; L65-I313 HydrophobicContact CD1-CD1 4.09Å; L65-I313 HydrophobicContact CD2-CG1 4.46Å; L65-I313 HydrophobicContact CD2-CG2 3.96Å; L65-I313 HydrophobicContact CG-CD1 4.07Å; L65-I313 HydrophobicContact CG-CG1 4.33Å; L65-I313 HydrophobicContact CG-CG2 3.78Å; L65-K317 VanDerWaalsContact O-CE 3.3Å; L65-K317 WeakPolarHBondContact O-CE 3.17Å; L65-K317 PolarHBondContact O-NZ 3.46Å
66	A	98.1	Very high	98	Very high	13 Å²	13	38.2 Å²	38.2	11%	0.107	21%	0.21	C	C	.	.	H	α-helix	trans	-75.1	-17.7	176.6	0	0	0	0	0	113.7	S62 I63 A64 Y187 V190 T191	S62-A66 VanDerWaalsContact O-CB 3.26Å; S62-A66 WeakPolarHBondContact O-CB 3.46Å; S62-A66 PolarHBondContact O-N 3.35Å; I63-A66 PolarHBondContact O-N 2.82Å; A64-A66 VanDerWaalsContact C-N 3.28Å; A64-A66 PolarHBondContact O-N 3.44Å; A66-Y187 HydrophobicContact CB-CD2 3.77Å; A66-Y187 HydrophobicContact CB-CE2 3.9Å; A66-Y187 HydrophobicContact CB-CG 4.14Å; A66-V190 HydrophobicContact CB-CB 3.71Å; A66-V190 HydrophobicContact CB-CG1 3.74Å; A66-V190 HydrophobicContact CB-CG2 4.15Å; A66-T191 HydrophobicContact CB-CG2 3.93Å
67	A	97.6	Very high	98	Very high	5 Å²	5	37.5 Å²	37.5	4%	0.041	21%	0.209	C	C	.	.	S	Bend	trans	-63.2	142.3	176.1	0	0	0	0	0	110.9	I63 A64 L65 K317	I63-A67 PolarHBondContact O-N 2.85Å; A64-A67 WeakPolarHBondContact O-CB 3.49Å; A64-A67 PolarHBondContact O-N 3.34Å; L65-A67 VanDerWaalsContact C-N 3.31Å; A67-K317 WeakPolarHBondContact O-CE 3.5Å; A67-K317 PolarHBondContact O-NZ 3.11Å
68	P	95.5	Very high	98	Very high	75 Å²	75	38.4 Å²	38.4	49%	0.487	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-58.4	154	171.7	-22.4	33.3	0	0	0	111.9	H71	P68-H71 HydrophobicContact CB-CB 4.49Å; P68-H71 WeakPolarHBondContact O-CB 3.43Å; P68-H71 PolarHBondContact O-N 3.14Å
69	P	95.9	Very high	98	Very high	78 Å²	78	42.1 Å²	42.1	51%	0.506	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	144.3	167.9	-25.6	35.7	0	0	0	112	H71 L320	P69-H71 PolarHBondContact O-N 2.81Å; P69-H71 PolarHBondContact O-ND1 3.4Å; P69-L320 HydrophobicContact CB-CB 3.96Å
70	G	96	Very high	98	Very high	43 Å²	43	42.3 Å²	42.3	44%	0.443	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	-0.3	-176	0	0	0	0	0	115.6	K317 L320	G70-K317 WeakPolarHBondContact CA-O 3.42Å; G70-K317 PolarHBondContact N-O 2.95Å; G70-L320 WeakPolarHBondContact CA-OXT 3.38Å; G70-L320 PolarHBondContact N-OXT 3.44Å
71	H	97	Very high	98	Very high	110 Å²	110	42.9 Å²	42.9	51%	0.509	24%	0.239	S	C	.	.			trans	-113.7	147.9	-174.3	-65.5	67	0	0	0	112.9	P68 P69	P68-H71 HydrophobicContact CB-CB 4.49Å; P68-H71 WeakPolarHBondContact O-CB 3.43Å; P68-H71 PolarHBondContact O-N 3.14Å; P69-H71 PolarHBondContact O-N 2.81Å; P69-H71 PolarHBondContact O-ND1 3.4Å
72	L	97.9	Very high	97.9	Very high	109 Å²	109	43.6 Å²	43.6	57%	0.571	25%	0.247	S	C	*	.	P	Polyproline II helix	trans	-72.6	154.6	166.6	-74.3	171.3	0	0	0	111	V314 I318	L72-V314 HydrophobicContact CD2-CG1 3.74Å; L72-I318 HydrophobicContact CD2-CD1 3.58Å; L72-I318 HydrophobicContact CD2-CG1 4.21Å; L72-I318 HydrophobicContact CG-CD1 4.39Å
73	P	98	Very high	97.9	Very high	9 Å²	9	46.7 Å²	46.7	6%	0.058	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-57.2	144.2	169.4	23	-33	0	0	0	111.5	I63 A64 I75 L78 F310 V314	I63-P73 HydrophobicContact CG2-CB 3.93Å; A64-P73 HydrophobicContact CB-CB 4.14Å; A64-P73 HydrophobicContact CB-CG 4.39Å; P73-I75 PolarHBondContact O-N 3.33Å; P73-I75 VanDerWaalsContact O-N 3.14Å; P73-L78 HydrophobicContact CB-CD1 3.95Å; P73-L78 HydrophobicContact CB-CG 4.33Å; P73-L78 HydrophobicContact CG-CD1 3.84Å; P73-F310 HydrophobicContact CG-CE2 4.25Å; P73-F310 HydrophobicContact CG-CZ 4.08Å; P73-V314 HydrophobicContact CG-CG2 4Å
74	D	97.4	Very high	97.9	Very high	73 Å²	73	47.3 Å²	47.3	39%	0.39	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-58.8	116.1	178.3	-176.3	-52.8	0	0	0	111.1	Y76 M77 L78	D74-Y76 VanDerWaalsContact C-N 3.31Å; D74-Y76 PolarHBondContact O-N 3.28Å; D74-Y76 WeakPolarHBondContact OD1-CA 3.37Å; D74-Y76 VanDerWaalsContact OD1-CB 3.27Å; D74-Y76 WeakPolarHBondContact OD1-CB 3.44Å; D74-Y76 PolarHBondContact OD1-N 2.98Å; D74-M77 HydrophobicContact CB-CB 4.05Å; D74-M77 HydrophobicContact CB-CG 4Å; D74-M77 PolarHBondContact O-N 2.98Å; D74-M77 PolarHBondContact OD1-N 3.35Å; D74-L78 WeakPolarHBondContact O-CG 3.36Å; D74-L78 PolarHBondContact O-N 2.86Å
75	I	98	Very high	97.9	Very high	114 Å²	114	47.6 Å²	47.6	59%	0.585	27%	0.274	S	S	*	.	H	α-helix	trans	-67.2	-32.7	-176.2	-57.5	-58.2	0	0	0	111.9	P73 L78 T79	P73-I75 PolarHBondContact O-N 3.33Å; P73-I75 VanDerWaalsContact O-N 3.14Å; I75-L78 HydrophobicContact CD1-CD1 4.24Å; I75-T79 WeakPolarHBondContact O-CB 3.45Å; I75-T79 PolarHBondContact O-N 2.84Å; I75-T79 PolarHBondContact O-OG1 2.92Å
76	Y	98.5	Very high	97.9	Very high	115 Å²	115	51 Å²	51	45%	0.451	29%	0.291	S	S	.	.	H	α-helix	trans	-67.9	-44.6	177.2	172.7	-109.7	0	0	0	110.2	D74 T79 L80 Q142	D74-Y76 VanDerWaalsContact C-N 3.31Å; D74-Y76 PolarHBondContact O-N 3.28Å; D74-Y76 WeakPolarHBondContact OD1-CA 3.37Å; D74-Y76 VanDerWaalsContact OD1-CB 3.27Å; D74-Y76 WeakPolarHBondContact OD1-CB 3.44Å; D74-Y76 PolarHBondContact OD1-N 2.98Å; Y76-T79 WeakPolarHBondContact O-CB 3.16Å; Y76-T79 PolarHBondContact O-N 3.03Å; Y76-T79 VanDerWaalsContact O-N 3.17Å; Y76-L80 HydrophobicContact CD1-CD1 4.24Å; Y76-L80 HydrophobicContact CD2-CG 4.46Å; Y76-L80 HydrophobicContact CE1-CD1 3.59Å; Y76-L80 HydrophobicContact CE1-CG 4.25Å; Y76-L80 HydrophobicContact CE2-CD1 4.2Å; Y76-L80 HydrophobicContact CE2-CD2 4.08Å; Y76-L80 HydrophobicContact CE2-CG 4.06Å; Y76-L80 PolarHBondContact O-N 3.4Å; Y76-Q142 PolarHBondContact OH-OE1 3.04Å
77	M	98.6	Very high	98	Very high	25 Å²	25	51.7 Å²	51.7	12%	0.123	29%	0.293	C	S	.	.	H	α-helix	trans	-62.4	-45.5	173.7	-67	-63	161.9	0	0	111.8	I63 D74 T79 L80 F81 L143 A189 V190	I63-M77 HydrophobicContact CD1-CB 4.1Å; I63-M77 HydrophobicContact CG1-CB 4.43Å; I63-M77 HydrophobicContact CG2-CB 4.19Å; D74-M77 HydrophobicContact CB-CB 4.05Å; D74-M77 HydrophobicContact CB-CG 4Å; D74-M77 PolarHBondContact O-N 2.98Å; D74-M77 PolarHBondContact OD1-N 3.35Å; M77-T79 PolarHBondContact O-N 3.35Å; M77-L80 PolarHBondContact O-N 2.97Å; M77-F81 VanDerWaalsContact O-CD2 3.25Å; M77-F81 WeakPolarHBondContact O-CD2 3.41Å; M77-F81 PolarHBondContact O-N 3.48Å; M77-L143 HydrophobicContact SD-CD2 3.98Å; M77-A189 HydrophobicContact SD-CB 3.99Å; M77-V190 HydrophobicContact CG-CG2 4.22Å
78	L	98.8	Very high	98	Very high	19 Å²	19	53.4 Å²	53.4	10%	0.099	30%	0.301	C	S	.	.	H	α-helix	trans	-56.2	-41	174	-71.7	178.4	0	0	0	111.6	Y56 T60 I63 P73 D74 I75 G82 F310	Y56-L78 WeakPolarHBondContact CE2-O 3.15Å; Y56-L78 PolarHBondContact OH-O 2.76Å; T60-L78 HydrophobicContact CG2-CD2 3.72Å; I63-L78 HydrophobicContact CB-CD2 4.36Å; I63-L78 HydrophobicContact CD1-CD2 4.12Å; I63-L78 HydrophobicContact CG2-CD2 4.1Å; I63-L78 HydrophobicContact CG2-CG 4.27Å; P73-L78 HydrophobicContact CB-CD1 3.95Å; P73-L78 HydrophobicContact CB-CG 4.33Å; P73-L78 HydrophobicContact CG-CD1 3.84Å; D74-L78 WeakPolarHBondContact O-CG 3.36Å; D74-L78 PolarHBondContact O-N 2.86Å; I75-L78 HydrophobicContact CD1-CD1 4.24Å; L78-G82 PolarHBondContact O-N 3.41Å; L78-F310 HydrophobicContact CD1-CZ 4.35Å; L78-F310 HydrophobicContact CD2-CE2 4.47Å; L78-F310 HydrophobicContact CD2-CZ 4.49Å
79	T	98.8	Very high	98.1	Very high	78 Å²	78	52.4 Å²	52.4	48%	0.479	29%	0.287	S	S	.	.	H	α-helix	trans	-66.4	-49.2	179	-58.3	0	0	0	0	111.9	I75 Y76 M77 F81 G82 V83	I75-T79 WeakPolarHBondContact O-CB 3.45Å; I75-T79 PolarHBondContact O-N 2.84Å; I75-T79 PolarHBondContact O-OG1 2.92Å; Y76-T79 WeakPolarHBondContact O-CB 3.16Å; Y76-T79 PolarHBondContact O-N 3.03Å; Y76-T79 VanDerWaalsContact O-N 3.17Å; M77-T79 PolarHBondContact O-N 3.35Å; T79-F81 VanDerWaalsContact C-N 3.35Å; T79-F81 PolarHBondContact O-N 3.49Å; T79-G82 PolarHBondContact O-N 3.41Å; T79-V83 WeakPolarHBondContact O-CG2 3.41Å; T79-V83 PolarHBondContact O-N 2.78Å
80	L	98.7	Very high	98.2	Very high	11 Å²	11	48.7 Å²	48.7	6%	0.058	26%	0.263	C	S	.	.	H	α-helix	trans	-58.6	-46.5	178	-70.6	-174.4	0	0	0	111.6	Y76 M77 G82 V83 G84 I139 Q142 L143	Y76-L80 HydrophobicContact CD1-CD1 4.24Å; Y76-L80 HydrophobicContact CD2-CG 4.46Å; Y76-L80 HydrophobicContact CE1-CD1 3.59Å; Y76-L80 HydrophobicContact CE1-CG 4.25Å; Y76-L80 HydrophobicContact CE2-CD1 4.2Å; Y76-L80 HydrophobicContact CE2-CD2 4.08Å; Y76-L80 HydrophobicContact CE2-CG 4.06Å; Y76-L80 PolarHBondContact O-N 3.4Å; M77-L80 PolarHBondContact O-N 2.97Å; L80-G82 VanDerWaalsContact C-N 3.33Å; L80-G82 PolarHBondContact O-N 2.94Å; L80-V83 PolarHBondContact O-N 3.22Å; L80-G84 PolarHBondContact O-N 3.39Å; L80-I139 HydrophobicContact CB-CG2 4.18Å; L80-I139 HydrophobicContact CD2-CD1 4.31Å; L80-I139 HydrophobicContact CD2-CG2 4.24Å; L80-Q142 HydrophobicContact CD1-CB 4.06Å; L80-L143 HydrophobicContact CD1-CD2 3.8Å
81	F	98.7	Very high	98.4	Very high	14 Å²	14	46.7 Å²	46.7	6%	0.061	24%	0.242	C	C	.	.	H	α-helix	trans	-70.3	-29.7	178.6	-81.5	-102.4	0	0	0	112.5	Y56 C59 I63 M77 T79 S85 L143 L185 A189	Y56-F81 HydrophobicContact CD2-CB 4.28Å; Y56-F81 HydrophobicContact CE2-CB 3.97Å; C59-F81 HydrophobicContact CB-CB 4Å; C59-F81 HydrophobicContact CB-CD1 3.47Å; C59-F81 VanDerWaalsContact CB-CD1 3.47Å; C59-F81 HydrophobicContact CB-CE1 4.22Å; C59-F81 HydrophobicContact CB-CG 4.03Å; I63-F81 HydrophobicContact CD1-CB 4.25Å; I63-F81 HydrophobicContact CD1-CD2 3.85Å; I63-F81 HydrophobicContact CD1-CE2 4.3Å; I63-F81 HydrophobicContact CD1-CG 3.99Å; M77-F81 VanDerWaalsContact O-CD2 3.25Å; M77-F81 WeakPolarHBondContact O-CD2 3.41Å; M77-F81 PolarHBondContact O-N 3.48Å; T79-F81 VanDerWaalsContact C-N 3.35Å; T79-F81 PolarHBondContact O-N 3.49Å; F81-S85 WeakPolarHBondContact O-CB 3.39Å; F81-S85 PolarHBondContact O-N 3.09Å; F81-S85 PolarHBondContact O-OG 3.39Å; F81-L143 HydrophobicContact CE2-CD1 4.01Å; F81-L143 HydrophobicContact CE2-CD2 4.19Å; F81-L143 HydrophobicContact CZ-CD1 3.99Å; F81-L185 HydrophobicContact CE1-CB 4.1Å; F81-L185 HydrophobicContact CE1-CD2 3.93Å; F81-L185 HydrophobicContact CE1-CG 3.74Å; F81-L185 HydrophobicContact CZ-CB 4.41Å; F81-L185 HydrophobicContact CZ-CD2 4.31Å; F81-L185 HydrophobicContact CZ-CG 3.79Å; F81-A189 HydrophobicContact CE2-CB 3.61Å; F81-A189 HydrophobicContact CZ-CB 3.73Å
82	G	98.7	Very high	98.4	Very high	17 Å²	17	42.3 Å²	42.3	18%	0.175	23%	0.227	C	C	.	.	H	α-helix	trans	-64.2	-51.9	173.4	0	0	0	0	0	111.7	Y56 L78 T79 L80 S85 I86	Y56-G82 VanDerWaalsContact CE2-CA 3.46Å; Y56-G82 VanDerWaalsContact CE2-N 3.26Å; L78-G82 PolarHBondContact O-N 3.41Å; T79-G82 PolarHBondContact O-N 3.41Å; L80-G82 VanDerWaalsContact C-N 3.33Å; L80-G82 PolarHBondContact O-N 2.94Å; G82-S85 PolarHBondContact O-N 3.46Å; G82-I86 WeakPolarHBondContact O-CG1 3.27Å; G82-I86 PolarHBondContact O-N 3.11Å; G82-I86 VanDerWaalsContact O-N 3.12Å
83	V	98.6	Very high	98.4	Very high	65 Å²	65	37.5 Å²	37.5	39%	0.394	20%	0.202	S	C	.	.	H	α-helix	trans	-63.7	-45.5	176.4	178	0	0	0	0	110.8	T79 L80 S85 I86 L87 I139	T79-V83 WeakPolarHBondContact O-CG2 3.41Å; T79-V83 PolarHBondContact O-N 2.78Å; L80-V83 PolarHBondContact O-N 3.22Å; V83-S85 VanDerWaalsContact C-N 3.31Å; V83-S85 PolarHBondContact O-N 3.39Å; V83-I86 WeakPolarHBondContact O-CB 3.5Å; V83-I86 PolarHBondContact O-N 2.65Å; V83-L87 HydrophobicContact CG1-CD1 4.1Å; V83-L87 WeakPolarHBondContact O-CG 3.44Å; V83-L87 PolarHBondContact O-N 3.23Å; V83-L87 VanDerWaalsContact O-N 3.1Å; V83-I139 HydrophobicContact CG1-CD1 4.33Å; V83-I139 HydrophobicContact CG1-CG1 4.43Å
84	G	98.5	Very high	98.5	Very high	13 Å²	13	37 Å²	37	13%	0.134	20%	0.2	C	C	.	.	H	α-helix	trans	-58.4	-40.7	175.9	0	0	0	0	0	112.6	L80 L87 M88	L80-G84 PolarHBondContact O-N 3.39Å; G84-L87 PolarHBondContact O-N 3.03Å; G84-M88 VanDerWaalsContact O-CB 3.27Å; G84-M88 WeakPolarHBondContact O-CB 3.32Å; G84-M88 WeakPolarHBondContact O-CG 3.41Å; G84-M88 PolarHBondContact O-N 2.87Å
85	S	98.7	Very high	98.5	Very high	6 Å²	6	34.2 Å²	34.2	4%	0.042	18%	0.184	C	C	.	.	H	α-helix	trans	-67	-37.1	177.4	-61.9	0	0	0	0	112.3	Y56 F81 G82 V83 R89	Y56-S85 WeakPolarHBondContact CA-OG 3.38Å; F81-S85 WeakPolarHBondContact O-CB 3.39Å; F81-S85 PolarHBondContact O-N 3.09Å; F81-S85 PolarHBondContact O-OG 3.39Å; G82-S85 PolarHBondContact O-N 3.46Å; V83-S85 VanDerWaalsContact C-N 3.31Å; V83-S85 PolarHBondContact O-N 3.39Å; S85-R89 WeakPolarHBondContact O-CB 3.09Å; S85-R89 PolarHBondContact O-N 3.04Å
86	I	98.7	Very high	98.5	Very high	78 Å²	78	29.6 Å²	29.6	40%	0.4	16%	0.161	S	C	.	.	H	α-helix	trans	-59.7	-50.3	173.5	-68.5	162.3	0	0	0	110	F46 T52 G82 V83 S90	F46-I86 HydrophobicContact CD1-CG2 4.03Å; F46-I86 HydrophobicContact CE1-CG2 3.77Å; T52-I86 HydrophobicContact CG2-CB 4.28Å; T52-I86 HydrophobicContact CG2-CG1 3.65Å; G82-I86 WeakPolarHBondContact O-CG1 3.27Å; G82-I86 PolarHBondContact O-N 3.11Å; G82-I86 VanDerWaalsContact O-N 3.12Å; V83-I86 WeakPolarHBondContact O-CB 3.5Å; V83-I86 PolarHBondContact O-N 2.65Å; I86-S90 VanDerWaalsContact O-CB 3.3Å; I86-S90 WeakPolarHBondContact O-CB 3.24Å; I86-S90 PolarHBondContact O-N 2.99Å
87	L	98.5	Very high	98.5	Very high	28 Å²	28	24.1 Å²	24.1	15%	0.147	14%	0.139	C	C	.	.	H	α-helix	trans	-68.6	-46.7	-177.3	-64.4	169	0	0	0	112.3	V83 G84 S90 A91 T135 S136 I139	V83-L87 HydrophobicContact CG1-CD1 4.1Å; V83-L87 WeakPolarHBondContact O-CG 3.44Å; V83-L87 PolarHBondContact O-N 3.23Å; V83-L87 VanDerWaalsContact O-N 3.1Å; G84-L87 PolarHBondContact O-N 3.03Å; L87-S90 WeakPolarHBondContact O-CB 3.27Å; L87-S90 PolarHBondContact O-N 3.45Å; L87-A91 PolarHBondContact O-N 3.49Å; L87-T135 HydrophobicContact CD1-CG2 3.65Å; L87-T135 HydrophobicContact CD2-CG2 4.31Å; L87-S136 WeakPolarHBondContact CB-OG 3.46Å; L87-I139 HydrophobicContact CD1-CG1 4.47Å
88	M	98.3	Very high	98.5	Very high	42 Å²	42	24.2 Å²	24.2	21%	0.207	14%	0.14	C	C	.	.	H	α-helix	trans	-73.1	-33	-177.2	-71.2	-55.1	-63.4	0	0	112.9	L55 G84 S90 A91 G92 L133 S136 L155	L55-M88 HydrophobicContact CD2-CB 4.31Å; G84-M88 VanDerWaalsContact O-CB 3.27Å; G84-M88 WeakPolarHBondContact O-CB 3.32Å; G84-M88 WeakPolarHBondContact O-CG 3.41Å; G84-M88 PolarHBondContact O-N 2.87Å; M88-S90 VanDerWaalsContact C-N 3.31Å; M88-A91 PolarHBondContact O-N 2.95Å; M88-G92 PolarHBondContact O-N 3.3Å; M88-L133 HydrophobicContact CE-CD2 4.32Å; M88-L133 HydrophobicContact SD-CD2 4.17Å; M88-S136 VanDerWaalsContact SD-CB 3.57Å; M88-S136 PolarHBondContact SD-OG 3.33Å; M88-S136 VanDerWaalsContact SD-OG 3.32Å; M88-L155 HydrophobicContact CE-CD2 3.79Å
89	R	98.2	Very high	98.4	Very high	54 Å²	54	28.2 Å²	28.2	20%	0.204	15%	0.154	C	C	.	.	H	α-helix	trans	-61.9	-44.6	169.1	177.2	56.9	-178.6	166.8	-6.4	110.6	L55 S85 G92 C93 F179	L55-R89 HydrophobicContact CD2-CB 3.89Å; S85-R89 WeakPolarHBondContact O-CB 3.09Å; S85-R89 PolarHBondContact O-N 3.04Å; R89-G92 PolarHBondContact O-N 3.47Å; R89-C93 PolarHBondContact O-N 3.3Å; R89-C93 PolarHBondContact O-SG 3.05Å; R89-F179 VanDerWaalsContact NH1-CZ 3.28Å
90	S	98.6	Very high	98.3	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62.3	-43.4	178.4	-172.5	0	0	0	0	112.1	G44 F46 I86 L87 M88 C93 T94 Q132	G44-S90 WeakPolarHBondContact CA-OG 3.19Å; G44-S90 WeakPolarHBondContact O-CA 3.3Å; G44-S90 WeakPolarHBondContact O-CB 3.36Å; G44-S90 PolarHBondContact O-OG 2.96Å; F46-S90 WeakPolarHBondContact CZ-OG 3.46Å; I86-S90 VanDerWaalsContact O-CB 3.3Å; I86-S90 WeakPolarHBondContact O-CB 3.24Å; I86-S90 PolarHBondContact O-N 2.99Å; L87-S90 WeakPolarHBondContact O-CB 3.27Å; L87-S90 PolarHBondContact O-N 3.45Å; M88-S90 VanDerWaalsContact C-N 3.31Å; S90-C93 PolarHBondContact O-N 3.42Å; S90-T94 PolarHBondContact O-N 3.24Å; S90-T94 PolarHBondContact O-OG1 3.44Å; S90-Q132 PolarHBondContact OG-NE2 2.81Å
91	A	98.7	Very high	98.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.1	-47.5	174.4	0	0	0	0	0	112.3	L87 M88 C93 T94 I95 L129 Q132 L133	L87-A91 PolarHBondContact O-N 3.49Å; M88-A91 PolarHBondContact O-N 2.95Å; A91-C93 VanDerWaalsContact C-N 3.32Å; A91-C93 PolarHBondContact O-N 3.35Å; A91-T94 WeakPolarHBondContact O-CB 3.43Å; A91-T94 PolarHBondContact O-N 2.97Å; A91-T94 VanDerWaalsContact O-N 3.11Å; A91-I95 WeakPolarHBondContact O-CG1 3.41Å; A91-I95 PolarHBondContact O-N 3.5Å; A91-L129 HydrophobicContact CB-CD1 3.76Å; A91-Q132 HydrophobicContact CB-CB 4.17Å; A91-L133 HydrophobicContact CB-CD2 3.95Å; A91-L133 HydrophobicContact CB-CG 4.49Å
92	G	98.3	Very high	98.2	Very high	19 Å²	19	35.4 Å²	35.4	20%	0.196	18%	0.178	C	C	.	.	H	α-helix	trans	-59.8	-40.6	176.3	0	0	0	0	0	112.7	M88 R89 N96	M88-G92 PolarHBondContact O-N 3.3Å; R89-G92 PolarHBondContact O-N 3.47Å; G92-N96 VanDerWaalsContact O-CB 3.26Å; G92-N96 WeakPolarHBondContact O-CB 3.31Å; G92-N96 PolarHBondContact O-N 3.1Å
93	C	98.1	Very high	98.1	Very high	7 Å²	7	38.2 Å²	38.2	5%	0.047	18%	0.184	C	C	.	.	H	α-helix	trans	-64.9	-39.5	173.6	-75.1	0	0	0	0	112.7	R45 R89 S90 A91 N96 D97	R45-C93 HydrophobicContact CG-CB 4.03Å; R45-C93 VanDerWaalsContact CG-SG 3.6Å; R89-C93 PolarHBondContact O-N 3.3Å; R89-C93 PolarHBondContact O-SG 3.05Å; S90-C93 PolarHBondContact O-N 3.42Å; A91-C93 VanDerWaalsContact C-N 3.32Å; A91-C93 PolarHBondContact O-N 3.35Å; C93-N96 PolarHBondContact O-N 3.37Å; C93-D97 WeakPolarHBondContact O-CB 3.19Å; C93-D97 PolarHBondContact O-N 3.41Å
94	T	98.6	Very high	98	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.8	-48.1	177.4	-56.5	0	0	0	0	110.9	L43 S90 A91 N96 D97 M98 A125 L129 Q132	L43-T94 HydrophobicContact CD2-CG2 4.1Å; L43-T94 HydrophobicContact CG-CG2 4.34Å; S90-T94 PolarHBondContact O-N 3.24Å; S90-T94 PolarHBondContact O-OG1 3.44Å; A91-T94 WeakPolarHBondContact O-CB 3.43Å; A91-T94 PolarHBondContact O-N 2.97Å; A91-T94 VanDerWaalsContact O-N 3.11Å; T94-N96 VanDerWaalsContact C-N 3.32Å; T94-N96 PolarHBondContact O-N 2.6Å; T94-D97 PolarHBondContact O-N 2.77Å; T94-M98 HydrophobicContact CG2-CG 4.48Å; T94-M98 HydrophobicContact CG2-SD 3.93Å; T94-M98 WeakPolarHBondContact O-CB 3.1Å; T94-M98 WeakPolarHBondContact O-CG 3.48Å; T94-M98 PolarHBondContact O-N 2.83Å; T94-A125 HydrophobicContact CG2-CB 4.27Å; T94-L129 HydrophobicContact CG2-CB 3.91Å; T94-Q132 PolarHBondContact OG1-OE1 3.41Å
95	I	98.5	Very high	98	Very high	14 Å²	14	39.3 Å²	39.3	7%	0.072	18%	0.183	C	C	.	.	H	α-helix	trans	-57.9	-47.3	174.6	-66.1	165.6	0	0	0	110.3	A91 D97 M98 W99 L129 V158 I159 P162	A91-I95 WeakPolarHBondContact O-CG1 3.41Å; A91-I95 PolarHBondContact O-N 3.5Å; I95-D97 PolarHBondContact O-N 2.91Å; I95-M98 WeakPolarHBondContact O-CB 3.4Å; I95-M98 PolarHBondContact O-N 3.45Å; I95-W99 PolarHBondContact O-N 3.47Å; I95-L129 HydrophobicContact CD1-CD1 4.11Å; I95-L129 HydrophobicContact CD1-CD2 4.4Å; I95-L129 HydrophobicContact CG1-CD1 3.82Å; I95-L129 HydrophobicContact CG1-CD2 3.66Å; I95-L129 HydrophobicContact CG1-CG 4.41Å; I95-V158 HydrophobicContact CD1-CG1 4.43Å; I95-I159 HydrophobicContact CD1-CG1 4.24Å; I95-P162 HydrophobicContact CG2-CG 4.35Å
96	N	97.8	Very high	97.9	Very high	16 Å²	16	43.6 Å²	43.6	9%	0.086	21%	0.205	C	C	.	.	H	α-helix	trans	-58.2	-51.8	179.9	-176.4	83.7	0	0	0	112	G92 C93 T94 M98 W99 D100 P162 K165	G92-N96 VanDerWaalsContact O-CB 3.26Å; G92-N96 WeakPolarHBondContact O-CB 3.31Å; G92-N96 PolarHBondContact O-N 3.1Å; C93-N96 PolarHBondContact O-N 3.37Å; T94-N96 VanDerWaalsContact C-N 3.32Å; T94-N96 PolarHBondContact O-N 2.6Å; N96-M98 VanDerWaalsContact C-N 3.29Å; N96-M98 PolarHBondContact O-N 3.22Å; N96-W99 PolarHBondContact O-N 3.15Å; N96-D100 VanDerWaalsContact O-CB 3.29Å; N96-D100 WeakPolarHBondContact O-CB 3.48Å; N96-D100 PolarHBondContact O-N 3.23Å; N96-D100 PolarHBondContact OD1-OD2 3.35Å; N96-P162 HydrophobicContact CB-CG 4.32Å; N96-K165 PolarHBondContact OD1-NZ 2.84Å
97	D	98.1	Very high	97.8	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-66.7	-31.1	-179.4	-72.6	12.9	0	0	0	111.6	L43 R45 C93 T94 I95 K101 R113 L115	L43-D97 HydrophobicContact CD1-CB 3.94Å; R45-D97 IonicContact CZ-OD2 2.77Å; R45-D97 IonicContact NH2-OD1 3.42Å; R45-D97 PolarHBondContact NH2-OD1 3.31Å; R45-D97 IonicContact NH2-OD2 3Å; R45-D97 PolarHBondContact NH2-OD2 3.23Å; C93-D97 WeakPolarHBondContact O-CB 3.19Å; C93-D97 PolarHBondContact O-N 3.41Å; T94-D97 PolarHBondContact O-N 2.77Å; I95-D97 PolarHBondContact O-N 2.91Å; D97-K101 PolarHBondContact O-N 3.23Å; D97-R113 IonicContact OD1-CZ 2.84Å; D97-R113 IonicContact OD1-NE 2.63Å; D97-R113 IonicContact OD1-NH1 3.92Å; D97-R113 PolarHBondContact OD1-NH1 3.45Å; D97-R113 WeakPolarHBondContact OD2-CD 3.3Å; D97-L115 HydrophobicContact CB-CD1 4.06Å
98	M	98.3	Very high	97.7	Very high	26 Å²	26	45.9 Å²	45.9	13%	0.128	21%	0.211	C	C	.	.	H	α-helix	trans	-64.4	-42.2	173.1	-74.9	171.6	74.4	0	0	112.1	T94 I95 N96 L115 F122 A125 L126 L129	T94-M98 HydrophobicContact CG2-CG 4.48Å; T94-M98 HydrophobicContact CG2-SD 3.93Å; T94-M98 WeakPolarHBondContact O-CB 3.1Å; T94-M98 WeakPolarHBondContact O-CG 3.48Å; T94-M98 PolarHBondContact O-N 2.83Å; I95-M98 WeakPolarHBondContact O-CB 3.4Å; I95-M98 PolarHBondContact O-N 3.45Å; N96-M98 VanDerWaalsContact C-N 3.29Å; N96-M98 PolarHBondContact O-N 3.22Å; M98-L115 HydrophobicContact CB-CD1 4.24Å; M98-L115 HydrophobicContact CG-CD1 3.58Å; M98-F122 HydrophobicContact CB-CE2 4Å; M98-F122 HydrophobicContact CE-CD1 4.32Å; M98-F122 HydrophobicContact CE-CD2 4.1Å; M98-F122 HydrophobicContact CE-CE1 3.7Å; M98-F122 HydrophobicContact CE-CE2 3.45Å; M98-F122 VanDerWaalsContact CE-CE2 3.45Å; M98-F122 HydrophobicContact CE-CZ 3.23Å; M98-F122 HydrophobicContact CG-CD2 4.41Å; M98-F122 HydrophobicContact CG-CE2 4.15Å; M98-A125 HydrophobicContact CG-CB 4.09Å; M98-A125 HydrophobicContact SD-CB 4.18Å; M98-L126 HydrophobicContact CE-CB 4.21Å; M98-L126 HydrophobicContact CE-CD1 4.18Å; M98-L129 HydrophobicContact SD-CD2 4.14Å
99	W	97.8	Very high	97.5	Very high	104 Å²	104	47.4 Å²	47.4	39%	0.394	22%	0.215	S	C	.	.	H	α-helix	trans	-71.7	-41.1	176.2	-80.4	57.7	0	0	0	111.6	I95 N96 P162 L163 R166	I95-W99 PolarHBondContact O-N 3.47Å; N96-W99 PolarHBondContact O-N 3.15Å; W99-P162 HydrophobicContact CB-CB 3.73Å; W99-P162 HydrophobicContact CB-CG 4.31Å; W99-P162 HydrophobicContact CD2-CB 4.06Å; W99-P162 HydrophobicContact CD2-CG 4.48Å; W99-P162 HydrophobicContact CE3-CB 4.06Å; W99-P162 HydrophobicContact CG-CB 3.95Å; W99-P162 HydrophobicContact CG-CG 4.25Å; W99-L163 HydrophobicContact CZ3-CB 3.85Å; W99-L163 HydrophobicContact CZ3-CD1 4.33Å; W99-R166 PolarHBondContact O-NH2 2.89Å
100	D	96.9	Very high	97.4	Very high	10 Å²	10	45 Å²	45	5%	0.053	21%	0.206	C	C	.	.	H	α-helix	trans	-94.5	1.8	-167.7	-71.5	-14.9	0	0	0	114.1	N96 K102 Y103 D104 K165 R166	N96-D100 VanDerWaalsContact O-CB 3.29Å; N96-D100 WeakPolarHBondContact O-CB 3.48Å; N96-D100 PolarHBondContact O-N 3.23Å; N96-D100 PolarHBondContact OD1-OD2 3.35Å; D100-K102 PolarHBondContact O-N 2.9Å; D100-Y103 WeakPolarHBondContact O-CA 3.45Å; D100-Y103 PolarHBondContact O-N 2.82Å; D100-D104 PolarHBondContact O-N 3.49Å; D100-K165 IonicContact OD2-NZ 2.76Å; D100-K165 PolarHBondContact OD2-NZ 3.47Å; D100-R166 IonicContact OD1-CZ 2.78Å; D100-R166 IonicContact OD1-NE 3.33Å; D100-R166 IonicContact OD1-NH2 3.85Å; D100-R166 PolarHBondContact OD1-NH2 3.08Å
101	K	97.5	Very high	97.3	Very high	79 Å²	79	49.9 Å²	49.9	34%	0.343	23%	0.227	S	C	.	.	H	α-helix	trans	-39.2	-48.2	-178.6	175.3	173.5	174.8	166.8	0	114.1	D97 M105 L115	D97-K101 PolarHBondContact O-N 3.23Å; K101-M105 WeakPolarHBondContact O-CG 3.26Å; K101-M105 PolarHBondContact O-N 3.48Å; K101-L115 WeakPolarHBondContact CD-O 3.47Å; K101-L115 WeakPolarHBondContact CE-O 3.5Å; K101-L115 WeakPolarHBondContact CG-O 3.33Å
102	K	96.8	Very high	97.2	Very high	164 Å²	164	55.4 Å²	55.4	71%	0.713	26%	0.257	S	S	*	.	H	α-helix	trans	-66.8	-38.8	-179.2	-69.8	-178.3	-179.8	-179.7	0	113.5	D100 M105	D100-K102 PolarHBondContact O-N 2.9Å; K102-M105 HydrophobicContact CB-CE 4.41Å; K102-M105 HydrophobicContact CG-CE 4.31Å
103	Y	96.2	Very high	97.2	Very high	76 Å²	76	56 Å²	56	30%	0.298	25%	0.253	S	S	.	.	H	α-helix	trans	-74.4	-42.2	177.9	-62.7	-82.3	0	0	0	110.9	D100 M105 L106 V107 I228 V230	D100-Y103 WeakPolarHBondContact O-CA 3.45Å; D100-Y103 PolarHBondContact O-N 2.82Å; Y103-M105 PolarHBondContact O-N 3.31Å; Y103-L106 WeakPolarHBondContact O-CA 3.48Å; Y103-L106 WeakPolarHBondContact O-CB 3.43Å; Y103-L106 PolarHBondContact O-N 3.17Å; Y103-V107 PolarHBondContact O-N 2.73Å; Y103-I228 HydrophobicContact CD1-CD1 4.12Å; Y103-I228 HydrophobicContact CD1-CG1 4.34Å; Y103-V230 HydrophobicContact CD1-CG2 3.68Å; Y103-V230 HydrophobicContact CE1-CG2 4.1Å; Y103-V230 HydrophobicContact CG-CG2 4.23Å
104	D	97.5	Very high	97.2	Very high	10 Å²	10	55.8 Å²	55.8	5%	0.053	25%	0.251	C	S	.	.	H	α-helix	trans	-59.6	-35.8	-179.7	-82.9	-31.2	0	0	0	111.8	D100 L106 V107 T110 K111 R113 A116	D100-D104 PolarHBondContact O-N 3.49Å; D104-L106 PolarHBondContact O-N 3.05Å; D104-L106 VanDerWaalsContact O-N 3.12Å; D104-V107 PolarHBondContact O-N 3.22Å; D104-T110 WeakPolarHBondContact CA-OG1 3.34Å; D104-T110 CarbonylContact O-C 3.33Å; D104-T110 PolarHBondContact O-OG1 2.62Å; D104-T110 WeakPolarHBondContact OD1-CB 3.49Å; D104-T110 PolarHBondContact OD1-OG1 2.98Å; D104-K111 WeakPolarHBondContact O-CA 3.4Å; D104-K111 PolarHBondContact O-N 3.28Å; D104-R113 VanDerWaalsContact CG-NH1 3.31Å; D104-R113 IonicContact OD1-CZ 2.8Å; D104-R113 IonicContact OD1-NE 2.79Å; D104-R113 IonicContact OD1-NH1 3.53Å; D104-R113 PolarHBondContact OD1-NH1 3.38Å; D104-R113 WeakPolarHBondContact OD2-CD 3.37Å; D104-R113 IonicContact OD2-CZ 3.26Å; D104-R113 IonicContact OD2-NE 3.92Å; D104-R113 IonicContact OD2-NH1 3.67Å; D104-R113 PolarHBondContact OD2-NH1 3.2Å; D104-A116 HydrophobicContact CB-CB 3.77Å
105	M	97.7	Very high	97.1	Very high	91 Å²	91	55.9 Å²	55.9	45%	0.448	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-23.7	172.9	-72.8	-172.1	-63.5	0	0	114	K101 K102 Y103 A116	K101-M105 WeakPolarHBondContact O-CG 3.26Å; K101-M105 PolarHBondContact O-N 3.48Å; K102-M105 HydrophobicContact CB-CE 4.41Å; K102-M105 HydrophobicContact CG-CE 4.31Å; Y103-M105 PolarHBondContact O-N 3.31Å; M105-A116 HydrophobicContact CG-CB 3.93Å; M105-A116 WeakPolarHBondContact CG-O 3.49Å
106	L	96.9	Very high	97.1	Very high	97 Å²	97	55.7 Å²	55.7	51%	0.508	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-1.5	-173.4	-56.1	175.3	0	0	0	113.3	Y103 D104 R227 I228	Y103-L106 WeakPolarHBondContact O-CA 3.48Å; Y103-L106 WeakPolarHBondContact O-CB 3.43Å; Y103-L106 PolarHBondContact O-N 3.17Å; D104-L106 PolarHBondContact O-N 3.05Å; D104-L106 VanDerWaalsContact O-N 3.12Å; L106-R227 PolarHBondContact O-NH2 3.3Å; L106-I228 HydrophobicContact CB-CG2 3.82Å; L106-I228 HydrophobicContact CD1-CG2 4.07Å
107	V	96.5	Very high	97.1	Very high	6 Å²	6	58.1 Å²	58.1	4%	0.036	27%	0.271	C	S	.	.	S	Bend	trans	-110.9	128.5	-178.5	175.1	0	0	0	0	109.6	Y103 D104 R109 T110 K111 D221 D224 I228	Y103-V107 PolarHBondContact O-N 2.73Å; D104-V107 PolarHBondContact O-N 3.22Å; V107-R109 HydrophobicContact CG1-CB 4.39Å; V107-R109 PolarHBondContact O-N 3.19Å; V107-R109 VanDerWaalsContact O-N 3.14Å; V107-T110 WeakPolarHBondContact CB-OG1 3.39Å; V107-T110 HydrophobicContact CG1-CG2 4.33Å; V107-T110 PolarHBondContact O-N 3.46Å; V107-T110 VanDerWaalsContact O-N 3.1Å; V107-K111 WeakPolarHBondContact O-CB 3.32Å; V107-K111 PolarHBondContact O-N 2.94Å; V107-D221 HydrophobicContact CG1-CB 4.24Å; V107-D224 HydrophobicContact CB-CB 4.4Å; V107-D224 HydrophobicContact CG1-CB 4.17Å; V107-D224 HydrophobicContact CG2-CB 4.15Å; V107-I228 HydrophobicContact CG2-CD1 3.49Å; V107-I228 VanDerWaalsContact CG2-CD1 3.49Å
108	K	96	Very high	97	Very high	147 Å²	147	60.3 Å²	60.3	64%	0.639	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-37.5	-173	-70.1	169.4	-172.7	164.1	0	113	D224	K108-D224 WeakPolarHBondContact CB-OD2 3.39Å; K108-D224 WeakPolarHBondContact CG-OD2 3.48Å; K108-D224 PolarHBondContact N-OD2 3.27Å
109	R	94.7	Very high	96.9	Very high	75 Å²	75	61.7 Å²	61.7	28%	0.283	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-27.7	-177.5	-172.8	-179.4	64.7	87.7	-5.6	113.4	V107 Y217 D221	V107-R109 HydrophobicContact CG1-CB 4.39Å; V107-R109 PolarHBondContact O-N 3.19Å; V107-R109 VanDerWaalsContact O-N 3.14Å; R109-Y217 PolarHBondContact NH1-OH 2.99Å; R109-D221 WeakPolarHBondContact CB-OD1 3.41Å; R109-D221 WeakPolarHBondContact CD-OD1 3.35Å; R109-D221 IonicContact CZ-OD1 3.55Å; R109-D221 IonicContact CZ-OD2 3.86Å; R109-D221 IonicContact NE-OD1 3.02Å; R109-D221 PolarHBondContact NE-OD1 3.4Å; R109-D221 IonicContact NE-OD2 2.87Å; R109-D221 PolarHBondContact NE-OD2 2.94Å; R109-D221 IonicContact NH2-OD2 3.3Å; R109-D221 PolarHBondContact NH2-OD2 3.35Å
110	T	96.3	Very high	96.9	Very high	3 Å²	3	56.8 Å²	56.8	2%	0.018	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-6.7	-166.8	67.3	0	0	0	0	114.4	D104 V107 D112 R113	D104-T110 WeakPolarHBondContact CA-OG1 3.34Å; D104-T110 CarbonylContact O-C 3.33Å; D104-T110 PolarHBondContact O-OG1 2.62Å; D104-T110 WeakPolarHBondContact OD1-CB 3.49Å; D104-T110 PolarHBondContact OD1-OG1 2.98Å; V107-T110 WeakPolarHBondContact CB-OG1 3.39Å; V107-T110 HydrophobicContact CG1-CG2 4.33Å; V107-T110 PolarHBondContact O-N 3.46Å; V107-T110 VanDerWaalsContact O-N 3.1Å; T110-D112 PolarHBondContact O-N 2.99Å; T110-D112 VanDerWaalsContact O-N 3.13Å; T110-R113 VanDerWaalsContact CB-NE 3.34Å; T110-R113 VanDerWaalsContact CG2-CZ 3.42Å; T110-R113 VanDerWaalsContact O-CB 3.23Å; T110-R113 WeakPolarHBondContact O-CB 3.26Å; T110-R113 WeakPolarHBondContact O-CD 3.37Å; T110-R113 WeakPolarHBondContact O-CG 3.31Å; T110-R113 PolarHBondContact O-N 2.86Å
111	K	97.1	Very high	96.9	Very high	102 Å²	102	59.7 Å²	59.7	44%	0.443	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-28.6	174.2	65.5	176.7	-173.3	169.5	0	114.5	D104 V107 R113 A116 S117	D104-K111 WeakPolarHBondContact O-CA 3.4Å; D104-K111 PolarHBondContact O-N 3.28Å; V107-K111 WeakPolarHBondContact O-CB 3.32Å; V107-K111 PolarHBondContact O-N 2.94Å; K111-R113 VanDerWaalsContact C-N 3.3Å; K111-A116 WeakPolarHBondContact O-CB 3.37Å; K111-S117 PolarHBondContact O-N 3.45Å
112	D	96.1	Very high	97	Very high	117 Å²	117	60.9 Å²	60.9	63%	0.626	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-0.9	-178.7	-58.7	-41	0	0	0	112.7	T110	T110-D112 PolarHBondContact O-N 2.99Å; T110-D112 VanDerWaalsContact O-N 3.13Å
113	R	97.2	Very high	97	Very high	30 Å²	30	57.4 Å²	57.4	11%	0.113	31%	0.306	C	S	.	.	S	Bend	trans	-60.4	146.1	175	-72.1	174.2	178.9	-176.1	8.8	110.5	R45 D97 D104 T110 K111 L115 A116 S117	R45-R113 VanDerWaalsContact NH2-CD 3.28Å; D97-R113 IonicContact OD1-CZ 2.84Å; D97-R113 IonicContact OD1-NE 2.63Å; D97-R113 IonicContact OD1-NH1 3.92Å; D97-R113 PolarHBondContact OD1-NH1 3.45Å; D97-R113 WeakPolarHBondContact OD2-CD 3.3Å; D104-R113 VanDerWaalsContact CG-NH1 3.31Å; D104-R113 IonicContact OD1-CZ 2.8Å; D104-R113 IonicContact OD1-NE 2.79Å; D104-R113 IonicContact OD1-NH1 3.53Å; D104-R113 PolarHBondContact OD1-NH1 3.38Å; D104-R113 WeakPolarHBondContact OD2-CD 3.37Å; D104-R113 IonicContact OD2-CZ 3.26Å; D104-R113 IonicContact OD2-NE 3.92Å; D104-R113 IonicContact OD2-NH1 3.67Å; D104-R113 PolarHBondContact OD2-NH1 3.2Å; T110-R113 VanDerWaalsContact CB-NE 3.34Å; T110-R113 VanDerWaalsContact CG2-CZ 3.42Å; T110-R113 VanDerWaalsContact O-CB 3.23Å; T110-R113 WeakPolarHBondContact O-CB 3.26Å; T110-R113 WeakPolarHBondContact O-CD 3.37Å; T110-R113 WeakPolarHBondContact O-CG 3.31Å; T110-R113 PolarHBondContact O-N 2.86Å; K111-R113 VanDerWaalsContact C-N 3.3Å; R113-L115 VanDerWaalsContact C-N 3.3Å; R113-L115 PolarHBondContact O-N 3.16Å; R113-L115 VanDerWaalsContact O-N 3.08Å; R113-A116 HydrophobicContact CB-CB 4.36Å; R113-A116 PolarHBondContact O-N 3.01Å; R113-S117 PolarHBondContact O-N 3.22Å; R113-S117 PolarHBondContact O-OG 3.41Å; R113-S117 VanDerWaalsContact O-OG 3.07Å
114	P	98	Very high	97.1	Very high	3 Å²	3	56.5 Å²	56.5	2%	0.019	30%	0.304	C	S	.	.	H	α-helix	trans	-52.9	-38.6	-171.1	-31.8	37.6	0	0	0	116.1	S39 E42 L43 G118 S119 L120	S39-P114 VanDerWaalsContact O-CG 3.22Å; S39-P114 WeakPolarHBondContact O-CG 3.45Å; E42-P114 HydrophobicContact CB-CG 4.09Å; E42-P114 HydrophobicContact CG-CG 4.22Å; L43-P114 HydrophobicContact CB-CB 4.43Å; L43-P114 HydrophobicContact CB-CG 4.06Å; P114-G118 CarbonylContact O-C 3.04Å; P114-G118 PolarHBondContact O-N 3.03Å; P114-G118 VanDerWaalsContact O-N 3.11Å; P114-S119 VanDerWaalsContact CA-OG 3.29Å; P114-S119 WeakPolarHBondContact CA-OG 3.47Å; P114-S119 WeakPolarHBondContact CB-OG 3.49Å; P114-S119 PolarHBondContact O-N 3.46Å; P114-L120 HydrophobicContact CB-CB 4.11Å; P114-L120 HydrophobicContact CB-CD1 3.84Å; P114-L120 HydrophobicContact CB-CG 4.01Å; P114-L120 PolarHBondContact O-N 3.23Å; P114-L120 VanDerWaalsContact O-N 3.08Å
115	L	98.2	Very high	97.2	Very high	2 Å²	2	56 Å²	56	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-78	-32.4	178.7	-71.7	-179.4	0	0	0	113.3	L43 D97 M98 K101 R113 L120 A125	L43-L115 HydrophobicContact CD1-CD1 4.28Å; L43-L115 HydrophobicContact CD1-CG 4.34Å; D97-L115 HydrophobicContact CB-CD1 4.06Å; M98-L115 HydrophobicContact CB-CD1 4.24Å; M98-L115 HydrophobicContact CG-CD1 3.58Å; K101-L115 WeakPolarHBondContact CD-O 3.47Å; K101-L115 WeakPolarHBondContact CE-O 3.5Å; K101-L115 WeakPolarHBondContact CG-O 3.33Å; R113-L115 VanDerWaalsContact C-N 3.3Å; R113-L115 PolarHBondContact O-N 3.16Å; R113-L115 VanDerWaalsContact O-N 3.08Å; L115-L120 HydrophobicContact CD2-CB 4.24Å; L115-L120 WeakPolarHBondContact CD2-O 3.49Å; L115-A125 HydrophobicContact CD1-CB 3.99Å; L115-A125 HydrophobicContact CD2-CB 3.84Å; L115-A125 HydrophobicContact CG-CB 4.33Å
116	A	97.6	Very high	97.2	Very high	11 Å²	11	56 Å²	56	9%	0.091	30%	0.303	C	S	.	.	H	α-helix	trans	-75.7	-43.2	178.5	0	0	0	0	0	111.3	D104 M105 K111 R113 G118	D104-A116 HydrophobicContact CB-CB 3.77Å; M105-A116 HydrophobicContact CG-CB 3.93Å; M105-A116 WeakPolarHBondContact CG-O 3.49Å; K111-A116 WeakPolarHBondContact O-CB 3.37Å; R113-A116 HydrophobicContact CB-CB 4.36Å; R113-A116 PolarHBondContact O-N 3.01Å; A116-G118 VanDerWaalsContact C-N 3.29Å; A116-G118 PolarHBondContact O-N 2.96Å
117	S	96.9	Very high	97.3	Very high	66 Å²	66	57 Å²	57	46%	0.462	31%	0.308	S	S	.	.	H	α-helix	trans	-76.1	-16.5	176.1	65.5	0	0	0	0	113.5	K111 R113	K111-S117 PolarHBondContact O-N 3.45Å; R113-S117 PolarHBondContact O-N 3.22Å; R113-S117 PolarHBondContact O-OG 3.41Å; R113-S117 VanDerWaalsContact O-OG 3.07Å
118	G	96.4	Very high	97.4	Very high	48 Å²	48	58.3 Å²	58.3	50%	0.495	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.2	11	-178.9	0	0	0	0	0	114.5	P114 A116 L120	P114-G118 CarbonylContact O-C 3.04Å; P114-G118 PolarHBondContact O-N 3.03Å; P114-G118 VanDerWaalsContact O-N 3.11Å; A116-G118 VanDerWaalsContact C-N 3.29Å; A116-G118 PolarHBondContact O-N 2.96Å; G118-L120 PolarHBondContact O-N 2.76Å
119	S	96.4	Very high	97.6	Very high	54 Å²	54	52.1 Å²	52.1	38%	0.378	29%	0.287	S	S	.	.	S	Bend	trans	-66.8	-21.6	174	80.8	0	0	0	0	112.9	S39 P114	S39-S119 WeakPolarHBondContact CB-OG 3.33Å; S39-S119 PolarHBondContact OG-OG 2.81Å; P114-S119 VanDerWaalsContact CA-OG 3.29Å; P114-S119 WeakPolarHBondContact CA-OG 3.47Å; P114-S119 WeakPolarHBondContact CB-OG 3.49Å; P114-S119 PolarHBondContact O-N 3.46Å
120	L	97.9	Very high	97.7	Very high	1 Å²	1	51 Å²	51	1%	0.005	29%	0.294	C	S	.	.	S	Bend	trans	-124.1	143.5	166.4	-71	175.9	0	0	0	111.1	L36 Y40 L43 P114 L115 G118 Q124	L36-L120 HydrophobicContact CD1-CD2 3.52Å; Y40-L120 HydrophobicContact CD1-CD1 3.77Å; Y40-L120 HydrophobicContact CD1-CD2 4.33Å; Y40-L120 HydrophobicContact CD2-CD2 4.39Å; Y40-L120 HydrophobicContact CE1-CD1 3.96Å; Y40-L120 HydrophobicContact CE1-CD2 3.89Å; Y40-L120 HydrophobicContact CE2-CD2 3.99Å; Y40-L120 HydrophobicContact CG-CD1 4.24Å; L43-L120 HydrophobicContact CB-CD1 4.21Å; L43-L120 HydrophobicContact CD2-CD1 3.68Å; P114-L120 HydrophobicContact CB-CB 4.11Å; P114-L120 HydrophobicContact CB-CD1 3.84Å; P114-L120 HydrophobicContact CB-CG 4.01Å; P114-L120 PolarHBondContact O-N 3.23Å; P114-L120 VanDerWaalsContact O-N 3.08Å; L115-L120 HydrophobicContact CD2-CB 4.24Å; L115-L120 WeakPolarHBondContact CD2-O 3.49Å; G118-L120 PolarHBondContact O-N 2.76Å; L120-Q124 HydrophobicContact CD2-CB 4.25Å
121	T	97.6	Very high	97.8	Very high	71 Å²	71	54.8 Å²	54.8	44%	0.436	32%	0.316	S	S	.	.			trans	-85.4	161.9	171.8	65.1	0	0	0	0	111.2	Q124 A125	T121-Q124 WeakPolarHBondContact O-CB 3.25Å; T121-Q124 PolarHBondContact O-N 3.3Å; T121-Q124 VanDerWaalsContact OG1-CD 3.28Å; T121-Q124 VanDerWaalsContact OG1-CG 3.28Å; T121-Q124 WeakPolarHBondContact OG1-CG 3.32Å; T121-Q124 PolarHBondContact OG1-N 2.88Å; T121-Q124 PolarHBondContact OG1-OE1 2.79Å; T121-A125 PolarHBondContact O-N 2.93Å
122	F	98	Very high	97.9	Very high	104 Å²	104	50.1 Å²	50.1	46%	0.456	30%	0.296	S	S	.	.	H	α-helix	trans	-61.3	-43.5	177.4	-171.3	-85.2	0	0	0	113.2	M98 Q124 A125 L126	M98-F122 HydrophobicContact CB-CE2 4Å; M98-F122 HydrophobicContact CE-CD1 4.32Å; M98-F122 HydrophobicContact CE-CD2 4.1Å; M98-F122 HydrophobicContact CE-CE1 3.7Å; M98-F122 HydrophobicContact CE-CE2 3.45Å; M98-F122 VanDerWaalsContact CE-CE2 3.45Å; M98-F122 HydrophobicContact CE-CZ 3.23Å; M98-F122 HydrophobicContact CG-CD2 4.41Å; M98-F122 HydrophobicContact CG-CE2 4.15Å; F122-Q124 VanDerWaalsContact C-N 3.31Å; F122-Q124 PolarHBondContact O-N 3Å; F122-A125 PolarHBondContact O-N 3.3Å; F122-L126 PolarHBondContact O-N 2.73Å
123	P	98.5	Very high	98	Very high	92 Å²	92	47.6 Å²	47.6	60%	0.597	28%	0.282	S	S	*	.	H	α-helix	trans	-60.8	-37	174.8	-25.5	36.4	0	0	0	113.6	L126 L127	P123-L126 PolarHBondContact O-N 3.44Å; P123-L127 PolarHBondContact O-N 3.41Å
124	Q	98.5	Very high	98.1	Very high	57 Å²	57	48.9 Å²	48.9	27%	0.266	30%	0.3	S	S	.	.	H	α-helix	trans	-64	-43.8	175	-76.7	169.3	-41.3	0	0	111.9	Y40 L120 T121 F122 L127 F128	Y40-Q124 HydrophobicContact CE1-CB 4.44Å; Y40-Q124 WeakPolarHBondContact OH-CB 3.44Å; L120-Q124 HydrophobicContact CD2-CB 4.25Å; T121-Q124 WeakPolarHBondContact O-CB 3.25Å; T121-Q124 PolarHBondContact O-N 3.3Å; T121-Q124 VanDerWaalsContact OG1-CD 3.28Å; T121-Q124 VanDerWaalsContact OG1-CG 3.28Å; T121-Q124 WeakPolarHBondContact OG1-CG 3.32Å; T121-Q124 PolarHBondContact OG1-N 2.88Å; T121-Q124 PolarHBondContact OG1-OE1 2.79Å; F122-Q124 VanDerWaalsContact C-N 3.31Å; F122-Q124 PolarHBondContact O-N 3Å; Q124-L127 PolarHBondContact O-N 2.95Å; Q124-F128 WeakPolarHBondContact O-CB 3.44Å; Q124-F128 PolarHBondContact O-N 3.41Å
125	A	98.6	Very high	98.1	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-65.5	-37.7	175	0	0	0	0	0	112.4	L43 T94 M98 L115 T121 F122 F128 L129	L43-A125 HydrophobicContact CD2-CB 3.93Å; T94-A125 HydrophobicContact CG2-CB 4.27Å; M98-A125 HydrophobicContact CG-CB 4.09Å; M98-A125 HydrophobicContact SD-CB 4.18Å; L115-A125 HydrophobicContact CD1-CB 3.99Å; L115-A125 HydrophobicContact CD2-CB 3.84Å; L115-A125 HydrophobicContact CG-CB 4.33Å; T121-A125 PolarHBondContact O-N 2.93Å; F122-A125 PolarHBondContact O-N 3.3Å; A125-F128 PolarHBondContact O-N 2.95Å; A125-L129 WeakPolarHBondContact O-CB 3.1Å; A125-L129 PolarHBondContact O-N 3.3Å
126	L	98.6	Very high	98.1	Very high	91 Å²	91	52.1 Å²	52.1	48%	0.476	32%	0.32	S	S	.	.	H	α-helix	trans	-64.6	-43.7	176.2	-177.5	63.2	0	0	0	112	M98 F122 P123 F128 L129 A130	M98-L126 HydrophobicContact CE-CB 4.21Å; M98-L126 HydrophobicContact CE-CD1 4.18Å; F122-L126 PolarHBondContact O-N 2.73Å; P123-L126 PolarHBondContact O-N 3.44Å; L126-F128 VanDerWaalsContact C-N 3.35Å; L126-L129 PolarHBondContact O-N 2.84Å; L126-A130 WeakPolarHBondContact O-CB 3.41Å; L126-A130 PolarHBondContact O-N 3.3Å
127	L	98.6	Very high	98.1	Very high	117 Å²	117	55.6 Å²	55.6	61%	0.613	34%	0.337	S	S	*	.	H	α-helix	trans	-62.1	-44.1	174.5	178.2	61.8	0	0	0	111.1	P123 Q124 L129 A130 V131	P123-L127 PolarHBondContact O-N 3.41Å; Q124-L127 PolarHBondContact O-N 2.95Å; L127-L129 VanDerWaalsContact C-N 3.34Å; L127-L129 PolarHBondContact O-N 3.48Å; L127-A130 PolarHBondContact O-N 3.46Å; L127-V131 WeakPolarHBondContact O-CG2 3.33Å; L127-V131 PolarHBondContact O-N 2.89Å
128	F	98.6	Very high	98.2	Very high	34 Å²	34	56.8 Å²	56.8	15%	0.149	34%	0.341	C	S	.	.	H	α-helix	trans	-61.4	-42.7	177	-177.1	-132.9	0	0	0	112.2	Y40 L43 F46 Q124 A125 L126 V131 Q132	Y40-F128 HydrophobicContact CD1-CB 3.94Å; Y40-F128 AromaticContact CD1-CD1 3.91Å; Y40-F128 HydrophobicContact CD1-CD1 3.91Å; Y40-F128 AromaticContact CD1-CD2 3.98Å; Y40-F128 HydrophobicContact CD1-CD2 3.98Å; Y40-F128 HydrophobicContact CD1-CE1 4.3Å; Y40-F128 HydrophobicContact CD1-CE2 4.41Å; Y40-F128 AromaticContact CD1-CG 3.7Å; Y40-F128 HydrophobicContact CD1-CG 3.7Å; Y40-F128 HydrophobicContact CE1-CB 3.85Å; Y40-F128 HydrophobicContact CE1-CG 4.14Å; Y40-F128 WeakPolarHBondContact O-CE1 3.44Å; Y40-F128 WeakPolarHBondContact O-CZ 3.36Å; L43-F128 HydrophobicContact CB-CE1 4.31Å; L43-F128 HydrophobicContact CD2-CD1 3.77Å; L43-F128 HydrophobicContact CD2-CE1 4.23Å; L43-F128 HydrophobicContact CG-CD1 4.25Å; L43-F128 HydrophobicContact CG-CE1 4.25Å; F46-F128 AromaticContact CE2-CZ 3.93Å; F46-F128 HydrophobicContact CE2-CZ 3.93Å; F46-F128 HydrophobicContact CZ-CZ 4.31Å; Q124-F128 WeakPolarHBondContact O-CB 3.44Å; Q124-F128 PolarHBondContact O-N 3.41Å; A125-F128 PolarHBondContact O-N 2.95Å; L126-F128 VanDerWaalsContact C-N 3.35Å; F128-V131 PolarHBondContact O-N 2.95Å; F128-Q132 VanDerWaalsContact CD1-NE2 3.3Å; F128-Q132 HydrophobicContact CD2-CG 4.48Å; F128-Q132 HydrophobicContact CE2-CG 4.36Å; F128-Q132 VanDerWaalsContact O-CG 3.27Å; F128-Q132 WeakPolarHBondContact O-CG 3.47Å; F128-Q132 PolarHBondContact O-N 2.8Å
129	L	98.6	Very high	98.3	Very high	17 Å²	17	56 Å²	56	9%	0.089	33%	0.325	C	S	.	.	H	α-helix	trans	-60.1	-45.5	173.5	178.7	60.9	0	0	0	111.5	A91 T94 I95 M98 A125 L126 L127 V131 Q132 L133	A91-L129 HydrophobicContact CB-CD1 3.76Å; T94-L129 HydrophobicContact CG2-CB 3.91Å; I95-L129 HydrophobicContact CD1-CD1 4.11Å; I95-L129 HydrophobicContact CD1-CD2 4.4Å; I95-L129 HydrophobicContact CG1-CD1 3.82Å; I95-L129 HydrophobicContact CG1-CD2 3.66Å; I95-L129 HydrophobicContact CG1-CG 4.41Å; M98-L129 HydrophobicContact SD-CD2 4.14Å; A125-L129 WeakPolarHBondContact O-CB 3.1Å; A125-L129 PolarHBondContact O-N 3.3Å; L126-L129 PolarHBondContact O-N 2.84Å; L127-L129 VanDerWaalsContact C-N 3.34Å; L127-L129 PolarHBondContact O-N 3.48Å; L129-V131 VanDerWaalsContact C-N 3.33Å; L129-V131 PolarHBondContact O-N 3.24Å; L129-Q132 PolarHBondContact O-N 2.91Å; L129-L133 HydrophobicContact CD1-CD1 3.92Å; L129-L133 HydrophobicContact CD1-CD2 4.5Å; L129-L133 HydrophobicContact CD1-CG 3.97Å; L129-L133 HydrophobicContact CG-CD1 3.93Å; L129-L133 HydrophobicContact CG-CG 4.35Å; L129-L133 WeakPolarHBondContact O-CB 3.07Å; L129-L133 WeakPolarHBondContact O-CG 3.13Å; L129-L133 PolarHBondContact O-N 3.46Å
130	A	98.7	Very high	98.4	Very high	52 Å²	52	54.8 Å²	54.8	43%	0.43	31%	0.314	S	S	.	.	H	α-helix	trans	-59.8	-42.7	178	0	0	0	0	0	111.9	L126 L127 L133 A134	L126-A130 WeakPolarHBondContact O-CB 3.41Å; L126-A130 PolarHBondContact O-N 3.3Å; L127-A130 PolarHBondContact O-N 3.46Å; A130-L133 PolarHBondContact O-N 3.46Å; A130-A134 VanDerWaalsContact O-CB 3.26Å; A130-A134 WeakPolarHBondContact O-CB 3.19Å; A130-A134 PolarHBondContact O-N 2.84Å
131	V	98.6	Very high	98.4	Very high	81 Å²	81	59.3 Å²	59.3	49%	0.491	34%	0.338	S	S	.	.	H	α-helix	trans	-63.6	-44.1	176	172.7	0	0	0	0	111.6	L127 F128 L129 T135	L127-V131 WeakPolarHBondContact O-CG2 3.33Å; L127-V131 PolarHBondContact O-N 2.89Å; F128-V131 PolarHBondContact O-N 2.95Å; L129-V131 VanDerWaalsContact C-N 3.33Å; L129-V131 PolarHBondContact O-N 3.24Å; V131-T135 WeakPolarHBondContact O-CB 3.46Å; V131-T135 PolarHBondContact O-N 2.89Å; V131-T135 PolarHBondContact O-OG1 3.33Å
132	Q	98.5	Very high	98.5	Very high	5 Å²	5	60.1 Å²	60.1	2%	0.023	34%	0.337	C	S	.	.	H	α-helix	trans	-60.6	-48.5	177.1	-69.8	161.4	-14.8	0	0	111.2	S90 A91 T94 F128 L129 T135 S136	S90-Q132 PolarHBondContact OG-NE2 2.81Å; A91-Q132 HydrophobicContact CB-CB 4.17Å; T94-Q132 PolarHBondContact OG1-OE1 3.41Å; F128-Q132 VanDerWaalsContact CD1-NE2 3.3Å; F128-Q132 HydrophobicContact CD2-CG 4.48Å; F128-Q132 HydrophobicContact CE2-CG 4.36Å; F128-Q132 VanDerWaalsContact O-CG 3.27Å; F128-Q132 WeakPolarHBondContact O-CG 3.47Å; F128-Q132 PolarHBondContact O-N 2.8Å; L129-Q132 PolarHBondContact O-N 2.91Å; Q132-T135 PolarHBondContact O-N 3.34Å; Q132-S136 WeakPolarHBondContact O-CB 3.36Å; Q132-S136 PolarHBondContact O-N 2.96Å; Q132-S136 PolarHBondContact O-OG 3.17Å; Q132-S136 VanDerWaalsContact O-OG 3.06Å
133	L	98.3	Very high	98.5	Very high	63 Å²	63	56.1 Å²	56.1	33%	0.33	32%	0.32	S	S	.	.	H	α-helix	trans	-66.9	-41.3	-178.8	-67.8	177.5	0	0	0	112.2	M88 A91 L129 A130 T135 S136 L137	M88-L133 HydrophobicContact CE-CD2 4.32Å; M88-L133 HydrophobicContact SD-CD2 4.17Å; A91-L133 HydrophobicContact CB-CD2 3.95Å; A91-L133 HydrophobicContact CB-CG 4.49Å; L129-L133 HydrophobicContact CD1-CD1 3.92Å; L129-L133 HydrophobicContact CD1-CD2 4.5Å; L129-L133 HydrophobicContact CD1-CG 3.97Å; L129-L133 HydrophobicContact CG-CD1 3.93Å; L129-L133 HydrophobicContact CG-CG 4.35Å; L129-L133 WeakPolarHBondContact O-CB 3.07Å; L129-L133 WeakPolarHBondContact O-CG 3.13Å; L129-L133 PolarHBondContact O-N 3.46Å; A130-L133 PolarHBondContact O-N 3.46Å; L133-T135 VanDerWaalsContact C-N 3.34Å; L133-T135 PolarHBondContact O-N 3.46Å; L133-S136 PolarHBondContact O-N 3.47Å; L133-L137 WeakPolarHBondContact O-CB 3.18Å; L133-L137 PolarHBondContact O-N 3.45Å
134	A	98.5	Very high	98.5	Very high	58 Å²	58	54.2 Å²	54.2	48%	0.479	31%	0.305	S	S	.	.	H	α-helix	trans	-62.3	-42.8	175.7	0	0	0	0	0	111.6	A130 L137 V138	A130-A134 VanDerWaalsContact O-CB 3.26Å; A130-A134 WeakPolarHBondContact O-CB 3.19Å; A130-A134 PolarHBondContact O-N 2.84Å; A134-L137 WeakPolarHBondContact O-CB 3.46Å; A134-L137 PolarHBondContact O-N 2.84Å; A134-V138 PolarHBondContact O-N 2.91Å
135	T	98.5	Very high	98.5	Very high	62 Å²	62	60 Å²	60	38%	0.38	32%	0.324	S	S	.	.	H	α-helix	trans	-66.9	-43.2	176.6	-49.5	0	0	0	0	111.2	L87 V131 Q132 L133 L137 V138 I139	L87-T135 HydrophobicContact CD1-CG2 3.65Å; L87-T135 HydrophobicContact CD2-CG2 4.31Å; V131-T135 WeakPolarHBondContact O-CB 3.46Å; V131-T135 PolarHBondContact O-N 2.89Å; V131-T135 PolarHBondContact O-OG1 3.33Å; Q132-T135 PolarHBondContact O-N 3.34Å; L133-T135 VanDerWaalsContact C-N 3.34Å; L133-T135 PolarHBondContact O-N 3.46Å; T135-L137 VanDerWaalsContact C-N 3.27Å; T135-L137 PolarHBondContact O-N 3.18Å; T135-V138 PolarHBondContact O-N 3.26Å; T135-I139 PolarHBondContact O-N 3.48Å
136	S	98.4	Very high	98.5	Very high	11 Å²	11	65.2 Å²	65.2	8%	0.077	35%	0.345	C	S	.	.	H	α-helix	trans	-60.8	-35.9	174.3	-67.9	0	0	0	0	112.4	L87 M88 Q132 L133 I139 L140	L87-S136 WeakPolarHBondContact CB-OG 3.46Å; M88-S136 VanDerWaalsContact SD-CB 3.57Å; M88-S136 PolarHBondContact SD-OG 3.33Å; M88-S136 VanDerWaalsContact SD-OG 3.32Å; Q132-S136 WeakPolarHBondContact O-CB 3.36Å; Q132-S136 PolarHBondContact O-N 2.96Å; Q132-S136 PolarHBondContact O-OG 3.17Å; Q132-S136 VanDerWaalsContact O-OG 3.06Å; L133-S136 PolarHBondContact O-N 3.47Å; S136-I139 WeakPolarHBondContact O-CB 3.48Å; S136-I139 PolarHBondContact O-N 2.88Å; S136-L140 PolarHBondContact O-N 2.92Å
137	L	98.2	Very high	98.5	Very high	84 Å²	84	60.9 Å²	60.9	44%	0.44	32%	0.322	S	S	.	.	H	α-helix	trans	-64.2	-40.8	177.2	180	62.1	0	0	0	111.4	L133 A134 T135 I139 L140 L141	L133-L137 WeakPolarHBondContact O-CB 3.18Å; L133-L137 PolarHBondContact O-N 3.45Å; A134-L137 WeakPolarHBondContact O-CB 3.46Å; A134-L137 PolarHBondContact O-N 2.84Å; T135-L137 VanDerWaalsContact C-N 3.27Å; T135-L137 PolarHBondContact O-N 3.18Å; L137-I139 VanDerWaalsContact C-N 3.26Å; L137-I139 PolarHBondContact O-N 3Å; L137-L140 PolarHBondContact O-N 3.23Å; L137-L140 VanDerWaalsContact O-N 3.15Å; L137-L141 HydrophobicContact CD1-CD1 4.31Å; L137-L141 HydrophobicContact CD1-CD2 4.49Å; L137-L141 HydrophobicContact CD1-CG 4.12Å; L137-L141 HydrophobicContact CG-CD1 4.06Å; L137-L141 HydrophobicContact CG-CG 4.32Å; L137-L141 WeakPolarHBondContact O-CB 3.39Å; L137-L141 VanDerWaalsContact O-CG 3.27Å; L137-L141 WeakPolarHBondContact O-CG 3.4Å; L137-L141 PolarHBondContact O-N 2.89Å
138	V	98.6	Very high	98.5	Very high	91 Å²	91	55.5 Å²	55.5	55%	0.552	29%	0.294	S	S	*	.	H	α-helix	trans	-59.9	-37.6	174.6	174.3	0	0	0	0	111.6	A134 T135 Q142	A134-V138 PolarHBondContact O-N 2.91Å; T135-V138 PolarHBondContact O-N 3.26Å; V138-Q142 PolarHBondContact O-NE2 2.94Å
139	I	98.4	Very high	98.5	Very high	30 Å²	30	60.2 Å²	60.2	15%	0.154	32%	0.315	C	S	.	.	H	α-helix	trans	-68.4	-45.3	173.9	-60.4	-60.1	0	0	0	110.9	L80 V83 L87 T135 S136 L137 L141 Q142	L80-I139 HydrophobicContact CB-CG2 4.18Å; L80-I139 HydrophobicContact CD2-CD1 4.31Å; L80-I139 HydrophobicContact CD2-CG2 4.24Å; V83-I139 HydrophobicContact CG1-CD1 4.33Å; V83-I139 HydrophobicContact CG1-CG1 4.43Å; L87-I139 HydrophobicContact CD1-CG1 4.47Å; T135-I139 PolarHBondContact O-N 3.48Å; S136-I139 WeakPolarHBondContact O-CB 3.48Å; S136-I139 PolarHBondContact O-N 2.88Å; L137-I139 VanDerWaalsContact C-N 3.26Å; L137-I139 PolarHBondContact O-N 3Å; I139-L141 VanDerWaalsContact C-N 3.31Å; I139-L141 PolarHBondContact O-N 2.85Å; I139-Q142 WeakPolarHBondContact O-CB 3.41Å; I139-Q142 PolarHBondContact O-N 3.36Å; I139-Q142 VanDerWaalsContact O-N 3.15Å
140	L	98.3	Very high	98.4	Very high	29 Å²	29	60.5 Å²	60.5	15%	0.152	32%	0.316	C	S	.	.	H	α-helix	trans	-60.6	-40.2	-179.2	-176.7	62.4	0	0	0	112	S136 L137 Q142 L143 V148 I152	S136-L140 PolarHBondContact O-N 2.92Å; L137-L140 PolarHBondContact O-N 3.23Å; L137-L140 VanDerWaalsContact O-N 3.15Å; L140-Q142 PolarHBondContact O-N 3.49Å; L140-Q142 VanDerWaalsContact O-N 3.17Å; L140-L143 HydrophobicContact CD1-CD1 4.12Å; L140-L143 WeakPolarHBondContact O-CB 3.35Å; L140-L143 PolarHBondContact O-N 3.37Å; L140-V148 HydrophobicContact CD2-CG1 4.5Å; L140-V148 HydrophobicContact CG-CG1 4.45Å; L140-V148 HydrophobicContact CG-CG2 4.46Å; L140-V148 WeakPolarHBondContact O-CG2 3.36Å; L140-I152 HydrophobicContact CD2-CG1 4.28Å
141	L	98.4	Very high	98.4	Very high	97 Å²	97	58.3 Å²	58.3	51%	0.508	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-8.1	179.6	-69.2	173.9	0	0	0	114.2	L137 I139 L143 W145 V148	L137-L141 HydrophobicContact CD1-CD1 4.31Å; L137-L141 HydrophobicContact CD1-CD2 4.49Å; L137-L141 HydrophobicContact CD1-CG 4.12Å; L137-L141 HydrophobicContact CG-CD1 4.06Å; L137-L141 HydrophobicContact CG-CG 4.32Å; L137-L141 WeakPolarHBondContact O-CB 3.39Å; L137-L141 VanDerWaalsContact O-CG 3.27Å; L137-L141 WeakPolarHBondContact O-CG 3.4Å; L137-L141 PolarHBondContact O-N 2.89Å; I139-L141 VanDerWaalsContact C-N 3.31Å; I139-L141 PolarHBondContact O-N 2.85Å; L141-L143 VanDerWaalsContact C-N 3.32Å; L141-W145 HydrophobicContact CD2-CH2 4.48Å; L141-W145 HydrophobicContact CD2-CZ3 4.48Å; L141-V148 HydrophobicContact CD2-CG1 4.44Å
142	Q	98.2	Very high	98.3	Very high	88 Å²	88	58.4 Å²	58.4	41%	0.411	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-11.6	170.5	-65.5	177.7	51.1	0	0	112.6	Y76 L80 V138 I139 L140	Y76-Q142 PolarHBondContact OH-OE1 3.04Å; L80-Q142 HydrophobicContact CD1-CB 4.06Å; V138-Q142 PolarHBondContact O-NE2 2.94Å; I139-Q142 WeakPolarHBondContact O-CB 3.41Å; I139-Q142 PolarHBondContact O-N 3.36Å; I139-Q142 VanDerWaalsContact O-N 3.15Å; L140-Q142 PolarHBondContact O-N 3.49Å; L140-Q142 VanDerWaalsContact O-N 3.17Å
143	L	98.3	Very high	98.3	Very high	19 Å²	19	63.1 Å²	63.1	10%	0.099	32%	0.32	C	S	.	.	S	Bend	trans	-85.7	165.8	176.9	-51.8	-172.8	0	0	0	111.2	M77 L80 F81 L140 L141 L185 A189	M77-L143 HydrophobicContact SD-CD2 3.98Å; L80-L143 HydrophobicContact CD1-CD2 3.8Å; F81-L143 HydrophobicContact CE2-CD1 4.01Å; F81-L143 HydrophobicContact CE2-CD2 4.19Å; F81-L143 HydrophobicContact CZ-CD1 3.99Å; L140-L143 HydrophobicContact CD1-CD1 4.12Å; L140-L143 WeakPolarHBondContact O-CB 3.35Å; L140-L143 PolarHBondContact O-N 3.37Å; L141-L143 VanDerWaalsContact C-N 3.32Å; L143-L185 HydrophobicContact CD1-CD1 4.48Å; L143-A189 HydrophobicContact CD1-CB 4.33Å; L143-A189 HydrophobicContact CD2-CB 4.26Å
144	N	98.4	Very high	98.2	Very high	53 Å²	53	61 Å²	61	28%	0.283	31%	0.311	S	S	.	.			trans	-63	154.3	171.8	62	69.7	0	0	0	111.9	Y146 S147 V148 S188 A189	N144-Y146 VanDerWaalsContact C-N 3.28Å; N144-Y146 PolarHBondContact O-N 3.37Å; N144-Y146 WeakPolarHBondContact OD1-CB 3.36Å; N144-Y146 PolarHBondContact OD1-N 3.1Å; N144-S147 PolarHBondContact ND2-OG 3.43Å; N144-S147 CarbonylContact O-C 3.6Å; N144-S147 WeakPolarHBondContact O-CA 3.32Å; N144-S147 WeakPolarHBondContact O-CB 3.45Å; N144-S147 PolarHBondContact O-N 3.31Å; N144-S147 WeakPolarHBondContact OD1-CB 3.47Å; N144-S147 PolarHBondContact OD1-N 3.18Å; N144-S147 PolarHBondContact OD1-OG 3.17Å; N144-V148 PolarHBondContact O-N 2.86Å; N144-S188 PolarHBondContact ND2-O 2.91Å; N144-A189 WeakPolarHBondContact ND2-CA 3.23Å; N144-A189 PolarHBondContact ND2-O 3.39Å; N144-A189 VanDerWaalsContact ND2-O 3.09Å
145	W	98.3	Very high	98.1	Very high	177 Å²	177	61.1 Å²	61.1	67%	0.67	30%	0.303	S	S	*	.	H	α-helix	trans	-58.6	-35.6	-174.4	-75.8	114	0	0	0	114.1	L141 S147 V148 F149	L141-W145 HydrophobicContact CD2-CH2 4.48Å; L141-W145 HydrophobicContact CD2-CZ3 4.48Å; W145-S147 VanDerWaalsContact C-N 3.3Å; W145-S147 PolarHBondContact O-N 2.99Å; W145-V148 HydrophobicContact CE3-CB 4.02Å; W145-V148 HydrophobicContact CE3-CG1 4.03Å; W145-V148 HydrophobicContact CE3-CG2 4.19Å; W145-V148 HydrophobicContact CZ3-CB 4.47Å; W145-V148 HydrophobicContact CZ3-CG1 4.02Å; W145-V148 WeakPolarHBondContact O-CB 3.43Å; W145-V148 PolarHBondContact O-N 3.32Å; W145-F149 HydrophobicContact CB-CE2 4.35Å; W145-F149 WeakPolarHBondContact O-CD2 3.4Å; W145-F149 PolarHBondContact O-N 3.19Å
146	Y	98.5	Very high	97.9	Very high	110 Å²	110	62.7 Å²	62.7	43%	0.431	31%	0.312	S	S	.	.	H	α-helix	trans	-56.8	-47.9	173.8	-177.4	-76.9	0	0	0	110.9	N144 F149 L150 G192 V194	N144-Y146 VanDerWaalsContact C-N 3.28Å; N144-Y146 PolarHBondContact O-N 3.37Å; N144-Y146 WeakPolarHBondContact OD1-CB 3.36Å; N144-Y146 PolarHBondContact OD1-N 3.1Å; Y146-F149 PolarHBondContact O-N 2.89Å; Y146-L150 HydrophobicContact CE1-CD2 4.22Å; Y146-L150 WeakPolarHBondContact O-CB 3.27Å; Y146-L150 PolarHBondContact O-N 2.97Å; Y146-G192 WeakPolarHBondContact CB-O 3.39Å; Y146-V194 HydrophobicContact CE1-CB 4.49Å; Y146-V194 HydrophobicContact CE1-CG2 3.99Å
147	S	98.7	Very high	97.8	Very high	0 Å²	0	63 Å²	63	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-66.3	-36.7	176.6	-57.4	0	0	0	0	112.4	N144 W145 L150 G151 L185 S188 A189	N144-S147 PolarHBondContact ND2-OG 3.43Å; N144-S147 CarbonylContact O-C 3.6Å; N144-S147 WeakPolarHBondContact O-CA 3.32Å; N144-S147 WeakPolarHBondContact O-CB 3.45Å; N144-S147 PolarHBondContact O-N 3.31Å; N144-S147 WeakPolarHBondContact OD1-CB 3.47Å; N144-S147 PolarHBondContact OD1-N 3.18Å; N144-S147 PolarHBondContact OD1-OG 3.17Å; W145-S147 VanDerWaalsContact C-N 3.3Å; W145-S147 PolarHBondContact O-N 2.99Å; S147-L150 PolarHBondContact O-N 2.64Å; S147-G151 PolarHBondContact O-N 3.49Å; S147-L185 WeakPolarHBondContact O-CD1 3.44Å; S147-S188 PolarHBondContact OG-O 2.75Å; S147-S188 PolarHBondContact OG-OG 3.46Å; S147-A189 WeakPolarHBondContact OG-CA 3.39Å; S147-A189 PolarHBondContact OG-N 2.8Å; S147-A189 VanDerWaalsContact OG-N 3.14Å
148	V	98.7	Very high	97.7	Very high	5 Å²	5	60.3 Å²	60.3	3%	0.03	30%	0.302	C	S	.	.	H	α-helix	trans	-58.7	-50.1	174.2	174.6	0	0	0	0	110.7	L140 L141 N144 W145 L150 G151 I152	L140-V148 HydrophobicContact CD2-CG1 4.5Å; L140-V148 HydrophobicContact CG-CG1 4.45Å; L140-V148 HydrophobicContact CG-CG2 4.46Å; L140-V148 WeakPolarHBondContact O-CG2 3.36Å; L141-V148 HydrophobicContact CD2-CG1 4.44Å; N144-V148 PolarHBondContact O-N 2.86Å; W145-V148 HydrophobicContact CE3-CB 4.02Å; W145-V148 HydrophobicContact CE3-CG1 4.03Å; W145-V148 HydrophobicContact CE3-CG2 4.19Å; W145-V148 HydrophobicContact CZ3-CB 4.47Å; W145-V148 HydrophobicContact CZ3-CG1 4.02Å; W145-V148 WeakPolarHBondContact O-CB 3.43Å; W145-V148 PolarHBondContact O-N 3.32Å; V148-L150 PolarHBondContact O-N 2.74Å; V148-G151 PolarHBondContact O-N 3.44Å; V148-I152 HydrophobicContact CG1-CD1 4.06Å; V148-I152 WeakPolarHBondContact O-CG1 3.45Å; V148-I152 PolarHBondContact O-N 3.36Å
149	F	98.3	Very high	97.6	Very high	132 Å²	132	59.9 Å²	59.9	58%	0.579	30%	0.295	S	S	*	.	H	α-helix	trans	-61.4	-45.2	177.5	-71.9	-63.8	0	0	0	111.8	W145 Y146 G151 I152 L153	W145-F149 HydrophobicContact CB-CE2 4.35Å; W145-F149 WeakPolarHBondContact O-CD2 3.4Å; W145-F149 PolarHBondContact O-N 3.19Å; Y146-F149 PolarHBondContact O-N 2.89Å; F149-G151 VanDerWaalsContact C-N 3.28Å; F149-G151 PolarHBondContact O-N 3.34Å; F149-I152 PolarHBondContact O-N 2.92Å; F149-L153 WeakPolarHBondContact O-CG 3.41Å; F149-L153 PolarHBondContact O-N 3.34Å
150	L	97.8	Very high	97.5	Very high	23 Å²	23	60.7 Å²	60.7	12%	0.12	30%	0.301	C	S	.	.	H	α-helix	trans	-62.7	-36.8	177.8	-172.7	61.2	0	0	0	112	Y146 S147 V148 L153 S154 W181 L184 L185 V194	Y146-L150 HydrophobicContact CE1-CD2 4.22Å; Y146-L150 WeakPolarHBondContact O-CB 3.27Å; Y146-L150 PolarHBondContact O-N 2.97Å; S147-L150 PolarHBondContact O-N 2.64Å; V148-L150 PolarHBondContact O-N 2.74Å; L150-L153 PolarHBondContact O-N 3.33Å; L150-S154 PolarHBondContact O-N 2.83Å; L150-W181 HydrophobicContact CD1-CZ2 3.87Å; L150-W181 PolarHBondContact O-NE1 3.12Å; L150-L184 HydrophobicContact CD2-CB 3.87Å; L150-L185 HydrophobicContact CB-CD1 4.16Å; L150-L185 HydrophobicContact CD2-CB 4.41Å; L150-L185 HydrophobicContact CD2-CD1 4.32Å; L150-L185 HydrophobicContact CG-CD1 4.36Å; L150-V194 HydrophobicContact CD2-CG2 4.05Å
151	G	98.1	Very high	97.4	Very high	6 Å²	6	61 Å²	61	6%	0.062	30%	0.301	C	S	.	.	H	α-helix	trans	-65.1	-42.6	174.2	0	0	0	0	0	112.7	S147 V148 F149 L153 S154	S147-G151 PolarHBondContact O-N 3.49Å; V148-G151 PolarHBondContact O-N 3.44Å; F149-G151 VanDerWaalsContact C-N 3.28Å; F149-G151 PolarHBondContact O-N 3.34Å; G151-L153 VanDerWaalsContact C-N 3.34Å; G151-L153 PolarHBondContact O-N 2.85Å; G151-S154 VanDerWaalsContact O-CB 3.32Å; G151-S154 WeakPolarHBondContact O-CB 3.26Å; G151-S154 PolarHBondContact O-N 3.38Å; G151-S154 PolarHBondContact O-OG 3.15Å
152	I	97.3	Very high	97.3	Very high	83 Å²	83	56.4 Å²	56.4	43%	0.426	28%	0.277	S	S	.	.	H	α-helix	trans	-61.7	-42.7	175.7	-68.1	166	0	0	0	110.8	L140 V148 F149 S154 L155	L140-I152 HydrophobicContact CD2-CG1 4.28Å; V148-I152 HydrophobicContact CG1-CD1 4.06Å; V148-I152 WeakPolarHBondContact O-CG1 3.45Å; V148-I152 PolarHBondContact O-N 3.36Å; F149-I152 PolarHBondContact O-N 2.92Å; I152-S154 PolarHBondContact O-N 2.93Å; I152-L155 VanDerWaalsContact O-CB 3.3Å; I152-L155 WeakPolarHBondContact O-CB 3.13Å; I152-L155 WeakPolarHBondContact O-CG 3.47Å; I152-L155 PolarHBondContact O-N 3.03Å
153	L	97.4	Very high	97.2	Very high	104 Å²	104	55.6 Å²	55.6	55%	0.545	28%	0.275	S	S	.	.	H	α-helix	trans	-60.3	-29.7	178.2	-69.6	176.8	0	0	0	112.9	F149 L150 G151 L155 V156 P157 W181	F149-L153 WeakPolarHBondContact O-CG 3.41Å; F149-L153 PolarHBondContact O-N 3.34Å; L150-L153 PolarHBondContact O-N 3.33Å; G151-L153 VanDerWaalsContact C-N 3.34Å; G151-L153 PolarHBondContact O-N 2.85Å; L153-L155 PolarHBondContact O-N 3.06Å; L153-V156 PolarHBondContact O-N 2.71Å; L153-P157 WeakPolarHBondContact O-CD 3.46Å; L153-W181 HydrophobicContact CB-CZ2 3.97Å
154	S	97	Very high	97.2	Very high	19 Å²	19	57.7 Å²	57.7	13%	0.133	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-21.6	176.3	82.8	0	0	0	0	113.7	L150 G151 I152 V156 P157 V158 W181	L150-S154 PolarHBondContact O-N 2.83Å; G151-S154 VanDerWaalsContact O-CB 3.32Å; G151-S154 WeakPolarHBondContact O-CB 3.26Å; G151-S154 PolarHBondContact O-N 3.38Å; G151-S154 PolarHBondContact O-OG 3.15Å; I152-S154 PolarHBondContact O-N 2.93Å; S154-V156 VanDerWaalsContact C-N 3.27Å; S154-V156 PolarHBondContact O-N 3.31Å; S154-P157 WeakPolarHBondContact O-CD 3.3Å; S154-P157 VanDerWaalsContact O-CG 3.31Å; S154-P157 WeakPolarHBondContact O-CG 3.43Å; S154-V158 VanDerWaalsContact O-CG2 3.23Å; S154-V158 WeakPolarHBondContact O-CG2 3.47Å; S154-V158 PolarHBondContact O-N 2.9Å; S154-W181 VanDerWaalsContact CB-CD1 3.45Å
155	L	95.4	Very high	97	Very high	60 Å²	60	56.7 Å²	56.7	31%	0.314	28%	0.277	S	S	.	.	H	α-helix	trans	-66.5	-30.2	-178.7	-64.3	177.5	0	0	0	112.2	M88 I152 L153 V158 I159	M88-L155 HydrophobicContact CE-CD2 3.79Å; I152-L155 VanDerWaalsContact O-CB 3.3Å; I152-L155 WeakPolarHBondContact O-CB 3.13Å; I152-L155 WeakPolarHBondContact O-CG 3.47Å; I152-L155 PolarHBondContact O-N 3.03Å; L153-L155 PolarHBondContact O-N 3.06Å; L155-V158 PolarHBondContact O-N 3.17Å; L155-I159 HydrophobicContact CB-CD1 4.26Å; L155-I159 WeakPolarHBondContact O-CB 3.38Å; L155-I159 VanDerWaalsContact O-CG1 3.25Å; L155-I159 WeakPolarHBondContact O-CG1 3.47Å; L155-I159 PolarHBondContact O-N 2.94Å
156	V	95.9	Very high	96.9	Very high	95 Å²	95	51.6 Å²	51.6	58%	0.576	26%	0.257	S	S	*	.	H	α-helix	trans	-59.3	-57.7	-179.6	178.4	0	0	0	0	111.6	L153 S154 V158 T160	L153-V156 PolarHBondContact O-N 2.71Å; S154-V156 VanDerWaalsContact C-N 3.27Å; S154-V156 PolarHBondContact O-N 3.31Å; V156-V158 VanDerWaalsContact C-N 3.32Å; V156-V158 PolarHBondContact O-N 3.48Å; V156-T160 WeakPolarHBondContact O-CB 3.47Å; V156-T160 WeakPolarHBondContact O-CG2 3.41Å; V156-T160 PolarHBondContact O-N 3.07Å; V156-T160 VanDerWaalsContact O-N 3.17Å; V156-T160 PolarHBondContact O-OG1 2.88Å
157	P	95.4	Very high	96.7	Very high	19 Å²	19	50.5 Å²	50.5	12%	0.123	26%	0.262	C	S	.	.	H	α-helix	trans	-67.7	-30.7	177.6	28.8	-37.5	0	0	0	112.5	L153 S154 T160 Y161 V174 T178 W181	L153-P157 WeakPolarHBondContact O-CD 3.46Å; S154-P157 WeakPolarHBondContact O-CD 3.3Å; S154-P157 VanDerWaalsContact O-CG 3.31Å; S154-P157 WeakPolarHBondContact O-CG 3.43Å; P157-T160 WeakPolarHBondContact CA-OG1 3.21Å; P157-T160 PolarHBondContact O-OG1 2.82Å; P157-Y161 VanDerWaalsContact O-CB 3.32Å; P157-Y161 WeakPolarHBondContact O-CB 3.37Å; P157-Y161 PolarHBondContact O-N 3.15Å; P157-V174 HydrophobicContact CB-CG1 4.48Å; P157-T178 HydrophobicContact CB-CG2 3.6Å; P157-T178 HydrophobicContact CG-CG2 4.04Å; P157-T178 WeakPolarHBondContact O-CG2 3.49Å; P157-W181 HydrophobicContact CG-CZ3 4.49Å
158	V	96.3	Very high	96.6	Very high	27 Å²	27	52.4 Å²	52.4	16%	0.164	27%	0.274	C	S	.	.	H	α-helix	trans	-63.3	-47.2	177.3	169.2	0	0	0	0	111.9	I95 S154 L155 V156 T178	I95-V158 HydrophobicContact CD1-CG1 4.43Å; S154-V158 VanDerWaalsContact O-CG2 3.23Å; S154-V158 WeakPolarHBondContact O-CG2 3.47Å; S154-V158 PolarHBondContact O-N 2.9Å; L155-V158 PolarHBondContact O-N 3.17Å; V156-V158 VanDerWaalsContact C-N 3.32Å; V156-V158 PolarHBondContact O-N 3.48Å; V158-T178 HydrophobicContact CG2-CG2 3.91Å
159	I	96.8	Very high	96.6	Very high	81 Å²	81	56.9 Å²	56.9	42%	0.415	29%	0.291	S	S	.	.	H	α-helix	trans	-69.7	-38	-178.7	-68.2	165.6	0	0	0	110.7	I95 L155 P162	I95-I159 HydrophobicContact CD1-CG1 4.24Å; L155-I159 HydrophobicContact CB-CD1 4.26Å; L155-I159 WeakPolarHBondContact O-CB 3.38Å; L155-I159 VanDerWaalsContact O-CG1 3.25Å; L155-I159 WeakPolarHBondContact O-CG1 3.47Å; L155-I159 PolarHBondContact O-N 2.94Å; I159-P162 WeakPolarHBondContact O-CD 3.23Å
160	T	95.4	Very high	96.6	Very high	47 Å²	47	54.7 Å²	54.7	29%	0.288	28%	0.279	S	S	.	.	H	α-helix	trans	-85.6	-19.6	-174	56.7	0	0	0	0	114.1	V156 P157 P162 L163 F164	V156-T160 WeakPolarHBondContact O-CB 3.47Å; V156-T160 WeakPolarHBondContact O-CG2 3.41Å; V156-T160 PolarHBondContact O-N 3.07Å; V156-T160 VanDerWaalsContact O-N 3.17Å; V156-T160 PolarHBondContact O-OG1 2.88Å; P157-T160 WeakPolarHBondContact CA-OG1 3.21Å; P157-T160 PolarHBondContact O-OG1 2.82Å; T160-P162 VanDerWaalsContact C-N 3.35Å; T160-P162 VanDerWaalsContact O-N 3.14Å; T160-L163 WeakPolarHBondContact O-CB 3.31Å; T160-L163 PolarHBondContact O-N 3.4Å; T160-F164 WeakPolarHBondContact O-CD2 3.25Å
161	Y	96.7	Very high	96.6	Very high	36 Å²	36	53.7 Å²	53.7	14%	0.141	27%	0.273	C	S	.	.	H	α-helix	trans	-44.7	-46.3	-178.9	163.3	-103	0	0	0	115	P157 L163 F164 K165 P171 V174 L175	P157-Y161 VanDerWaalsContact O-CB 3.32Å; P157-Y161 WeakPolarHBondContact O-CB 3.37Å; P157-Y161 PolarHBondContact O-N 3.15Å; Y161-L163 PolarHBondContact O-N 2.84Å; Y161-L163 VanDerWaalsContact O-N 3.16Å; Y161-F164 PolarHBondContact O-N 3.25Å; Y161-K165 WeakPolarHBondContact OH-CE 3.44Å; Y161-P171 HydrophobicContact CE2-CB 4.22Å; Y161-P171 WeakPolarHBondContact CE2-O 3.46Å; Y161-V174 HydrophobicContact CD2-CB 4.31Å; Y161-V174 HydrophobicContact CD2-CG1 4.35Å; Y161-L175 HydrophobicContact CD2-CB 4.06Å; Y161-L175 HydrophobicContact CD2-CD1 4.21Å; Y161-L175 HydrophobicContact CE1-CD1 4.19Å; Y161-L175 HydrophobicContact CE2-CB 3.62Å; Y161-L175 HydrophobicContact CE2-CD1 3.87Å; Y161-L175 HydrophobicContact CE2-CG 4.23Å
162	P	96.5	Very high	96.6	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.006	27%	0.272	C	S	.	.	H	α-helix	trans	-60.1	-28.6	-178.9	-23.9	35.4	0	0	0	114	I95 N96 W99 I159 T160 F164	I95-P162 HydrophobicContact CG2-CG 4.35Å; N96-P162 HydrophobicContact CB-CG 4.32Å; W99-P162 HydrophobicContact CB-CB 3.73Å; W99-P162 HydrophobicContact CB-CG 4.31Å; W99-P162 HydrophobicContact CD2-CB 4.06Å; W99-P162 HydrophobicContact CD2-CG 4.48Å; W99-P162 HydrophobicContact CE3-CB 4.06Å; W99-P162 HydrophobicContact CG-CB 3.95Å; W99-P162 HydrophobicContact CG-CG 4.25Å; I159-P162 WeakPolarHBondContact O-CD 3.23Å; T160-P162 VanDerWaalsContact C-N 3.35Å; T160-P162 VanDerWaalsContact O-N 3.14Å; P162-F164 VanDerWaalsContact C-N 3.28Å; P162-F164 PolarHBondContact O-N 3.25Å
163	L	96.7	Very high	96.6	Very high	70 Å²	70	52.1 Å²	52.1	37%	0.366	26%	0.264	S	S	.	.	H	α-helix	trans	-62	-37.2	176.8	-178.9	60.4	0	0	0	111.9	W99 T160 Y161 K165 R166 V167	W99-L163 HydrophobicContact CZ3-CB 3.85Å; W99-L163 HydrophobicContact CZ3-CD1 4.33Å; T160-L163 WeakPolarHBondContact O-CB 3.31Å; T160-L163 PolarHBondContact O-N 3.4Å; Y161-L163 PolarHBondContact O-N 2.84Å; Y161-L163 VanDerWaalsContact O-N 3.16Å; L163-K165 PolarHBondContact O-N 3.04Å; L163-R166 WeakPolarHBondContact O-CB 3.27Å; L163-R166 PolarHBondContact O-N 3.33Å; L163-V167 HydrophobicContact CD1-CG1 4.17Å; L163-V167 HydrophobicContact CG-CG1 4.37Å; L163-V167 PolarHBondContact O-N 3.32Å
164	F	97.1	Very high	96.6	Very high	64 Å²	64	48 Å²	48	28%	0.281	24%	0.243	S	C	.	.	H	α-helix	trans	-66.7	-26	-170.6	-74.9	-90.4	0	0	0	113.1	T160 Y161 P162 R166 V167 T168 P171 V174	T160-F164 WeakPolarHBondContact O-CD2 3.25Å; Y161-F164 PolarHBondContact O-N 3.25Å; P162-F164 VanDerWaalsContact C-N 3.28Å; P162-F164 PolarHBondContact O-N 3.25Å; F164-R166 PolarHBondContact O-N 3.46Å; F164-V167 HydrophobicContact CD1-CG2 4.28Å; F164-V167 PolarHBondContact O-N 3.43Å; F164-T168 HydrophobicContact CB-CG2 3.94Å; F164-T168 HydrophobicContact CD1-CG2 3.71Å; F164-T168 HydrophobicContact CG-CG2 4.33Å; F164-T168 WeakPolarHBondContact O-CG2 3.42Å; F164-T168 PolarHBondContact O-N 3.13Å; F164-P171 HydrophobicContact CB-CB 4.08Å; F164-V174 HydrophobicContact CB-CG2 4.19Å; F164-V174 HydrophobicContact CD1-CG2 3.64Å; F164-V174 HydrophobicContact CD2-CB 4.23Å; F164-V174 HydrophobicContact CD2-CG1 3.95Å; F164-V174 HydrophobicContact CD2-CG2 3.79Å; F164-V174 HydrophobicContact CE1-CG2 3.88Å; F164-V174 HydrophobicContact CE2-CG1 4.08Å; F164-V174 HydrophobicContact CE2-CG2 4.01Å; F164-V174 HydrophobicContact CG-CB 4.31Å; F164-V174 HydrophobicContact CG-CG2 3.59Å; F164-V174 HydrophobicContact CZ-CG2 4.05Å
165	K	95.4	Very high	96.6	Very high	32 Å²	32	47.4 Å²	47.4	14%	0.139	24%	0.238	C	C	.	.	H	α-helix	trans	-63.3	-20.7	173.4	-55.5	-177.8	-163.6	167	0	113.3	N96 D100 Y161 L163 P171 V230 K231	N96-K165 PolarHBondContact OD1-NZ 2.84Å; D100-K165 IonicContact OD2-NZ 2.76Å; D100-K165 PolarHBondContact OD2-NZ 3.47Å; Y161-K165 WeakPolarHBondContact OH-CE 3.44Å; L163-K165 PolarHBondContact O-N 3.04Å; K165-P171 HydrophobicContact CG-CB 3.86Å; K165-P171 HydrophobicContact CG-CG 4.19Å; K165-V230 HydrophobicContact CB-CG1 4.32Å; K165-K231 WeakPolarHBondContact O-CB 3.19Å; K165-K231 PolarHBondContact O-N 3.25Å
166	R	94.8	Very high	96.8	Very high	69 Å²	69	44.5 Å²	44.5	26%	0.26	22%	0.223	S	C	.	.	H	α-helix	trans	-96.5	-35	-177.5	-56	170.1	-166	173.4	-0.4	111.3	W99 D100 L163 F164 K231	W99-R166 PolarHBondContact O-NH2 2.89Å; D100-R166 IonicContact OD1-CZ 2.78Å; D100-R166 IonicContact OD1-NE 3.33Å; D100-R166 IonicContact OD1-NH2 3.85Å; D100-R166 PolarHBondContact OD1-NH2 3.08Å; L163-R166 WeakPolarHBondContact O-CB 3.27Å; L163-R166 PolarHBondContact O-N 3.33Å; F164-R166 PolarHBondContact O-N 3.46Å; R166-K231 PolarHBondContact O-NZ 3.41Å
167	V	95.6	Very high	96.9	Very high	87 Å²	87	42.8 Å²	42.8	53%	0.527	21%	0.21	S	C	.	.	H	α-helix	trans	-96.4	-31.4	-172.2	-57.7	0	0	0	0	113.2	L163 F164 K231	L163-V167 HydrophobicContact CD1-CG1 4.17Å; L163-V167 HydrophobicContact CG-CG1 4.37Å; L163-V167 PolarHBondContact O-N 3.32Å; F164-V167 HydrophobicContact CD1-CG2 4.28Å; F164-V167 PolarHBondContact O-N 3.43Å; V167-K231 PolarHBondContact O-NZ 3.03Å
168	T	97.2	Very high	97	Very high	41 Å²	41	42.5 Å²	42.5	25%	0.252	21%	0.208	S	C	.	.			trans	-135.7	156.7	-174.2	-176.3	0	0	0	0	112.9	F164 W170 K231	F164-T168 HydrophobicContact CB-CG2 3.94Å; F164-T168 HydrophobicContact CD1-CG2 3.71Å; F164-T168 HydrophobicContact CG-CG2 4.33Å; F164-T168 WeakPolarHBondContact O-CG2 3.42Å; F164-T168 PolarHBondContact O-N 3.13Å; T168-W170 HydrophobicContact CG2-CB 4.36Å; T168-W170 PolarHBondContact O-N 3.38Å; T168-W170 PolarHBondContact OG1-N 3.09Å; T168-W170 VanDerWaalsContact OG1-N 3.17Å; T168-K231 WeakPolarHBondContact O-CB 3.3Å
169	Y	97.9	Very high	97.1	Very high	98 Å²	98	41.8 Å²	41.8	38%	0.384	20%	0.203	S	C	.	.	S	Bend	trans	-78.8	3.7	168.4	-73.2	-85.6	0	0	0	113.9	P171 K231 S232 T233 I235 L236	Y169-P171 WeakPolarHBondContact O-CD 3.32Å; Y169-K231 HydrophobicContact CD1-CB 3.82Å; Y169-K231 HydrophobicContact CD1-CG 4.15Å; Y169-K231 HydrophobicContact CD2-CD 4.05Å; Y169-K231 HydrophobicContact CD2-CG 4.37Å; Y169-K231 HydrophobicContact CE1-CB 4.04Å; Y169-K231 HydrophobicContact CE1-CG 3.91Å; Y169-K231 HydrophobicContact CE2-CD 3.94Å; Y169-K231 HydrophobicContact CE2-CG 4.15Å; Y169-K231 HydrophobicContact CG-CB 4.08Å; Y169-K231 HydrophobicContact CG-CD 4.42Å; Y169-K231 HydrophobicContact CG-CG 4.37Å; Y169-S232 CarbonylContact O-C 3.48Å; Y169-T233 WeakPolarHBondContact O-CA 3.47Å; Y169-T233 WeakPolarHBondContact O-CG2 3.48Å; Y169-T233 PolarHBondContact O-N 3.4Å; Y169-I235 HydrophobicContact CD1-CB 4.27Å; Y169-I235 HydrophobicContact CD1-CG2 4.27Å; Y169-I235 HydrophobicContact CE1-CB 4.12Å; Y169-I235 HydrophobicContact CE1-CG2 3.67Å; Y169-L236 HydrophobicContact CD1-CB 4.09Å; Y169-L236 HydrophobicContact CG-CB 4.19Å; Y169-L236 HydrophobicContact CG-CD1 4.44Å
170	W	97.5	Very high	97.2	Very high	86 Å²	86	38 Å²	38	33%	0.326	18%	0.184	S	C	.	.			trans	-114.2	39.1	-177.7	-65.4	97.9	0	0	0	115.4	T168 Q172 L173 T233 L236 F237 F248	T168-W170 HydrophobicContact CG2-CB 4.36Å; T168-W170 PolarHBondContact O-N 3.38Å; T168-W170 PolarHBondContact OG1-N 3.09Å; T168-W170 VanDerWaalsContact OG1-N 3.17Å; W170-Q172 PolarHBondContact O-N 3.34Å; W170-L173 HydrophobicContact CB-CD1 3.6Å; W170-L173 HydrophobicContact CB-CG 3.93Å; W170-L173 HydrophobicContact CD2-CD1 3.88Å; W170-L173 HydrophobicContact CD2-CG 4.26Å; W170-L173 HydrophobicContact CE3-CD1 3.75Å; W170-L173 HydrophobicContact CE3-CD2 3.97Å; W170-L173 HydrophobicContact CE3-CG 3.69Å; W170-L173 HydrophobicContact CG-CD1 3.89Å; W170-L173 HydrophobicContact CG-CG 4.43Å; W170-L173 HydrophobicContact CZ3-CD2 4.29Å; W170-L173 HydrophobicContact CZ3-CG 4.48Å; W170-L173 PolarHBondContact O-N 3.43Å; W170-L173 VanDerWaalsContact O-N 3.09Å; W170-T233 HydrophobicContact CD2-CG2 4.18Å; W170-T233 HydrophobicContact CE3-CG2 3.53Å; W170-T233 HydrophobicContact CZ3-CG2 3.97Å; W170-L236 HydrophobicContact CD2-CD2 4.16Å; W170-L236 VanDerWaalsContact CE2-CD2 3.42Å; W170-L236 HydrophobicContact CH2-CD2 4.39Å; W170-L236 HydrophobicContact CZ2-CD2 3.56Å; W170-F237 AromaticContact CH2-CE1 3.59Å; W170-F237 HydrophobicContact CH2-CE1 3.59Å; W170-F237 AromaticContact CH2-CZ 3.48Å; W170-F237 HydrophobicContact CH2-CZ 3.48Å; W170-F237 VanDerWaalsContact CH2-CZ 3.48Å; W170-F237 HydrophobicContact CZ2-CE1 4.08Å; W170-F237 HydrophobicContact CZ2-CZ 4.36Å; W170-F237 HydrophobicContact CZ3-CE1 4.13Å; W170-F237 AromaticContact CZ3-CZ 3.58Å; W170-F237 HydrophobicContact CZ3-CZ 3.58Å; W170-F248 HydrophobicContact CH2-CZ 4.32Å; W170-F248 HydrophobicContact CZ3-CE2 4.34Å; W170-F248 AromaticContact CZ3-CZ 3.88Å; W170-F248 HydrophobicContact CZ3-CZ 3.88Å
171	P	97.9	Very high	97.3	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.013	18%	0.178	C	C	.	.	H	α-helix	trans	-62	-26.7	176.6	27	-31.6	0	0	0	112.2	Y161 F164 K165 Y169 L173 V174 L175 K231	Y161-P171 HydrophobicContact CE2-CB 4.22Å; Y161-P171 WeakPolarHBondContact CE2-O 3.46Å; F164-P171 HydrophobicContact CB-CB 4.08Å; K165-P171 HydrophobicContact CG-CB 3.86Å; K165-P171 HydrophobicContact CG-CG 4.19Å; Y169-P171 WeakPolarHBondContact O-CD 3.32Å; P171-L173 VanDerWaalsContact C-N 3.26Å; P171-L173 PolarHBondContact O-N 3.05Å; P171-V174 PolarHBondContact O-N 3.46Å; P171-V174 VanDerWaalsContact O-N 3.15Å; P171-L175 PolarHBondContact O-N 3.2Å; P171-K231 WeakPolarHBondContact CG-O 3.26Å
172	Q	98.2	Very high	97.4	Very high	5 Å²	5	36.3 Å²	36.3	2%	0.023	17%	0.173	C	C	.	.	H	α-helix	trans	-61	-29.2	174.6	-75.4	71.8	20	0	0	113.5	W170 G176 I211 D214 T233	W170-Q172 PolarHBondContact O-N 3.34Å; Q172-G176 PolarHBondContact O-N 3.02Å; Q172-I211 HydrophobicContact CB-CG1 4.37Å; Q172-D214 HydrophobicContact CG-CB 4.06Å; Q172-D214 WeakPolarHBondContact CG-OD2 3.5Å; Q172-D214 PolarHBondContact NE2-OD2 3.46Å; Q172-T233 HydrophobicContact CB-CG2 3.99Å; Q172-T233 HydrophobicContact CG-CG2 4.31Å; Q172-T233 VanDerWaalsContact CG-OG1 3.28Å; Q172-T233 WeakPolarHBondContact CG-OG1 3.44Å; Q172-T233 PolarHBondContact OE1-OG1 3.3Å
173	L	97.1	Very high	97.5	Very high	52 Å²	52	36.3 Å²	36.3	27%	0.272	17%	0.173	S	C	.	.	H	α-helix	trans	-64.4	-49.8	172.9	-63.6	175.1	0	0	0	109.7	W170 P171 L175 G176 L177 F207 I211	W170-L173 HydrophobicContact CB-CD1 3.6Å; W170-L173 HydrophobicContact CB-CG 3.93Å; W170-L173 HydrophobicContact CD2-CD1 3.88Å; W170-L173 HydrophobicContact CD2-CG 4.26Å; W170-L173 HydrophobicContact CE3-CD1 3.75Å; W170-L173 HydrophobicContact CE3-CD2 3.97Å; W170-L173 HydrophobicContact CE3-CG 3.69Å; W170-L173 HydrophobicContact CG-CD1 3.89Å; W170-L173 HydrophobicContact CG-CG 4.43Å; W170-L173 HydrophobicContact CZ3-CD2 4.29Å; W170-L173 HydrophobicContact CZ3-CG 4.48Å; W170-L173 PolarHBondContact O-N 3.43Å; W170-L173 VanDerWaalsContact O-N 3.09Å; P171-L173 VanDerWaalsContact C-N 3.26Å; P171-L173 PolarHBondContact O-N 3.05Å; L173-L175 VanDerWaalsContact C-N 3.29Å; L173-L175 PolarHBondContact O-N 2.83Å; L173-G176 WeakPolarHBondContact O-CA 3.27Å; L173-G176 PolarHBondContact O-N 3.27Å; L173-G176 VanDerWaalsContact O-N 3.07Å; L173-L177 WeakPolarHBondContact O-CG 3.44Å; L173-L177 PolarHBondContact O-N 3.05Å; L173-F207 HydrophobicContact CB-CE2 4.14Å; L173-F207 HydrophobicContact CB-CZ 4.05Å; L173-F207 HydrophobicContact CD2-CE1 3.82Å; L173-F207 HydrophobicContact CD2-CE2 4.17Å; L173-F207 HydrophobicContact CD2-CZ 3.28Å; L173-F207 HydrophobicContact CG-CZ 4.22Å; L173-F207 WeakPolarHBondContact O-CE2 3.46Å; L173-I211 HydrophobicContact CD2-CD1 3.51Å; L173-I211 HydrophobicContact CD2-CG1 4.34Å
174	V	97.3	Very high	97.6	Very high	16 Å²	16	33.9 Å²	33.9	10%	0.097	16%	0.16	C	C	.	.	H	α-helix	trans	-64.4	-38.5	-179.6	-174.8	0	0	0	0	110.7	P157 Y161 F164 P171 G176 L177 T178	P157-V174 HydrophobicContact CB-CG1 4.48Å; Y161-V174 HydrophobicContact CD2-CB 4.31Å; Y161-V174 HydrophobicContact CD2-CG1 4.35Å; F164-V174 HydrophobicContact CB-CG2 4.19Å; F164-V174 HydrophobicContact CD1-CG2 3.64Å; F164-V174 HydrophobicContact CD2-CB 4.23Å; F164-V174 HydrophobicContact CD2-CG1 3.95Å; F164-V174 HydrophobicContact CD2-CG2 3.79Å; F164-V174 HydrophobicContact CE1-CG2 3.88Å; F164-V174 HydrophobicContact CE2-CG1 4.08Å; F164-V174 HydrophobicContact CE2-CG2 4.01Å; F164-V174 HydrophobicContact CG-CB 4.31Å; F164-V174 HydrophobicContact CG-CG2 3.59Å; F164-V174 HydrophobicContact CZ-CG2 4.05Å; P171-V174 PolarHBondContact O-N 3.46Å; P171-V174 VanDerWaalsContact O-N 3.15Å; V174-G176 VanDerWaalsContact C-N 3.34Å; V174-G176 PolarHBondContact O-N 3.06Å; V174-L177 WeakPolarHBondContact O-CB 3.43Å; V174-L177 PolarHBondContact O-N 3.46Å; V174-T178 WeakPolarHBondContact O-CG2 3.25Å; V174-T178 PolarHBondContact O-N 3.42Å
175	L	98.1	Very high	97.7	Very high	7 Å²	7	31.8 Å²	31.8	4%	0.037	15%	0.152	C	C	.	.	H	α-helix	trans	-60.2	-45.7	171.9	-167.9	67.5	0	0	0	111.4	Y161 P171 L173 L177 T178 F179 T210 D214	Y161-L175 HydrophobicContact CD2-CB 4.06Å; Y161-L175 HydrophobicContact CD2-CD1 4.21Å; Y161-L175 HydrophobicContact CE1-CD1 4.19Å; Y161-L175 HydrophobicContact CE2-CB 3.62Å; Y161-L175 HydrophobicContact CE2-CD1 3.87Å; Y161-L175 HydrophobicContact CE2-CG 4.23Å; P171-L175 PolarHBondContact O-N 3.2Å; L173-L175 VanDerWaalsContact C-N 3.29Å; L173-L175 PolarHBondContact O-N 2.83Å; L175-L177 PolarHBondContact O-N 3.21Å; L175-T178 WeakPolarHBondContact CA-OG1 3.07Å; L175-T178 PolarHBondContact O-N 3.25Å; L175-T178 PolarHBondContact O-OG1 3.3Å; L175-F179 HydrophobicContact CD1-CD2 3.55Å; L175-F179 HydrophobicContact CD1-CE2 3.48Å; L175-F179 VanDerWaalsContact CD1-CE2 3.48Å; L175-F179 HydrophobicContact CD1-CG 4.49Å; L175-F179 HydrophobicContact CD1-CZ 4.38Å; L175-F179 HydrophobicContact CG-CD2 3.96Å; L175-F179 HydrophobicContact CG-CE2 4.24Å; L175-F179 HydrophobicContact CG-CG 4.47Å; L175-F179 WeakPolarHBondContact O-CB 3.26Å; L175-F179 PolarHBondContact O-N 2.86Å; L175-T210 HydrophobicContact CB-CG2 4.21Å; L175-T210 HydrophobicContact CD2-CG2 4.01Å; L175-T210 HydrophobicContact CG-CG2 3.94Å; L175-D214 HydrophobicContact CD2-CB 3.83Å; L175-D214 VanDerWaalsContact CD2-OD1 3.31Å; L175-D214 WeakPolarHBondContact CD2-OD1 3.44Å; L175-D214 VanDerWaalsContact CD2-OD2 3.29Å; L175-D214 WeakPolarHBondContact CD2-OD2 3.21Å
176	G	98.4	Very high	97.8	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-55.3	-40.2	174.5	0	0	0	0	0	112.3	Q172 L173 V174 N180	Q172-G176 PolarHBondContact O-N 3.02Å; L173-G176 WeakPolarHBondContact O-CA 3.27Å; L173-G176 PolarHBondContact O-N 3.27Å; L173-G176 VanDerWaalsContact O-N 3.07Å; V174-G176 VanDerWaalsContact C-N 3.34Å; V174-G176 PolarHBondContact O-N 3.06Å; G176-N180 WeakPolarHBondContact O-CB 3.17Å; G176-N180 PolarHBondContact O-N 3.42Å; G176-N180 PolarHBondContact O-ND2 3.26Å
177	L	97.6	Very high	98	Very high	58 Å²	58	28.2 Å²	28.2	30%	0.304	14%	0.138	S	C	.	.	H	α-helix	trans	-64.2	-42.9	175.6	-62.7	175.9	0	0	0	111.9	L173 V174 L175 Y203 F207	L173-L177 WeakPolarHBondContact O-CG 3.44Å; L173-L177 PolarHBondContact O-N 3.05Å; V174-L177 WeakPolarHBondContact O-CB 3.43Å; V174-L177 PolarHBondContact O-N 3.46Å; L175-L177 PolarHBondContact O-N 3.21Å; L177-Y203 VanDerWaalsContact C-OH 3.29Å; L177-Y203 WeakPolarHBondContact CA-OH 3.48Å; L177-Y203 WeakPolarHBondContact CB-OH 3.46Å; L177-Y203 HydrophobicContact CD2-CE1 3.81Å; L177-Y203 WeakPolarHBondContact CD2-OH 3.33Å; L177-Y203 PolarHBondContact O-OH 2.91Å; L177-F207 HydrophobicContact CD2-CD2 3.91Å; L177-F207 HydrophobicContact CD2-CE2 3.82Å; L177-F207 HydrophobicContact CG-CD2 4.25Å; L177-F207 HydrophobicContact CG-CE2 3.98Å
178	T	98	Very high	98.2	Very high	13 Å²	13	24.1 Å²	24.1	8%	0.08	11%	0.113	C	C	.	.	H	α-helix	trans	-69.9	-48.6	-179.9	58.7	0	0	0	0	113.1	P157 V158 V174 L175 N180 W181	P157-T178 HydrophobicContact CB-CG2 3.6Å; P157-T178 HydrophobicContact CG-CG2 4.04Å; P157-T178 WeakPolarHBondContact O-CG2 3.49Å; V158-T178 HydrophobicContact CG2-CG2 3.91Å; V174-T178 WeakPolarHBondContact O-CG2 3.25Å; V174-T178 PolarHBondContact O-N 3.42Å; L175-T178 WeakPolarHBondContact CA-OG1 3.07Å; L175-T178 PolarHBondContact O-N 3.25Å; L175-T178 PolarHBondContact O-OG1 3.3Å; T178-N180 VanDerWaalsContact C-N 3.3Å; T178-N180 PolarHBondContact O-N 3.4Å; T178-W181 WeakPolarHBondContact O-CB 3.31Å; T178-W181 PolarHBondContact O-N 2.86Å
179	F	98.3	Very high	98.2	Very high	13 Å²	13	22.5 Å²	22.5	6%	0.057	10%	0.104	C	C	.	.	H	α-helix	trans	-71.3	-28.1	-170.5	-96.8	-123.7	0	0	0	113	L54 L55 R89 L175 T210 Y213	L54-F179 HydrophobicContact CB-CD1 4.07Å; L54-F179 HydrophobicContact CB-CE1 3.93Å; L55-F179 HydrophobicContact CB-CD1 4.35Å; L55-F179 HydrophobicContact CB-CE1 4.27Å; L55-F179 HydrophobicContact CD1-CD2 4.49Å; L55-F179 HydrophobicContact CD1-CG 4.42Å; R89-F179 VanDerWaalsContact NH1-CZ 3.28Å; L175-F179 HydrophobicContact CD1-CD2 3.55Å; L175-F179 HydrophobicContact CD1-CE2 3.48Å; L175-F179 VanDerWaalsContact CD1-CE2 3.48Å; L175-F179 HydrophobicContact CD1-CG 4.49Å; L175-F179 HydrophobicContact CD1-CZ 4.38Å; L175-F179 HydrophobicContact CG-CD2 3.96Å; L175-F179 HydrophobicContact CG-CE2 4.24Å; L175-F179 HydrophobicContact CG-CG 4.47Å; L175-F179 WeakPolarHBondContact O-CB 3.26Å; L175-F179 PolarHBondContact O-N 2.86Å; F179-T210 HydrophobicContact CB-CG2 4.48Å; F179-Y213 VanDerWaalsContact CD1-OH 3.25Å; F179-Y213 WeakPolarHBondContact CD1-OH 3.41Å
180	N	98.7	Very high	98.2	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	3.3	-177.2	-61	-75.6	0	0	0	112.8	P58 G176 T178 G182 A183 Y203 G206 F207 T210	P58-N180 VanDerWaalsContact CG-OD1 3.25Å; P58-N180 WeakPolarHBondContact CG-OD1 3.32Å; G176-N180 WeakPolarHBondContact O-CB 3.17Å; G176-N180 PolarHBondContact O-N 3.42Å; G176-N180 PolarHBondContact O-ND2 3.26Å; T178-N180 VanDerWaalsContact C-N 3.3Å; T178-N180 PolarHBondContact O-N 3.4Å; N180-G182 PolarHBondContact O-N 2.97Å; N180-A183 WeakPolarHBondContact O-CB 3.5Å; N180-A183 PolarHBondContact O-N 3.03Å; N180-Y203 VanDerWaalsContact C-CE2 3.48Å; N180-Y203 HydrophobicContact CB-CD2 3.94Å; N180-Y203 HydrophobicContact CB-CE2 4.06Å; N180-Y203 WeakPolarHBondContact O-CD2 3.33Å; N180-G206 PolarHBondContact ND2-O 3.05Å; N180-G206 WeakPolarHBondContact OD1-CA 3.48Å; N180-G206 PolarHBondContact OD1-O 3.39Å; N180-F207 WeakPolarHBondContact ND2-CA 3.4Å; N180-F207 PolarHBondContact ND2-N 3.15Å; N180-T210 PolarHBondContact ND2-OG1 2.98Å
181	W	98.6	Very high	98.3	Very high	44 Å²	44	19.1 Å²	19.1	17%	0.167	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-28.6	177.5	-154.1	-89.4	0	0	0	112.8	L150 L153 S154 P157 T178 A183 L184 L185 Y203	L150-W181 HydrophobicContact CD1-CZ2 3.87Å; L150-W181 PolarHBondContact O-NE1 3.12Å; L153-W181 HydrophobicContact CB-CZ2 3.97Å; S154-W181 VanDerWaalsContact CB-CD1 3.45Å; P157-W181 HydrophobicContact CG-CZ3 4.49Å; T178-W181 WeakPolarHBondContact O-CB 3.31Å; T178-W181 PolarHBondContact O-N 2.86Å; W181-A183 PolarHBondContact O-N 2.94Å; W181-L184 PolarHBondContact O-N 3.21Å; W181-L185 PolarHBondContact O-N 3.45Å; W181-Y203 HydrophobicContact CE3-CE2 4.21Å
182	G	98.5	Very high	98.3	Very high	5 Å²	5	20.7 Å²	20.7	5%	0.052	12%	0.119	C	C	.	.	H	α-helix	trans	-54	-29.7	169.6	0	0	0	0	0	115.2	P58 C59 S62 N180 L184 G186	P58-G182 CarbonylContact O-C 3.38Å; C59-G182 WeakPolarHBondContact SG-CA 3.28Å; S62-G182 PolarHBondContact OG-O 3.38Å; N180-G182 PolarHBondContact O-N 2.97Å; G182-L184 PolarHBondContact O-N 2.97Å; G182-G186 PolarHBondContact O-N 3.25Å
183	A	98.7	Very high	98.3	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-64.1	-29.7	175.9	0	0	0	0	0	112.6	P58 S62 N180 W181 L202 Y203	P58-A183 WeakPolarHBondContact O-CA 3.32Å; P58-A183 PolarHBondContact O-N 3.37Å; S62-A183 WeakPolarHBondContact CB-O 3.39Å; N180-A183 WeakPolarHBondContact O-CB 3.5Å; N180-A183 PolarHBondContact O-N 3.03Å; W181-A183 PolarHBondContact O-N 2.94Å; A183-L202 HydrophobicContact CB-CB 4.4Å; A183-L202 HydrophobicContact CB-CD2 3.88Å; A183-L202 HydrophobicContact CB-CG 3.88Å; A183-Y203 HydrophobicContact CB-CD2 4.37Å
184	L	98.6	Very high	98.3	Very high	19 Å²	19	22 Å²	22	10%	0.099	13%	0.132	C	C	.	.	H	α-helix	trans	-87.7	-51.3	175.1	-51.1	178.1	0	0	0	110.2	L150 W181 G182 Y187 S188 V194 I200 Y203	L150-L184 HydrophobicContact CD2-CB 3.87Å; W181-L184 PolarHBondContact O-N 3.21Å; G182-L184 PolarHBondContact O-N 2.97Å; L184-Y187 PolarHBondContact O-N 3.42Å; L184-S188 PolarHBondContact O-N 3.35Å; L184-S188 VanDerWaalsContact O-N 3.13Å; L184-V194 HydrophobicContact CB-CG2 4.22Å; L184-I200 HydrophobicContact CD2-CD1 4.1Å; L184-Y203 HydrophobicContact CD1-CD2 4.03Å; L184-Y203 HydrophobicContact CD1-CE2 4.2Å; L184-Y203 HydrophobicContact CD1-CG 4.38Å; L184-Y203 HydrophobicContact CD2-CD2 4.33Å; L184-Y203 HydrophobicContact CD2-CG 4.21Å; L184-Y203 HydrophobicContact CG-CD2 3.84Å; L184-Y203 HydrophobicContact CG-CE2 4.43Å; L184-Y203 HydrophobicContact CG-CG 4.21Å
185	L	98.6	Very high	98.3	Very high	21 Å²	21	23.7 Å²	23.7	11%	0.11	14%	0.141	C	C	.	.	H	α-helix	trans	-68.2	-38.9	-171.7	-174.1	61	0	0	0	113.1	F81 L143 S147 L150 W181 S188 A189	F81-L185 HydrophobicContact CE1-CB 4.1Å; F81-L185 HydrophobicContact CE1-CD2 3.93Å; F81-L185 HydrophobicContact CE1-CG 3.74Å; F81-L185 HydrophobicContact CZ-CB 4.41Å; F81-L185 HydrophobicContact CZ-CD2 4.31Å; F81-L185 HydrophobicContact CZ-CG 3.79Å; L143-L185 HydrophobicContact CD1-CD1 4.48Å; S147-L185 WeakPolarHBondContact O-CD1 3.44Å; L150-L185 HydrophobicContact CB-CD1 4.16Å; L150-L185 HydrophobicContact CD2-CB 4.41Å; L150-L185 HydrophobicContact CD2-CD1 4.32Å; L150-L185 HydrophobicContact CG-CD1 4.36Å; W181-L185 PolarHBondContact O-N 3.45Å; L185-S188 PolarHBondContact O-N 2.92Å; L185-S188 PolarHBondContact O-OG 2.87Å; L185-S188 VanDerWaalsContact O-OG 3.09Å; L185-A189 VanDerWaalsContact O-CB 3.3Å; L185-A189 WeakPolarHBondContact O-CB 3.4Å; L185-A189 PolarHBondContact O-N 3.25Å
186	G	98.7	Very high	98.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-66.5	-38.8	177.7	0	0	0	0	0	112.5	S62 G182 A189 V190	S62-G186 VanDerWaalsContact OG-CA 3.24Å; S62-G186 WeakPolarHBondContact OG-CA 3.49Å; G182-G186 PolarHBondContact O-N 3.25Å; G186-A189 PolarHBondContact O-N 3.34Å; G186-V190 PolarHBondContact O-N 3.39Å
187	Y	98.6	Very high	98.4	Very high	26 Å²	26	32.6 Å²	32.6	10%	0.102	19%	0.192	C	C	.	.	H	α-helix	trans	-64.3	-46.3	175.2	-158.7	-84	0	0	0	111.3	S62 L65 A66 L184 A189 V190 T191 N195 I198	S62-Y187 PolarHBondContact OG-N 3Å; L65-Y187 HydrophobicContact CB-CE2 4.37Å; A66-Y187 HydrophobicContact CB-CD2 3.77Å; A66-Y187 HydrophobicContact CB-CE2 3.9Å; A66-Y187 HydrophobicContact CB-CG 4.14Å; L184-Y187 PolarHBondContact O-N 3.42Å; Y187-A189 VanDerWaalsContact C-N 3.32Å; Y187-A189 PolarHBondContact O-N 2.92Å; Y187-V190 PolarHBondContact O-N 3.19Å; Y187-T191 HydrophobicContact CD1-CG2 4.2Å; Y187-T191 WeakPolarHBondContact CD1-OG1 3.48Å; Y187-T191 HydrophobicContact CE1-CG2 3.84Å; Y187-T191 PolarHBondContact O-N 2.93Å; Y187-T191 PolarHBondContact O-OG1 3.06Å; Y187-N195 HydrophobicContact CD1-CB 4.28Å; Y187-N195 HydrophobicContact CE1-CB 3.51Å; Y187-I198 HydrophobicContact CD2-CG2 4.39Å; Y187-I198 HydrophobicContact CE2-CB 4.46Å; Y187-I198 HydrophobicContact CE2-CD1 4.49Å; Y187-I198 HydrophobicContact CE2-CG2 3.95Å
188	S	98.6	Very high	98.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-70.2	-28	-179.7	70.6	0	0	0	0	113.4	N144 S147 L184 L185 V190 G192 S193	N144-S188 PolarHBondContact ND2-O 2.91Å; S147-S188 PolarHBondContact OG-O 2.75Å; S147-S188 PolarHBondContact OG-OG 3.46Å; L184-S188 PolarHBondContact O-N 3.35Å; L184-S188 VanDerWaalsContact O-N 3.13Å; L185-S188 PolarHBondContact O-N 2.92Å; L185-S188 PolarHBondContact O-OG 2.87Å; L185-S188 VanDerWaalsContact O-OG 3.09Å; S188-V190 VanDerWaalsContact C-N 3.28Å; S188-V190 PolarHBondContact O-N 3.06Å; S188-G192 WeakPolarHBondContact O-CA 3.46Å; S188-G192 PolarHBondContact O-N 3.16Å; S188-S193 VanDerWaalsContact CA-O 3.26Å; S188-S193 WeakPolarHBondContact CA-O 3.45Å
189	A	98.7	Very high	98.4	Very high	7 Å²	7	29.7 Å²	29.7	6%	0.058	18%	0.176	C	C	.	.	H	α-helix	trans	-62.8	-38.8	175.8	0	0	0	0	0	111.4	M77 F81 L143 N144 S147 L185 G186 Y187	M77-A189 HydrophobicContact SD-CB 3.99Å; F81-A189 HydrophobicContact CE2-CB 3.61Å; F81-A189 HydrophobicContact CZ-CB 3.73Å; L143-A189 HydrophobicContact CD1-CB 4.33Å; L143-A189 HydrophobicContact CD2-CB 4.26Å; N144-A189 WeakPolarHBondContact ND2-CA 3.23Å; N144-A189 PolarHBondContact ND2-O 3.39Å; N144-A189 VanDerWaalsContact ND2-O 3.09Å; S147-A189 WeakPolarHBondContact OG-CA 3.39Å; S147-A189 PolarHBondContact OG-N 2.8Å; S147-A189 VanDerWaalsContact OG-N 3.14Å; L185-A189 VanDerWaalsContact O-CB 3.3Å; L185-A189 WeakPolarHBondContact O-CB 3.4Å; L185-A189 PolarHBondContact O-N 3.25Å; G186-A189 PolarHBondContact O-N 3.34Å; Y187-A189 VanDerWaalsContact C-N 3.32Å; Y187-A189 PolarHBondContact O-N 2.92Å
190	V	98.3	Very high	98.5	Very high	52 Å²	52	32.5 Å²	32.5	32%	0.315	19%	0.191	S	C	.	.	H	α-helix	trans	-79.6	-43.3	179.4	178	0	0	0	0	111.9	I63 A66 M77 G186 Y187 S188	I63-V190 HydrophobicContact CB-CG2 4.41Å; I63-V190 HydrophobicContact CG1-CG2 4.3Å; I63-V190 HydrophobicContact CG2-CG2 4.07Å; A66-V190 HydrophobicContact CB-CB 3.71Å; A66-V190 HydrophobicContact CB-CG1 3.74Å; A66-V190 HydrophobicContact CB-CG2 4.15Å; M77-V190 HydrophobicContact CG-CG2 4.22Å; G186-V190 PolarHBondContact O-N 3.39Å; Y187-V190 PolarHBondContact O-N 3.19Å; S188-V190 VanDerWaalsContact C-N 3.28Å; S188-V190 PolarHBondContact O-N 3.06Å
191	T	97.8	Very high	98.5	Very high	62 Å²	62	33.2 Å²	33.2	38%	0.38	20%	0.196	S	C	.	.	H	α-helix	trans	-104.8	-6	-168.8	61	0	0	0	0	114.8	A66 Y187 S193	A66-T191 HydrophobicContact CB-CG2 3.93Å; Y187-T191 HydrophobicContact CD1-CG2 4.2Å; Y187-T191 WeakPolarHBondContact CD1-OG1 3.48Å; Y187-T191 HydrophobicContact CE1-CG2 3.84Å; Y187-T191 PolarHBondContact O-N 2.93Å; Y187-T191 PolarHBondContact O-OG1 3.06Å; T191-S193 PolarHBondContact O-N 2.97Å; T191-S193 PolarHBondContact OG1-O 3.06Å
192	G	98.1	Very high	98.5	Very high	34 Å²	34	31.1 Å²	31.1	35%	0.351	19%	0.188	S	C	.	.	S	Bend	trans	77.4	-2.2	-176.1	0	0	0	0	0	115	Y146 S188	Y146-G192 WeakPolarHBondContact CB-O 3.39Å; S188-G192 WeakPolarHBondContact O-CA 3.46Å; S188-G192 PolarHBondContact O-N 3.16Å
193	S	98.1	Very high	98.5	Very high	58 Å²	58	31.5 Å²	31.5	41%	0.406	19%	0.188	S	C	.	.	S	Bend	trans	-156.8	166.5	177.3	61.7	0	0	0	0	111.5	S188 T191	S188-S193 VanDerWaalsContact CA-O 3.26Å; S188-S193 WeakPolarHBondContact CA-O 3.45Å; T191-S193 PolarHBondContact O-N 2.97Å; T191-S193 PolarHBondContact OG1-O 3.06Å
194	V	98	Very high	98.5	Very high	26 Å²	26	35.7 Å²	35.7	16%	0.158	21%	0.206	C	C	.	.			trans	-87	134.2	170.9	164.4	0	0	0	0	109.2	Y146 L150 L184 P196	Y146-V194 HydrophobicContact CE1-CB 4.49Å; Y146-V194 HydrophobicContact CE1-CG2 3.99Å; L150-V194 HydrophobicContact CD2-CG2 4.05Å; L184-V194 HydrophobicContact CB-CG2 4.22Å; V194-P196 VanDerWaalsContact O-CD 3.29Å; V194-P196 WeakPolarHBondContact O-CD 3.47Å
195	N	98.1	Very high	98.5	Very high	53 Å²	53	34.8 Å²	34.8	28%	0.283	20%	0.202	S	C	.	.			trans	-87.7	107.6	162	-178.4	-23.2	0	0	0	108.9	Y187 L197 I198 S199	Y187-N195 HydrophobicContact CD1-CB 4.28Å; Y187-N195 HydrophobicContact CE1-CB 3.51Å; N195-L197 VanDerWaalsContact C-N 3.26Å; N195-L197 PolarHBondContact O-N 3.36Å; N195-L197 PolarHBondContact OD1-N 3.44Å; N195-L197 VanDerWaalsContact OD1-N 3.1Å; N195-I198 HydrophobicContact CB-CB 4.49Å; N195-I198 PolarHBondContact O-N 3.29Å; N195-I198 VanDerWaalsContact O-N 3.14Å; N195-S199 WeakPolarHBondContact O-CB 3.44Å; N195-S199 PolarHBondContact O-N 3.01Å; N195-S199 PolarHBondContact O-OG 2.91Å
196	P	98.4	Very high	98.5	Very high	82 Å²	82	33.8 Å²	33.8	53%	0.532	20%	0.196	S	C	.	.	H	α-helix	trans	-62.7	-32.6	-173.1	-23.1	35.4	0	0	0	113.4	V194 I198 I200 P201	V194-P196 VanDerWaalsContact O-CD 3.29Å; V194-P196 WeakPolarHBondContact O-CD 3.47Å; P196-I198 PolarHBondContact O-N 2.94Å; P196-I200 HydrophobicContact CB-CG1 4.2Å; P196-I200 VanDerWaalsContact O-CB 3.23Å; P196-I200 WeakPolarHBondContact O-CB 3.47Å; P196-I200 WeakPolarHBondContact O-CG1 3.49Å; P196-I200 PolarHBondContact O-N 3.26Å; P196-P201 WeakPolarHBondContact O-CD 3.42Å
197	L	98.6	Very high	98.5	Very high	111 Å²	111	35 Å²	35	58%	0.581	20%	0.202	S	C	*	.	H	α-helix	trans	-67.8	-24.6	-179	-63.9	177.9	0	0	0	112.5	N195 P201 N262	N195-L197 VanDerWaalsContact C-N 3.26Å; N195-L197 PolarHBondContact O-N 3.36Å; N195-L197 PolarHBondContact OD1-N 3.44Å; N195-L197 VanDerWaalsContact OD1-N 3.1Å; L197-P201 WeakPolarHBondContact O-CD 3.41Å; L197-P201 WeakPolarHBondContact O-CG 3.48Å; L197-N262 HydrophobicContact CB-CB 4.09Å; L197-N262 WeakPolarHBondContact O-CB 3.3Å; L197-N262 PolarHBondContact O-ND2 3.48Å
198	I	98.6	Very high	98.5	Very high	10 Å²	10	34.7 Å²	34.7	5%	0.051	20%	0.202	C	C	.	.	H	α-helix	trans	-103	-52.2	179.4	-66.4	171.5	0	0	0	110.4	L65 Y187 N195 P196 P201 L202 V259 N262 A263	L65-I198 HydrophobicContact CB-CG2 4.38Å; L65-I198 HydrophobicContact CD1-CG2 4.18Å; Y187-I198 HydrophobicContact CD2-CG2 4.39Å; Y187-I198 HydrophobicContact CE2-CB 4.46Å; Y187-I198 HydrophobicContact CE2-CD1 4.49Å; Y187-I198 HydrophobicContact CE2-CG2 3.95Å; N195-I198 HydrophobicContact CB-CB 4.49Å; N195-I198 PolarHBondContact O-N 3.29Å; N195-I198 VanDerWaalsContact O-N 3.14Å; P196-I198 PolarHBondContact O-N 2.94Å; I198-P201 WeakPolarHBondContact O-CD 3.36Å; I198-P201 WeakPolarHBondContact O-CG 3.41Å; I198-L202 VanDerWaalsContact O-CB 3.26Å; I198-L202 WeakPolarHBondContact O-CB 3.41Å; I198-L202 PolarHBondContact O-N 3.2Å; I198-L202 VanDerWaalsContact O-N 3.11Å; I198-V259 HydrophobicContact CG2-CG1 4.34Å; I198-N262 HydrophobicContact CG1-CB 4.19Å; I198-A263 HydrophobicContact CD1-CB 4Å; I198-A263 HydrophobicContact CG1-CB 4.3Å
199	S	98.6	Very high	98.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-73.7	-33	-169.9	-50.5	0	0	0	0	113.4	N195 Y203	N195-S199 WeakPolarHBondContact O-CB 3.44Å; N195-S199 PolarHBondContact O-N 3.01Å; N195-S199 PolarHBondContact O-OG 2.91Å; S199-Y203 WeakPolarHBondContact O-CB 3.08Å; S199-Y203 PolarHBondContact O-N 3.38Å
200	I	98.7	Very high	98.6	Very high	72 Å²	72	34.4 Å²	34.4	37%	0.369	20%	0.199	S	C	.	.	H	α-helix	trans	-68.5	-51.4	178.2	-61	-64.1	0	0	0	112	L184 P196 L202 Y203 F204	L184-I200 HydrophobicContact CD2-CD1 4.1Å; P196-I200 HydrophobicContact CB-CG1 4.2Å; P196-I200 VanDerWaalsContact O-CB 3.23Å; P196-I200 WeakPolarHBondContact O-CB 3.47Å; P196-I200 WeakPolarHBondContact O-CG1 3.49Å; P196-I200 PolarHBondContact O-N 3.26Å; I200-L202 VanDerWaalsContact C-N 3.27Å; I200-L202 PolarHBondContact O-N 3.33Å; I200-Y203 WeakPolarHBondContact O-CB 3.21Å; I200-Y203 PolarHBondContact O-N 2.86Å; I200-F204 HydrophobicContact CG2-CD2 3.76Å; I200-F204 HydrophobicContact CG2-CE2 3.89Å; I200-F204 WeakPolarHBondContact O-CD2 3.31Å; I200-F204 PolarHBondContact O-N 2.99Å
201	P	98.8	Very high	98.6	Very high	16 Å²	16	32 Å²	32	10%	0.104	18%	0.184	C	C	.	.	H	α-helix	trans	-63.6	-34.4	174.5	22.6	-30.5	0	0	0	111.6	P196 L197 I198 Y203 F204 G205 C255 T258 V259	P196-P201 WeakPolarHBondContact O-CD 3.42Å; L197-P201 WeakPolarHBondContact O-CD 3.41Å; L197-P201 WeakPolarHBondContact O-CG 3.48Å; I198-P201 WeakPolarHBondContact O-CD 3.36Å; I198-P201 WeakPolarHBondContact O-CG 3.41Å; P201-Y203 PolarHBondContact O-N 3.4Å; P201-F204 PolarHBondContact O-N 3.17Å; P201-G205 PolarHBondContact O-N 3.09Å; P201-C255 WeakPolarHBondContact O-CB 3.32Å; P201-T258 HydrophobicContact CB-CG2 4.08Å; P201-T258 HydrophobicContact CG-CG2 4.13Å; P201-V259 HydrophobicContact CB-CG2 3.94Å; P201-V259 HydrophobicContact CG-CG2 3.91Å
202	L	98.9	Very high	98.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-60.9	-45.8	172.9	-175.6	68.6	0	0	0	112.1	W61 L65 A183 I198 I200 G205 G206 L256 V259 Y309	W61-L202 HydrophobicContact CB-CD1 4.16Å; W61-L202 HydrophobicContact CB-CD2 4.28Å; W61-L202 HydrophobicContact CE3-CD1 4.03Å; L65-L202 HydrophobicContact CD1-CD1 3.96Å; L65-L202 HydrophobicContact CD1-CD2 3.71Å; L65-L202 HydrophobicContact CD1-CG 4.38Å; A183-L202 HydrophobicContact CB-CB 4.4Å; A183-L202 HydrophobicContact CB-CD2 3.88Å; A183-L202 HydrophobicContact CB-CG 3.88Å; I198-L202 VanDerWaalsContact O-CB 3.26Å; I198-L202 WeakPolarHBondContact O-CB 3.41Å; I198-L202 PolarHBondContact O-N 3.2Å; I198-L202 VanDerWaalsContact O-N 3.11Å; I200-L202 VanDerWaalsContact C-N 3.27Å; I200-L202 PolarHBondContact O-N 3.33Å; L202-G205 PolarHBondContact O-N 3.44Å; L202-G206 PolarHBondContact O-N 3.31Å; L202-L256 HydrophobicContact CD1-CD2 4.24Å; L202-V259 HydrophobicContact CB-CG2 3.8Å; L202-V259 HydrophobicContact CD1-CG2 4.4Å; L202-V259 VanDerWaalsContact N-CG2 3.31Å; L202-Y309 HydrophobicContact CD1-CE1 3.75Å
203	Y	98.8	Very high	98.7	Very high	13 Å²	13	27.7 Å²	27.7	5%	0.051	15%	0.151	C	C	.	.	H	α-helix	trans	-59.5	-47	177	-179.8	-102.9	0	0	0	111.6	L177 N180 W181 A183 L184 S199 I200 P201 G206 F207	L177-Y203 VanDerWaalsContact C-OH 3.29Å; L177-Y203 WeakPolarHBondContact CA-OH 3.48Å; L177-Y203 WeakPolarHBondContact CB-OH 3.46Å; L177-Y203 HydrophobicContact CD2-CE1 3.81Å; L177-Y203 WeakPolarHBondContact CD2-OH 3.33Å; L177-Y203 PolarHBondContact O-OH 2.91Å; N180-Y203 VanDerWaalsContact C-CE2 3.48Å; N180-Y203 HydrophobicContact CB-CD2 3.94Å; N180-Y203 HydrophobicContact CB-CE2 4.06Å; N180-Y203 WeakPolarHBondContact O-CD2 3.33Å; W181-Y203 HydrophobicContact CE3-CE2 4.21Å; A183-Y203 HydrophobicContact CB-CD2 4.37Å; L184-Y203 HydrophobicContact CD1-CD2 4.03Å; L184-Y203 HydrophobicContact CD1-CE2 4.2Å; L184-Y203 HydrophobicContact CD1-CG 4.38Å; L184-Y203 HydrophobicContact CD2-CD2 4.33Å; L184-Y203 HydrophobicContact CD2-CG 4.21Å; L184-Y203 HydrophobicContact CG-CD2 3.84Å; L184-Y203 HydrophobicContact CG-CE2 4.43Å; L184-Y203 HydrophobicContact CG-CG 4.21Å; S199-Y203 WeakPolarHBondContact O-CB 3.08Å; S199-Y203 PolarHBondContact O-N 3.38Å; I200-Y203 WeakPolarHBondContact O-CB 3.21Å; I200-Y203 PolarHBondContact O-N 2.86Å; P201-Y203 PolarHBondContact O-N 3.4Å; Y203-G206 PolarHBondContact O-N 3.28Å; Y203-F207 WeakPolarHBondContact O-CB 3.38Å; Y203-F207 PolarHBondContact O-N 3.48Å
204	F	98.8	Very high	98.7	Very high	87 Å²	87	25.6 Å²	25.6	38%	0.382	14%	0.135	S	C	.	.	H	α-helix	trans	-71.6	-31.4	177.5	-80.9	-72	0	0	0	113	I200 P201 F207 N208	I200-F204 HydrophobicContact CG2-CD2 3.76Å; I200-F204 HydrophobicContact CG2-CE2 3.89Å; I200-F204 WeakPolarHBondContact O-CD2 3.31Å; I200-F204 PolarHBondContact O-N 2.99Å; P201-F204 PolarHBondContact O-N 3.17Å; F204-F207 HydrophobicContact CD1-CB 4.42Å; F204-F207 HydrophobicContact CD1-CD1 4.18Å; F204-F207 HydrophobicContact CD1-CG 4.31Å; F204-F207 WeakPolarHBondContact O-CB 3.29Å; F204-F207 PolarHBondContact O-N 3.36Å; F204-N208 PolarHBondContact O-N 3.03Å; F204-N208 PolarHBondContact O-ND2 3.13Å
205	G	98.9	Very high	98.7	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-60.5	-48.3	170.9	0	0	0	0	0	111.4	P201 L202 N208 W209	P201-G205 PolarHBondContact O-N 3.09Å; L202-G205 PolarHBondContact O-N 3.44Å; G205-N208 PolarHBondContact O-N 2.6Å; G205-W209 PolarHBondContact O-N 3.21Å; G205-W209 VanDerWaalsContact O-N 3.09Å
206	G	98.8	Very high	98.8	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62.4	-40.2	172.7	0	0	0	0	0	113.2	N180 L202 Y203 N208 W209 T210	N180-G206 PolarHBondContact ND2-O 3.05Å; N180-G206 WeakPolarHBondContact OD1-CA 3.48Å; N180-G206 PolarHBondContact OD1-O 3.39Å; L202-G206 PolarHBondContact O-N 3.31Å; Y203-G206 PolarHBondContact O-N 3.28Å; G206-N208 PolarHBondContact O-N 3.28Å; G206-W209 CarbonylContact O-C 3.51Å; G206-W209 WeakPolarHBondContact O-CA 3.25Å; G206-W209 WeakPolarHBondContact O-CB 3.46Å; G206-W209 PolarHBondContact O-N 2.85Å; G206-W209 VanDerWaalsContact O-N 3.13Å; G206-T210 PolarHBondContact O-N 3.38Å; G206-T210 PolarHBondContact O-OG1 3.4Å
207	F	98.8	Very high	98.8	Very high	25 Å²	25	19.9 Å²	19.9	11%	0.11	10%	0.097	C	C	.	.	H	α-helix	trans	-58	-47.6	175.7	170.1	-88.7	0	0	0	112	L173 L177 N180 Y203 F204 W209 T210 I211	L173-F207 HydrophobicContact CB-CE2 4.14Å; L173-F207 HydrophobicContact CB-CZ 4.05Å; L173-F207 HydrophobicContact CD2-CE1 3.82Å; L173-F207 HydrophobicContact CD2-CE2 4.17Å; L173-F207 HydrophobicContact CD2-CZ 3.28Å; L173-F207 HydrophobicContact CG-CZ 4.22Å; L173-F207 WeakPolarHBondContact O-CE2 3.46Å; L177-F207 HydrophobicContact CD2-CD2 3.91Å; L177-F207 HydrophobicContact CD2-CE2 3.82Å; L177-F207 HydrophobicContact CG-CD2 4.25Å; L177-F207 HydrophobicContact CG-CE2 3.98Å; N180-F207 WeakPolarHBondContact ND2-CA 3.4Å; N180-F207 PolarHBondContact ND2-N 3.15Å; Y203-F207 WeakPolarHBondContact O-CB 3.38Å; Y203-F207 PolarHBondContact O-N 3.48Å; F204-F207 HydrophobicContact CD1-CB 4.42Å; F204-F207 HydrophobicContact CD1-CD1 4.18Å; F204-F207 HydrophobicContact CD1-CG 4.31Å; F204-F207 WeakPolarHBondContact O-CB 3.29Å; F204-F207 PolarHBondContact O-N 3.36Å; F207-W209 VanDerWaalsContact C-N 3.29Å; F207-W209 PolarHBondContact O-N 3.04Å; F207-T210 PolarHBondContact O-N 3Å; F207-I211 HydrophobicContact CD1-CD1 3.69Å; F207-I211 HydrophobicContact CE1-CD1 3.38Å; F207-I211 HydrophobicContact CG-CD1 4.41Å; F207-I211 HydrophobicContact CZ-CD1 3.86Å; F207-I211 WeakPolarHBondContact O-CG1 3.31Å; F207-I211 PolarHBondContact O-N 2.95Å; F207-I211 VanDerWaalsContact O-N 3.08Å
208	N	98.9	Very high	98.7	Very high	20 Å²	20	15.1 Å²	15.1	11%	0.107	7%	0.073	C	C	.	.	H	α-helix	trans	-59.2	-43.5	174.7	-80.2	-87.6	0	0	0	110.7	F204 G205 G206 T210 I211 I212 F248 M252	F204-N208 PolarHBondContact O-N 3.03Å; F204-N208 PolarHBondContact O-ND2 3.13Å; G205-N208 PolarHBondContact O-N 2.6Å; G206-N208 PolarHBondContact O-N 3.28Å; N208-T210 PolarHBondContact O-N 3.09Å; N208-I211 PolarHBondContact O-N 3.31Å; N208-I212 WeakPolarHBondContact O-CG1 3.42Å; N208-I212 PolarHBondContact O-N 2.83Å; N208-F248 HydrophobicContact CB-CB 4.49Å; N208-F248 WeakPolarHBondContact CB-O 3.36Å; N208-F248 VanDerWaalsContact OD1-CD1 3.28Å; N208-F248 WeakPolarHBondContact OD1-CD1 3.44Å; N208-F248 PolarHBondContact OD1-O 3.25Å; N208-M252 HydrophobicContact CB-CB 3.79Å
209	W	98.8	Very high	98.7	Very high	2 Å²	2	15.2 Å²	15.2	1%	0.008	7%	0.073	C	C	.	.	H	α-helix	trans	-61.1	-42	176.5	-179.4	49.4	0	0	0	113.2	L54 L57 P58 W61 G205 G206 F207 I211 I212 Y213 M252 S302 T305	L54-W209 HydrophobicContact CD2-CH2 3.61Å; L54-W209 HydrophobicContact CD2-CZ2 3.76Å; L54-W209 HydrophobicContact CD2-CZ3 4.33Å; L57-W209 HydrophobicContact CB-CH2 4.5Å; L57-W209 HydrophobicContact CD1-CH2 4.22Å; P58-W209 HydrophobicContact CG-CZ3 4.46Å; W61-W209 HydrophobicContact CH2-CD2 4.18Å; W61-W209 AromaticContact CH2-CE3 3.33Å; W61-W209 HydrophobicContact CH2-CE3 3.33Å; W61-W209 HydrophobicContact CH2-CH2 4.1Å; W61-W209 AromaticContact CH2-CZ3 3.27Å; W61-W209 HydrophobicContact CH2-CZ3 3.27Å; W61-W209 AromaticContact CZ2-CE3 3.98Å; W61-W209 HydrophobicContact CZ2-CE3 3.98Å; W61-W209 AromaticContact CZ2-CH2 3.87Å; W61-W209 HydrophobicContact CZ2-CH2 3.87Å; W61-W209 AromaticContact CZ2-CZ3 3.46Å; W61-W209 HydrophobicContact CZ2-CZ3 3.46Å; W61-W209 VanDerWaalsContact CZ2-CZ3 3.46Å; W61-W209 HydrophobicContact CZ3-CE3 4.33Å; W61-W209 HydrophobicContact CZ3-CZ3 4.41Å; G205-W209 PolarHBondContact O-N 3.21Å; G205-W209 VanDerWaalsContact O-N 3.09Å; G206-W209 CarbonylContact O-C 3.51Å; G206-W209 WeakPolarHBondContact O-CA 3.25Å; G206-W209 WeakPolarHBondContact O-CB 3.46Å; G206-W209 PolarHBondContact O-N 2.85Å; G206-W209 VanDerWaalsContact O-N 3.13Å; F207-W209 VanDerWaalsContact C-N 3.29Å; F207-W209 PolarHBondContact O-N 3.04Å; W209-I211 VanDerWaalsContact C-N 3.34Å; W209-I211 PolarHBondContact O-N 2.88Å; W209-I212 WeakPolarHBondContact O-CB 3.4Å; W209-I212 PolarHBondContact O-N 3.11Å; W209-I212 VanDerWaalsContact O-N 3.13Å; W209-Y213 AromaticContact CD2-CD1 3.89Å; W209-Y213 HydrophobicContact CD2-CD1 3.89Å; W209-Y213 AromaticContact CD2-CE1 3.77Å; W209-Y213 HydrophobicContact CD2-CE1 3.77Å; W209-Y213 AromaticContact CE2-CD1 3.84Å; W209-Y213 HydrophobicContact CE3-CD1 4.43Å; W209-Y213 AromaticContact CE3-CE1 3.85Å; W209-Y213 HydrophobicContact CE3-CE1 3.85Å; W209-Y213 HydrophobicContact CG-CD1 4.07Å; W209-Y213 HydrophobicContact CG-CE1 4.23Å; W209-Y213 HydrophobicContact CZ2-CD1 4.42Å; W209-Y213 HydrophobicContact CZ2-CE1 4.44Å; W209-Y213 HydrophobicContact CZ3-CE1 4.28Å; W209-Y213 AromaticContact NE1-CD1 3.85Å; W209-Y213 WeakPolarHBondContact O-CD1 3.26Å; W209-Y213 PolarHBondContact O-N 2.99Å; W209-M252 HydrophobicContact CB-CE 3.74Å; W209-M252 HydrophobicContact CB-SD 3.79Å; W209-M252 HydrophobicContact CG-CE 3.82Å; W209-M252 HydrophobicContact CG-SD 4.22Å; W209-S302 VanDerWaalsContact CZ2-O 3.26Å; W209-S302 WeakPolarHBondContact CZ2-O 3.17Å; W209-T305 HydrophobicContact CZ2-CG2 4.43Å
210	T	98.9	Very high	98.7	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-60.8	-43.1	174.8	-61.7	0	0	0	0	112.4	L175 F179 N180 G206 F207 N208 I212 Y213 D214	L175-T210 HydrophobicContact CB-CG2 4.21Å; L175-T210 HydrophobicContact CD2-CG2 4.01Å; L175-T210 HydrophobicContact CG-CG2 3.94Å; F179-T210 HydrophobicContact CB-CG2 4.48Å; N180-T210 PolarHBondContact ND2-OG1 2.98Å; G206-T210 PolarHBondContact O-N 3.38Å; G206-T210 PolarHBondContact O-OG1 3.4Å; F207-T210 PolarHBondContact O-N 3Å; N208-T210 PolarHBondContact O-N 3.09Å; T210-I212 PolarHBondContact O-N 2.88Å; T210-Y213 VanDerWaalsContact CA-CZ 3.45Å; T210-Y213 WeakPolarHBondContact CB-OH 3.34Å; T210-Y213 HydrophobicContact CG2-CE2 4.04Å; T210-Y213 WeakPolarHBondContact CG2-OH 3.08Å; T210-Y213 PolarHBondContact OG1-OH 2.97Å; T210-D214 HydrophobicContact CG2-CB 4.49Å; T210-D214 WeakPolarHBondContact O-CB 3.11Å; T210-D214 PolarHBondContact O-N 3.45Å
211	I	98.8	Very high	98.6	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-60.8	-40.4	175.6	-64.1	161.8	0	0	0	110.2	Q172 L173 F207 N208 W209 T215 F248	Q172-I211 HydrophobicContact CB-CG1 4.37Å; L173-I211 HydrophobicContact CD2-CD1 3.51Å; L173-I211 HydrophobicContact CD2-CG1 4.34Å; F207-I211 HydrophobicContact CD1-CD1 3.69Å; F207-I211 HydrophobicContact CE1-CD1 3.38Å; F207-I211 HydrophobicContact CG-CD1 4.41Å; F207-I211 HydrophobicContact CZ-CD1 3.86Å; F207-I211 WeakPolarHBondContact O-CG1 3.31Å; F207-I211 PolarHBondContact O-N 2.95Å; F207-I211 VanDerWaalsContact O-N 3.08Å; N208-I211 PolarHBondContact O-N 3.31Å; W209-I211 VanDerWaalsContact C-N 3.34Å; W209-I211 PolarHBondContact O-N 2.88Å; I211-T215 WeakPolarHBondContact O-CB 3.22Å; I211-T215 PolarHBondContact O-N 3.47Å; I211-T215 PolarHBondContact O-OG1 3.48Å; I211-F248 HydrophobicContact CB-CD1 4.19Å; I211-F248 HydrophobicContact CB-CE1 4.44Å; I211-F248 HydrophobicContact CB-CG 4.32Å; I211-F248 HydrophobicContact CD1-CD1 3.66Å; I211-F248 HydrophobicContact CD1-CE1 3.37Å; I211-F248 HydrophobicContact CD1-CZ 4.05Å; I211-F248 HydrophobicContact CG1-CE1 4.47Å; I211-F248 HydrophobicContact CG2-CD1 4.03Å; I211-F248 HydrophobicContact CG2-CD2 3.7Å; I211-F248 HydrophobicContact CG2-CE1 4.06Å; I211-F248 HydrophobicContact CG2-CE2 3.72Å; I211-F248 HydrophobicContact CG2-CG 3.89Å; I211-F248 HydrophobicContact CG2-CZ 3.93Å
212	I	98.9	Very high	98.5	Very high	6 Å²	6	14.7 Å²	14.7	3%	0.031	7%	0.069	C	C	.	.	H	α-helix	trans	-60.8	-61.1	178.5	-65.3	163.1	0	0	0	111.5	N208 W209 T210 D214 I216 L245 F248 H249 V280 I284	N208-I212 WeakPolarHBondContact O-CG1 3.42Å; N208-I212 PolarHBondContact O-N 2.83Å; W209-I212 WeakPolarHBondContact O-CB 3.4Å; W209-I212 PolarHBondContact O-N 3.11Å; W209-I212 VanDerWaalsContact O-N 3.13Å; T210-I212 PolarHBondContact O-N 2.88Å; I212-D214 VanDerWaalsContact C-N 3.34Å; I212-D214 PolarHBondContact O-N 3.18Å; I212-I216 HydrophobicContact CG2-CD1 4.35Å; I212-I216 WeakPolarHBondContact O-CG1 3.42Å; I212-I216 PolarHBondContact O-N 3.23Å; I212-L245 HydrophobicContact CG1-CD2 4.47Å; I212-F248 HydrophobicContact CD1-CB 4.18Å; I212-F248 HydrophobicContact CG1-CB 3.83Å; I212-H249 HydrophobicContact CD1-CB 4.04Å; I212-V280 HydrophobicContact CD1-CG1 4.02Å; I212-V280 HydrophobicContact CG2-CG1 4.26Å; I212-I284 HydrophobicContact CD1-CD1 4.47Å; I212-I284 HydrophobicContact CG2-CD1 3.85Å; I212-I284 HydrophobicContact CG2-CG1 3.81Å
213	Y	98.7	Very high	98.4	Very high	1 Å²	1	20.8 Å²	20.8	0%	0.004	10%	0.102	C	C	.	.	H	α-helix	trans	-70.7	-31.7	-173.4	67.1	-116.3	0	0	0	112.3	L54 F179 W209 T210 Y217 F299 S302	L54-Y213 HydrophobicContact CD1-CD2 4.02Å; L54-Y213 HydrophobicContact CD1-CE1 4.39Å; L54-Y213 HydrophobicContact CD1-CE2 3.81Å; L54-Y213 HydrophobicContact CD1-CG 4.49Å; L54-Y213 HydrophobicContact CD2-CD1 4.22Å; L54-Y213 HydrophobicContact CD2-CE1 3.94Å; F179-Y213 VanDerWaalsContact CD1-OH 3.25Å; F179-Y213 WeakPolarHBondContact CD1-OH 3.41Å; W209-Y213 AromaticContact CD2-CD1 3.89Å; W209-Y213 HydrophobicContact CD2-CD1 3.89Å; W209-Y213 AromaticContact CD2-CE1 3.77Å; W209-Y213 HydrophobicContact CD2-CE1 3.77Å; W209-Y213 AromaticContact CE2-CD1 3.84Å; W209-Y213 HydrophobicContact CE3-CD1 4.43Å; W209-Y213 AromaticContact CE3-CE1 3.85Å; W209-Y213 HydrophobicContact CE3-CE1 3.85Å; W209-Y213 HydrophobicContact CG-CD1 4.07Å; W209-Y213 HydrophobicContact CG-CE1 4.23Å; W209-Y213 HydrophobicContact CZ2-CD1 4.42Å; W209-Y213 HydrophobicContact CZ2-CE1 4.44Å; W209-Y213 HydrophobicContact CZ3-CE1 4.28Å; W209-Y213 AromaticContact NE1-CD1 3.85Å; W209-Y213 WeakPolarHBondContact O-CD1 3.26Å; W209-Y213 PolarHBondContact O-N 2.99Å; T210-Y213 VanDerWaalsContact CA-CZ 3.45Å; T210-Y213 WeakPolarHBondContact CB-OH 3.34Å; T210-Y213 HydrophobicContact CG2-CE2 4.04Å; T210-Y213 WeakPolarHBondContact CG2-OH 3.08Å; T210-Y213 PolarHBondContact OG1-OH 2.97Å; Y213-Y217 WeakPolarHBondContact O-CB 3.2Å; Y213-Y217 PolarHBondContact O-N 3.37Å; Y213-F299 AromaticContact CD2-CD2 3.7Å; Y213-F299 HydrophobicContact CD2-CD2 3.7Å; Y213-F299 AromaticContact CD2-CE2 3.56Å; Y213-F299 HydrophobicContact CD2-CE2 3.56Å; Y213-F299 HydrophobicContact CE2-CD2 4.47Å; Y213-F299 AromaticContact CE2-CE2 3.87Å; Y213-F299 HydrophobicContact CE2-CE2 3.87Å; Y213-F299 HydrophobicContact CG-CD2 4.45Å; Y213-S302 WeakPolarHBondContact CB-OG 3.12Å
214	D	98.5	Very high	98.3	Very high	13 Å²	13	20.7 Å²	20.7	7%	0.07	10%	0.102	C	C	.	.	H	α-helix	trans	-84.1	-29.6	-174.9	-160.2	73.6	0	0	0	112.2	Q172 L175 T210 I212 I216 Y217 A218	Q172-D214 HydrophobicContact CG-CB 4.06Å; Q172-D214 WeakPolarHBondContact CG-OD2 3.5Å; Q172-D214 PolarHBondContact NE2-OD2 3.46Å; L175-D214 HydrophobicContact CD2-CB 3.83Å; L175-D214 VanDerWaalsContact CD2-OD1 3.31Å; L175-D214 WeakPolarHBondContact CD2-OD1 3.44Å; L175-D214 VanDerWaalsContact CD2-OD2 3.29Å; L175-D214 WeakPolarHBondContact CD2-OD2 3.21Å; T210-D214 HydrophobicContact CG2-CB 4.49Å; T210-D214 WeakPolarHBondContact O-CB 3.11Å; T210-D214 PolarHBondContact O-N 3.45Å; I212-D214 VanDerWaalsContact C-N 3.34Å; I212-D214 PolarHBondContact O-N 3.18Å; D214-I216 VanDerWaalsContact C-N 3.34Å; D214-Y217 WeakPolarHBondContact O-CB 3.07Å; D214-Y217 PolarHBondContact O-N 2.96Å; D214-A218 WeakPolarHBondContact O-CB 3.29Å; D214-A218 PolarHBondContact O-N 2.94Å
215	T	98.8	Very high	98.2	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-63.1	-44	167.1	-58.7	0	0	0	0	110.2	I211 Y217 A218 H219 T233 A234 F237 T241 L245	I211-T215 WeakPolarHBondContact O-CB 3.22Å; I211-T215 PolarHBondContact O-N 3.47Å; I211-T215 PolarHBondContact O-OG1 3.48Å; T215-Y217 VanDerWaalsContact C-N 3.32Å; T215-Y217 PolarHBondContact O-N 3.36Å; T215-A218 PolarHBondContact O-N 2.91Å; T215-H219 PolarHBondContact O-CD2 3Å; T215-H219 VanDerWaalsContact O-CD2 3.24Å; T215-H219 PolarHBondContact O-N 3.39Å; T215-T233 WeakPolarHBondContact CB-OG1 3.22Å; T215-T233 WeakPolarHBondContact CG2-OG1 3.44Å; T215-T233 PolarHBondContact OG1-OG1 2.94Å; T215-A234 HydrophobicContact CG2-CB 4.46Å; T215-F237 HydrophobicContact CG2-CD2 4.02Å; T215-F237 HydrophobicContact CG2-CE2 4.41Å; T215-T241 HydrophobicContact CG2-CG2 3.9Å; T215-L245 HydrophobicContact CG2-CD2 4.11Å
216	I	98.8	Very high	98.1	Very high	2 Å²	2	22.3 Å²	22.3	1%	0.01	11%	0.114	C	C	.	.	H	α-helix	trans	-60.4	-44.7	173.6	-69.2	170.2	0	0	0	110.4	I212 D214 A218 H219 L245 T287 L289 C295 T298	I212-I216 HydrophobicContact CG2-CD1 4.35Å; I212-I216 WeakPolarHBondContact O-CG1 3.42Å; I212-I216 PolarHBondContact O-N 3.23Å; D214-I216 VanDerWaalsContact C-N 3.34Å; I216-A218 VanDerWaalsContact C-N 3.32Å; I216-A218 PolarHBondContact O-N 2.93Å; I216-H219 WeakPolarHBondContact O-CB 3.46Å; I216-H219 PolarHBondContact O-N 2.85Å; I216-L245 HydrophobicContact CD1-CD1 3.72Å; I216-L245 HydrophobicContact CG1-CD1 3.5Å; I216-L245 VanDerWaalsContact CG1-CD1 3.5Å; I216-T287 HydrophobicContact CG2-CG2 3.76Å; I216-L289 HydrophobicContact CG1-CD2 4.28Å; I216-C295 HydrophobicContact CG2-CB 4.14Å; I216-C295 WeakPolarHBondContact O-CB 3.26Å; I216-T298 HydrophobicContact CD1-CG2 3.83Å; I216-T298 HydrophobicContact CG2-CG2 3.98Å
217	Y	98.3	Very high	98	Very high	40 Å²	40	30 Å²	30	16%	0.157	14%	0.143	C	C	.	.	H	α-helix	trans	-58.3	-42.8	177.9	-178.9	-107.6	0	0	0	112.3	R109 Y213 D214 T215 H219 Q220 W296 F299	R109-Y217 PolarHBondContact NH1-OH 2.99Å; Y213-Y217 WeakPolarHBondContact O-CB 3.2Å; Y213-Y217 PolarHBondContact O-N 3.37Å; D214-Y217 WeakPolarHBondContact O-CB 3.07Å; D214-Y217 PolarHBondContact O-N 2.96Å; T215-Y217 VanDerWaalsContact C-N 3.32Å; T215-Y217 PolarHBondContact O-N 3.36Å; Y217-H219 VanDerWaalsContact C-N 3.26Å; Y217-H219 PolarHBondContact O-N 3.11Å; Y217-Q220 WeakPolarHBondContact O-CB 3.41Å; Y217-Q220 WeakPolarHBondContact O-CG 3.36Å; Y217-Q220 PolarHBondContact O-N 2.85Å; Y217-Q220 PolarHBondContact O-NE2 3.35Å; Y217-W296 HydrophobicContact CD2-CE3 4.06Å; Y217-W296 HydrophobicContact CD2-CZ3 4.27Å; Y217-W296 AromaticContact CE2-CE3 3.61Å; Y217-W296 HydrophobicContact CE2-CE3 3.61Å; Y217-W296 AromaticContact CE2-CZ3 3.58Å; Y217-W296 HydrophobicContact CE2-CZ3 3.58Å; Y217-F299 HydrophobicContact CD2-CB 3.84Å; Y217-F299 AromaticContact CD2-CD1 3.7Å; Y217-F299 HydrophobicContact CD2-CD1 3.7Å; Y217-F299 AromaticContact CD2-CD2 3.76Å; Y217-F299 HydrophobicContact CD2-CD2 3.76Å; Y217-F299 HydrophobicContact CD2-CE1 4.14Å; Y217-F299 HydrophobicContact CD2-CE2 4.18Å; Y217-F299 AromaticContact CD2-CG 3.48Å; Y217-F299 HydrophobicContact CD2-CG 3.48Å; Y217-F299 VanDerWaalsContact CD2-CG 3.48Å; Y217-F299 HydrophobicContact CD2-CZ 4.36Å; Y217-F299 HydrophobicContact CE2-CD1 4.02Å; Y217-F299 HydrophobicContact CE2-CE1 4.2Å; Y217-F299 HydrophobicContact CE2-CG 4.27Å; Y217-F299 HydrophobicContact CG-CB 4.47Å; Y217-F299 AromaticContact CG-CD2 3.81Å; Y217-F299 HydrophobicContact CG-CD2 3.81Å; Y217-F299 HydrophobicContact CG-CE2 4.09Å; Y217-F299 HydrophobicContact CG-CG 4.02Å
218	A	98.3	Very high	97.9	Very high	10 Å²	10	30.4 Å²	30.4	8%	0.083	15%	0.146	C	C	.	.	H	α-helix	trans	-65.8	-22.7	-179.1	0	0	0	0	0	113.9	D214 T215 I216 Q220 D221 A234	D214-A218 WeakPolarHBondContact O-CB 3.29Å; D214-A218 PolarHBondContact O-N 2.94Å; T215-A218 PolarHBondContact O-N 2.91Å; I216-A218 VanDerWaalsContact C-N 3.32Å; I216-A218 PolarHBondContact O-N 2.93Å; A218-Q220 PolarHBondContact O-N 3.39Å; A218-Q220 VanDerWaalsContact O-N 3.1Å; A218-D221 PolarHBondContact O-N 3.43Å; A218-A234 HydrophobicContact CB-CB 3.8Å
219	H	98.5	Very high	97.7	Very high	12 Å²	12	31.8 Å²	31.8	6%	0.056	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-14.6	172.9	-84.2	-76.7	0	0	0	113.7	T215 I216 Y217 D221 T241	T215-H219 PolarHBondContact O-CD2 3Å; T215-H219 VanDerWaalsContact O-CD2 3.24Å; T215-H219 PolarHBondContact O-N 3.39Å; I216-H219 WeakPolarHBondContact O-CB 3.46Å; I216-H219 PolarHBondContact O-N 2.85Å; Y217-H219 VanDerWaalsContact C-N 3.26Å; Y217-H219 PolarHBondContact O-N 3.11Å; H219-D221 VanDerWaalsContact C-N 3.27Å; H219-D221 PolarHBondContact O-N 3.38Å; H219-T241 PolarHBondContact CE1-OG1 3.39Å; H219-T241 WeakPolarHBondContact NE2-CG2 3.39Å; H219-T241 PolarHBondContact NE2-OG1 2.94Å
220	Q	98	Very high	97.6	Very high	29 Å²	29	32.5 Å²	32.5	14%	0.136	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-31.4	174.4	-77.9	170.8	92	0	0	114.1	Y217 A218 P292 C295	Y217-Q220 WeakPolarHBondContact O-CB 3.41Å; Y217-Q220 WeakPolarHBondContact O-CG 3.36Å; Y217-Q220 PolarHBondContact O-N 2.85Å; Y217-Q220 PolarHBondContact O-NE2 3.35Å; A218-Q220 PolarHBondContact O-N 3.39Å; A218-Q220 VanDerWaalsContact O-N 3.1Å; Q220-P292 HydrophobicContact CB-CB 4.22Å; Q220-P292 HydrophobicContact CG-CB 3.99Å; Q220-P292 VanDerWaalsContact CG-O 3.3Å; Q220-P292 WeakPolarHBondContact CG-O 3.45Å; Q220-C295 HydrophobicContact CG-CB 3.84Å
221	D	96.7	Very high	97.5	Very high	14 Å²	14	35.1 Å²	35.1	8%	0.075	18%	0.181	C	C	.	.	S	Bend	trans	-117.8	11.7	-171.1	-53.5	-56.1	0	0	0	112.1	V107 R109 A218 H219 D223 D224 D225	V107-D221 HydrophobicContact CG1-CB 4.24Å; R109-D221 WeakPolarHBondContact CB-OD1 3.41Å; R109-D221 WeakPolarHBondContact CD-OD1 3.35Å; R109-D221 IonicContact CZ-OD1 3.55Å; R109-D221 IonicContact CZ-OD2 3.86Å; R109-D221 IonicContact NE-OD1 3.02Å; R109-D221 PolarHBondContact NE-OD1 3.4Å; R109-D221 IonicContact NE-OD2 2.87Å; R109-D221 PolarHBondContact NE-OD2 2.94Å; R109-D221 IonicContact NH2-OD2 3.3Å; R109-D221 PolarHBondContact NH2-OD2 3.35Å; A218-D221 PolarHBondContact O-N 3.43Å; H219-D221 VanDerWaalsContact C-N 3.27Å; H219-D221 PolarHBondContact O-N 3.38Å; D221-D223 VanDerWaalsContact C-N 3.28Å; D221-D223 PolarHBondContact O-N 3.36Å; D221-D223 VanDerWaalsContact O-N 3.12Å; D221-D224 PolarHBondContact O-N 2.67Å; D221-D225 WeakPolarHBondContact O-CB 3.46Å; D221-D225 PolarHBondContact O-N 3.5Å
222	I	96.9	Very high	97.5	Very high	34 Å²	34	35.3 Å²	35.3	17%	0.174	18%	0.182	C	C	.	.	H	α-helix	trans	-53.3	-41.8	-169.5	-166.9	168.3	0	0	0	113.3	I226 I235	I222-I226 HydrophobicContact CG1-CD1 3.95Å; I222-I226 HydrophobicContact CG1-CG1 4.5Å; I222-I226 WeakPolarHBondContact O-CB 3.27Å; I222-I226 WeakPolarHBondContact O-CD1 3.5Å; I222-I226 WeakPolarHBondContact O-CG1 3.41Å; I222-I226 PolarHBondContact O-N 3Å; I222-I235 HydrophobicContact CD1-CG1 4.4Å; I222-I235 HydrophobicContact CG1-CG1 3.86Å
223	D	96.2	Very high	97.4	Very high	129 Å²	129	35 Å²	35	69%	0.69	18%	0.18	S	C	*	.	H	α-helix	trans	-67.6	-43.6	179.7	-62.1	-34.9	0	0	0	112.2	D221 R227	D221-D223 VanDerWaalsContact C-N 3.28Å; D221-D223 PolarHBondContact O-N 3.36Å; D221-D223 VanDerWaalsContact O-N 3.12Å; D223-R227 WeakPolarHBondContact O-CB 3.32Å; D223-R227 PolarHBondContact O-N 3.45Å
224	D	97.1	Very high	97.4	Very high	11 Å²	11	35 Å²	35	6%	0.059	18%	0.18	C	C	.	.	H	α-helix	trans	-70.2	-40.6	179	-76.4	-25.1	0	0	0	109.9	V107 K108 D221 R227 I228	V107-D224 HydrophobicContact CB-CB 4.4Å; V107-D224 HydrophobicContact CG1-CB 4.17Å; V107-D224 HydrophobicContact CG2-CB 4.15Å; K108-D224 WeakPolarHBondContact CB-OD2 3.39Å; K108-D224 WeakPolarHBondContact CG-OD2 3.48Å; K108-D224 PolarHBondContact N-OD2 3.27Å; D221-D224 PolarHBondContact O-N 2.67Å; D224-R227 WeakPolarHBondContact O-CB 3.17Å; D224-R227 PolarHBondContact O-N 2.92Å; D224-R227 IonicContact OD1-CZ 3.75Å; D224-R227 IonicContact OD1-NH2 3.89Å; D224-R227 PolarHBondContact OD1-NH2 3.36Å; D224-I228 VanDerWaalsContact O-CG1 3.31Å; D224-I228 WeakPolarHBondContact O-CG1 2.98Å; D224-I228 WeakPolarHBondContact O-CG2 3.5Å; D224-I228 PolarHBondContact O-N 2.97Å
225	D	97.1	Very high	97.4	Very high	19 Å²	19	36.1 Å²	36.1	10%	0.102	19%	0.186	C	C	.	.	H	α-helix	trans	-62.7	-45.3	178.5	-77.2	-13.1	0	0	0	111.7	D221 R227 I228 G229 V230 I235	D221-D225 WeakPolarHBondContact O-CB 3.46Å; D221-D225 PolarHBondContact O-N 3.5Å; D225-R227 VanDerWaalsContact C-N 3.33Å; D225-R227 PolarHBondContact O-N 2.96Å; D225-I228 PolarHBondContact O-N 3.22Å; D225-G229 PolarHBondContact O-N 2.69Å; D225-V230 HydrophobicContact CB-CB 4.1Å; D225-V230 HydrophobicContact CB-CG1 4.2Å; D225-V230 PolarHBondContact O-N 3.29Å; D225-I235 HydrophobicContact CB-CD1 3.92Å
226	I	96.9	Very high	97.4	Very high	102 Å²	102	39.9 Å²	39.9	52%	0.523	21%	0.205	S	C	.	.	H	α-helix	trans	-58.7	-46.4	174.1	-72.1	167.2	0	0	0	110.3	I222 I228 G229 I235	I222-I226 HydrophobicContact CG1-CD1 3.95Å; I222-I226 HydrophobicContact CG1-CG1 4.5Å; I222-I226 WeakPolarHBondContact O-CB 3.27Å; I222-I226 WeakPolarHBondContact O-CD1 3.5Å; I222-I226 WeakPolarHBondContact O-CG1 3.41Å; I222-I226 PolarHBondContact O-N 3Å; I226-I228 VanDerWaalsContact C-N 3.31Å; I226-I228 PolarHBondContact O-N 3.4Å; I226-G229 PolarHBondContact O-N 2.76Å; I226-I235 HydrophobicContact CD1-CG1 4.45Å; I226-I235 HydrophobicContact CG1-CD1 3.87Å; I226-I235 HydrophobicContact CG1-CG1 3.93Å; I226-I235 HydrophobicContact CG1-CG2 4.19Å
227	R	96.8	Very high	97.4	Very high	162 Å²	162	40.3 Å²	40.3	61%	0.611	21%	0.207	S	C	*	.	H	α-helix	trans	-61.9	-37.4	-178.2	-178.4	-178.1	65.5	-174.6	-5.5	112.7	L106 D223 D224 D225	L106-R227 PolarHBondContact O-NH2 3.3Å; D223-R227 WeakPolarHBondContact O-CB 3.32Å; D223-R227 PolarHBondContact O-N 3.45Å; D224-R227 WeakPolarHBondContact O-CB 3.17Å; D224-R227 PolarHBondContact O-N 2.92Å; D224-R227 IonicContact OD1-CZ 3.75Å; D224-R227 IonicContact OD1-NH2 3.89Å; D224-R227 PolarHBondContact OD1-NH2 3.36Å; D225-R227 VanDerWaalsContact C-N 3.33Å; D225-R227 PolarHBondContact O-N 2.96Å
228	I	96.1	Very high	97.2	Very high	33 Å²	33	39.7 Å²	39.7	17%	0.169	21%	0.213	C	C	.	.	H	α-helix	trans	-96.1	1.8	-177.3	71.3	-174.3	0	0	0	113.4	Y103 L106 V107 D224 D225 I226 V230	Y103-I228 HydrophobicContact CD1-CD1 4.12Å; Y103-I228 HydrophobicContact CD1-CG1 4.34Å; L106-I228 HydrophobicContact CB-CG2 3.82Å; L106-I228 HydrophobicContact CD1-CG2 4.07Å; V107-I228 HydrophobicContact CG2-CD1 3.49Å; V107-I228 VanDerWaalsContact CG2-CD1 3.49Å; D224-I228 VanDerWaalsContact O-CG1 3.31Å; D224-I228 WeakPolarHBondContact O-CG1 2.98Å; D224-I228 WeakPolarHBondContact O-CG2 3.5Å; D224-I228 PolarHBondContact O-N 2.97Å; D225-I228 PolarHBondContact O-N 3.22Å; I226-I228 VanDerWaalsContact C-N 3.31Å; I226-I228 PolarHBondContact O-N 3.4Å; I228-V230 VanDerWaalsContact C-N 3.33Å; I228-V230 HydrophobicContact CD1-CB 4.32Å; I228-V230 HydrophobicContact CD1-CG2 3.78Å; I228-V230 HydrophobicContact CG1-CB 4.04Å; I228-V230 HydrophobicContact CG1-CG2 3.74Å; I228-V230 PolarHBondContact O-N 3.27Å
229	G	94.8	Very high	97.1	Very high	48 Å²	48	48.4 Å²	48.4	50%	0.495	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.1	20.4	179.2	0	0	0	0	0	114.7	D225 I226	D225-G229 PolarHBondContact O-N 2.69Å; I226-G229 PolarHBondContact O-N 2.76Å
230	V	96.1	Very high	97.1	Very high	18 Å²	18	54.1 Å²	54.1	11%	0.109	28%	0.277	C	S	.	.			trans	-77.9	136.3	170.7	165.5	0	0	0	0	108.8	Y103 K165 D225 I228 I235	Y103-V230 HydrophobicContact CD1-CG2 3.68Å; Y103-V230 HydrophobicContact CE1-CG2 4.1Å; Y103-V230 HydrophobicContact CG-CG2 4.23Å; K165-V230 HydrophobicContact CB-CG1 4.32Å; D225-V230 HydrophobicContact CB-CB 4.1Å; D225-V230 HydrophobicContact CB-CG1 4.2Å; D225-V230 PolarHBondContact O-N 3.29Å; I228-V230 VanDerWaalsContact C-N 3.33Å; I228-V230 HydrophobicContact CD1-CB 4.32Å; I228-V230 HydrophobicContact CD1-CG2 3.78Å; I228-V230 HydrophobicContact CG1-CB 4.04Å; I228-V230 HydrophobicContact CG1-CG2 3.74Å; I228-V230 PolarHBondContact O-N 3.27Å; V230-I235 WeakPolarHBondContact O-CD1 3.39Å
231	K	97.5	Very high	97.1	Very high	55 Å²	55	52.8 Å²	52.8	24%	0.239	27%	0.27	C	S	.	.			trans	-107.2	147.6	-174.1	-61	171.6	-177.1	151	0	110.7	K165 R166 V167 T168 Y169 P171	K165-K231 WeakPolarHBondContact O-CB 3.19Å; K165-K231 PolarHBondContact O-N 3.25Å; R166-K231 PolarHBondContact O-NZ 3.41Å; V167-K231 PolarHBondContact O-NZ 3.03Å; T168-K231 WeakPolarHBondContact O-CB 3.3Å; Y169-K231 HydrophobicContact CD1-CB 3.82Å; Y169-K231 HydrophobicContact CD1-CG 4.15Å; Y169-K231 HydrophobicContact CD2-CD 4.05Å; Y169-K231 HydrophobicContact CD2-CG 4.37Å; Y169-K231 HydrophobicContact CE1-CB 4.04Å; Y169-K231 HydrophobicContact CE1-CG 3.91Å; Y169-K231 HydrophobicContact CE2-CD 3.94Å; Y169-K231 HydrophobicContact CE2-CG 4.15Å; Y169-K231 HydrophobicContact CG-CB 4.08Å; Y169-K231 HydrophobicContact CG-CD 4.42Å; Y169-K231 HydrophobicContact CG-CG 4.37Å; P171-K231 WeakPolarHBondContact CG-O 3.26Å
232	S	98.1	Very high	97.2	Very high	3 Å²	3	56.1 Å²	56.1	2%	0.021	28%	0.284	C	S	.	.			trans	-158.5	164.2	177	64.8	0	0	0	0	111.2	Y169 A234 I235 L236	Y169-S232 CarbonylContact O-C 3.48Å; S232-A234 PolarHBondContact O-N 2.98Å; S232-A234 PolarHBondContact OG-N 2.87Å; S232-I235 PolarHBondContact O-N 3.4Å; S232-I235 PolarHBondContact OG-N 3.18Å; S232-L236 PolarHBondContact O-N 2.99Å; S232-L236 VanDerWaalsContact O-N 3.07Å
233	T	98.3	Very high	97.3	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64	-26.8	171.9	48.9	0	0	0	0	111.8	Y169 W170 Q172 T215 I235 L236 F237	Y169-T233 WeakPolarHBondContact O-CA 3.47Å; Y169-T233 WeakPolarHBondContact O-CG2 3.48Å; Y169-T233 PolarHBondContact O-N 3.4Å; W170-T233 HydrophobicContact CD2-CG2 4.18Å; W170-T233 HydrophobicContact CE3-CG2 3.53Å; W170-T233 HydrophobicContact CZ3-CG2 3.97Å; Q172-T233 HydrophobicContact CB-CG2 3.99Å; Q172-T233 HydrophobicContact CG-CG2 4.31Å; Q172-T233 VanDerWaalsContact CG-OG1 3.28Å; Q172-T233 WeakPolarHBondContact CG-OG1 3.44Å; Q172-T233 PolarHBondContact OE1-OG1 3.3Å; T215-T233 WeakPolarHBondContact CB-OG1 3.22Å; T215-T233 WeakPolarHBondContact CG2-OG1 3.44Å; T215-T233 PolarHBondContact OG1-OG1 2.94Å; T233-I235 VanDerWaalsContact C-N 3.34Å; T233-I235 PolarHBondContact O-N 3.32Å; T233-L236 PolarHBondContact O-N 2.89Å; T233-F237 HydrophobicContact CG2-CE2 4.19Å; T233-F237 HydrophobicContact CG2-CZ 4.18Å; T233-F237 VanDerWaalsContact O-CB 3.29Å; T233-F237 WeakPolarHBondContact O-CB 3.49Å; T233-F237 WeakPolarHBondContact O-CD2 3.42Å; T233-F237 VanDerWaalsContact O-CG 3.23Å; T233-F237 WeakPolarHBondContact O-CG 3.47Å; T233-F237 PolarHBondContact O-N 3.24Å
234	A	98.3	Very high	97.4	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60.9	-43.4	173.9	0	0	0	0	0	111.5	T215 A218 S232 G238	T215-A234 HydrophobicContact CG2-CB 4.46Å; A218-A234 HydrophobicContact CB-CB 3.8Å; S232-A234 PolarHBondContact O-N 2.98Å; S232-A234 PolarHBondContact OG-N 2.87Å; A234-G238 WeakPolarHBondContact O-CA 3.44Å; A234-G238 PolarHBondContact O-N 3.03Å
235	I	98.2	Very high	97.5	Very high	38 Å²	38	58.4 Å²	58.4	20%	0.195	29%	0.29	C	S	.	.	H	α-helix	trans	-70.1	-44.2	175.7	-62.2	166.6	0	0	0	110.9	Y169 I222 D225 I226 V230 S232 T233	Y169-I235 HydrophobicContact CD1-CB 4.27Å; Y169-I235 HydrophobicContact CD1-CG2 4.27Å; Y169-I235 HydrophobicContact CE1-CB 4.12Å; Y169-I235 HydrophobicContact CE1-CG2 3.67Å; I222-I235 HydrophobicContact CD1-CG1 4.4Å; I222-I235 HydrophobicContact CG1-CG1 3.86Å; D225-I235 HydrophobicContact CB-CD1 3.92Å; I226-I235 HydrophobicContact CD1-CG1 4.45Å; I226-I235 HydrophobicContact CG1-CD1 3.87Å; I226-I235 HydrophobicContact CG1-CG1 3.93Å; I226-I235 HydrophobicContact CG1-CG2 4.19Å; V230-I235 WeakPolarHBondContact O-CD1 3.39Å; S232-I235 PolarHBondContact O-N 3.4Å; S232-I235 PolarHBondContact OG-N 3.18Å; T233-I235 VanDerWaalsContact C-N 3.34Å; T233-I235 PolarHBondContact O-N 3.32Å
236	L	98.2	Very high	97.5	Very high	78 Å²	78	58.8 Å²	58.8	41%	0.408	30%	0.298	S	S	.	.	H	α-helix	trans	-63	-44	-178.7	178.7	65.1	0	0	0	113.2	Y169 W170 S232 T233	Y169-L236 HydrophobicContact CD1-CB 4.09Å; Y169-L236 HydrophobicContact CG-CB 4.19Å; Y169-L236 HydrophobicContact CG-CD1 4.44Å; W170-L236 HydrophobicContact CD2-CD2 4.16Å; W170-L236 VanDerWaalsContact CE2-CD2 3.42Å; W170-L236 HydrophobicContact CH2-CD2 4.39Å; W170-L236 HydrophobicContact CZ2-CD2 3.56Å; S232-L236 PolarHBondContact O-N 2.99Å; S232-L236 VanDerWaalsContact O-N 3.07Å; T233-L236 PolarHBondContact O-N 2.89Å
237	F	98.4	Very high	97.6	Very high	11 Å²	11	56.3 Å²	56.3	5%	0.048	29%	0.292	C	S	.	.	H	α-helix	trans	-81.9	-28.4	-178	-61.2	-23	0	0	0	112.4	W170 T215 T233 E239 K240 T241 Y244 F248	W170-F237 AromaticContact CH2-CE1 3.59Å; W170-F237 HydrophobicContact CH2-CE1 3.59Å; W170-F237 AromaticContact CH2-CZ 3.48Å; W170-F237 HydrophobicContact CH2-CZ 3.48Å; W170-F237 VanDerWaalsContact CH2-CZ 3.48Å; W170-F237 HydrophobicContact CZ2-CE1 4.08Å; W170-F237 HydrophobicContact CZ2-CZ 4.36Å; W170-F237 HydrophobicContact CZ3-CE1 4.13Å; W170-F237 AromaticContact CZ3-CZ 3.58Å; W170-F237 HydrophobicContact CZ3-CZ 3.58Å; T215-F237 HydrophobicContact CG2-CD2 4.02Å; T215-F237 HydrophobicContact CG2-CE2 4.41Å; T233-F237 HydrophobicContact CG2-CE2 4.19Å; T233-F237 HydrophobicContact CG2-CZ 4.18Å; T233-F237 VanDerWaalsContact O-CB 3.29Å; T233-F237 WeakPolarHBondContact O-CB 3.49Å; T233-F237 WeakPolarHBondContact O-CD2 3.42Å; T233-F237 VanDerWaalsContact O-CG 3.23Å; T233-F237 WeakPolarHBondContact O-CG 3.47Å; T233-F237 PolarHBondContact O-N 3.24Å; F237-E239 PolarHBondContact O-N 3.29Å; F237-K240 WeakPolarHBondContact O-CA 3.21Å; F237-K240 WeakPolarHBondContact O-CB 3.13Å; F237-K240 PolarHBondContact O-N 3.43Å; F237-T241 PolarHBondContact O-N 3.36Å; F237-Y244 HydrophobicContact CB-CD2 3.7Å; F237-Y244 HydrophobicContact CB-CE2 4.24Å; F237-Y244 HydrophobicContact CD1-CD1 4.31Å; F237-Y244 AromaticContact CD1-CD2 3.45Å; F237-Y244 HydrophobicContact CD1-CD2 3.45Å; F237-Y244 VanDerWaalsContact CD1-CD2 3.45Å; F237-Y244 AromaticContact CD1-CE2 3.81Å; F237-Y244 HydrophobicContact CD1-CE2 3.81Å; F237-Y244 AromaticContact CD1-CG 3.72Å; F237-Y244 HydrophobicContact CD1-CG 3.72Å; F237-Y244 HydrophobicContact CD2-CD2 4.22Å; F237-Y244 HydrophobicContact CD2-CG 4.23Å; F237-Y244 HydrophobicContact CE1-CD1 4.17Å; F237-Y244 HydrophobicContact CE1-CD2 4.12Å; F237-Y244 AromaticContact CE1-CG 3.9Å; F237-Y244 HydrophobicContact CE1-CG 3.9Å; F237-Y244 HydrophobicContact CE2-CG 4.39Å; F237-Y244 AromaticContact CG-CD2 3.52Å; F237-Y244 HydrophobicContact CG-CD2 3.52Å; F237-Y244 HydrophobicContact CG-CE2 4.21Å; F237-Y244 AromaticContact CG-CG 3.9Å; F237-Y244 HydrophobicContact CG-CG 3.9Å; F237-Y244 HydrophobicContact CZ-CG 4.23Å; F237-F248 HydrophobicContact CE2-CE2 4.15Å; F237-F248 AromaticContact CZ-CE2 3.9Å; F237-F248 HydrophobicContact CZ-CE2 3.9Å
238	G	95.8	Very high	97.7	Very high	27 Å²	27	50.1 Å²	50.1	28%	0.278	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	49.1	-127.6	177.6	0	0	0	0	0	112	A234 K240 T241	A234-G238 WeakPolarHBondContact O-CA 3.44Å; A234-G238 PolarHBondContact O-N 3.03Å; G238-K240 PolarHBondContact O-N 2.99Å; G238-T241 WeakPolarHBondContact O-CB 3.46Å; G238-T241 PolarHBondContact O-N 2.89Å; G238-T241 VanDerWaalsContact O-N 3.1Å; G238-T241 PolarHBondContact O-OG1 3.39Å
239	E	95.5	Very high	97.9	Very high	194 Å²	194	50 Å²	50	91%	0.907	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-63	-25.9	180	-57.6	-169.5	151.8	0	0	113.7	F237 T241	F237-E239 PolarHBondContact O-N 3.29Å; E239-T241 PolarHBondContact O-N 2.82Å
240	K	97.9	Very high	98.1	Very high	132 Å²	132	53.7 Å²	53.7	57%	0.574	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-84.2	6	178.4	-63.6	-176.9	-178.3	179.3	0	113	F237 G238 K242 L243 Y244	F237-K240 WeakPolarHBondContact O-CA 3.21Å; F237-K240 WeakPolarHBondContact O-CB 3.13Å; F237-K240 PolarHBondContact O-N 3.43Å; G238-K240 PolarHBondContact O-N 2.99Å; K240-K242 VanDerWaalsContact C-N 3.35Å; K240-K242 PolarHBondContact O-N 2.95Å; K240-L243 WeakPolarHBondContact O-CB 3.37Å; K240-L243 PolarHBondContact O-N 3.45Å; K240-Y244 HydrophobicContact CB-CD2 4Å; K240-Y244 HydrophobicContact CB-CE2 3.69Å; K240-Y244 HydrophobicContact CD-CE2 4.49Å; K240-Y244 VanDerWaalsContact O-CD2 3.31Å; K240-Y244 WeakPolarHBondContact O-CD2 3.41Å; K240-Y244 PolarHBondContact O-N 2.87Å
241	T	98.7	Very high	98.2	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-46.1	-54.2	-178.7	-68	0	0	0	0	112.3	T215 H219 F237 G238 E239 L243 Y244 L245 L289	T215-T241 HydrophobicContact CG2-CG2 3.9Å; H219-T241 PolarHBondContact CE1-OG1 3.39Å; H219-T241 WeakPolarHBondContact NE2-CG2 3.39Å; H219-T241 PolarHBondContact NE2-OG1 2.94Å; F237-T241 PolarHBondContact O-N 3.36Å; G238-T241 WeakPolarHBondContact O-CB 3.46Å; G238-T241 PolarHBondContact O-N 2.89Å; G238-T241 VanDerWaalsContact O-N 3.1Å; G238-T241 PolarHBondContact O-OG1 3.39Å; E239-T241 PolarHBondContact O-N 2.82Å; T241-L243 PolarHBondContact O-N 3.35Å; T241-L243 VanDerWaalsContact O-N 3.17Å; T241-Y244 PolarHBondContact O-N 3.43Å; T241-Y244 VanDerWaalsContact O-N 3.11Å; T241-L245 HydrophobicContact CG2-CD1 3.86Å; T241-L245 HydrophobicContact CG2-CD2 4.47Å; T241-L245 HydrophobicContact CG2-CG 3.91Å; T241-L245 VanDerWaalsContact O-CG 3.29Å; T241-L245 WeakPolarHBondContact O-CG 3.43Å; T241-L245 PolarHBondContact O-N 3.16Å; T241-L289 HydrophobicContact CG2-CD1 3.66Å; T241-L289 HydrophobicContact CG2-CD2 4.42Å
242	K	98.5	Very high	98.2	Very high	84 Å²	84	51.4 Å²	51.4	37%	0.365	27%	0.27	S	S	.	.	H	α-helix	trans	-59.5	-32.1	-177	-69.5	-168.2	176.7	-175.7	0	113.6	K240 G246 I284 R285 T287 L289	K240-K242 VanDerWaalsContact C-N 3.35Å; K240-K242 PolarHBondContact O-N 2.95Å; K242-G246 PolarHBondContact O-N 2.79Å; K242-I284 HydrophobicContact CB-CG2 4.42Å; K242-I284 WeakPolarHBondContact CE-O 3.45Å; K242-I284 HydrophobicContact CG-CG2 4.4Å; K242-I284 PolarHBondContact NZ-O 3.1Å; K242-R285 PolarHBondContact NZ-O 3.26Å; K242-T287 WeakPolarHBondContact CE-O 3.46Å; K242-T287 PolarHBondContact NZ-O 3.47Å; K242-L289 HydrophobicContact CG-CD1 4.03Å
243	L	98.4	Very high	98.3	Very high	124 Å²	124	52.9 Å²	52.9	65%	0.649	28%	0.279	S	S	*	.	H	α-helix	trans	-65.9	-50	175.7	176.5	65.1	0	0	0	110.8	K240 T241 L245 G246 A247	K240-L243 WeakPolarHBondContact O-CB 3.37Å; K240-L243 PolarHBondContact O-N 3.45Å; T241-L243 PolarHBondContact O-N 3.35Å; T241-L243 VanDerWaalsContact O-N 3.17Å; L243-L245 VanDerWaalsContact C-N 3.32Å; L243-L245 PolarHBondContact O-N 2.99Å; L243-G246 WeakPolarHBondContact O-CA 3.28Å; L243-G246 PolarHBondContact O-N 3.07Å; L243-G246 VanDerWaalsContact O-N 3.09Å; L243-A247 PolarHBondContact O-N 3.34Å; L243-A247 VanDerWaalsContact O-N 3.15Å
244	Y	98.7	Very high	98.3	Very high	98 Å²	98	55.4 Å²	55.4	38%	0.384	30%	0.3	S	S	.	.	H	α-helix	trans	-64.5	-37.1	177.5	-68.2	-71.1	0	0	0	111.9	F237 K240 T241 G246 A247 F248	F237-Y244 HydrophobicContact CB-CD2 3.7Å; F237-Y244 HydrophobicContact CB-CE2 4.24Å; F237-Y244 HydrophobicContact CD1-CD1 4.31Å; F237-Y244 AromaticContact CD1-CD2 3.45Å; F237-Y244 HydrophobicContact CD1-CD2 3.45Å; F237-Y244 VanDerWaalsContact CD1-CD2 3.45Å; F237-Y244 AromaticContact CD1-CE2 3.81Å; F237-Y244 HydrophobicContact CD1-CE2 3.81Å; F237-Y244 AromaticContact CD1-CG 3.72Å; F237-Y244 HydrophobicContact CD1-CG 3.72Å; F237-Y244 HydrophobicContact CD2-CD2 4.22Å; F237-Y244 HydrophobicContact CD2-CG 4.23Å; F237-Y244 HydrophobicContact CE1-CD1 4.17Å; F237-Y244 HydrophobicContact CE1-CD2 4.12Å; F237-Y244 AromaticContact CE1-CG 3.9Å; F237-Y244 HydrophobicContact CE1-CG 3.9Å; F237-Y244 HydrophobicContact CE2-CG 4.39Å; F237-Y244 AromaticContact CG-CD2 3.52Å; F237-Y244 HydrophobicContact CG-CD2 3.52Å; F237-Y244 HydrophobicContact CG-CE2 4.21Å; F237-Y244 AromaticContact CG-CG 3.9Å; F237-Y244 HydrophobicContact CG-CG 3.9Å; F237-Y244 HydrophobicContact CZ-CG 4.23Å; K240-Y244 HydrophobicContact CB-CD2 4Å; K240-Y244 HydrophobicContact CB-CE2 3.69Å; K240-Y244 HydrophobicContact CD-CE2 4.49Å; K240-Y244 VanDerWaalsContact O-CD2 3.31Å; K240-Y244 WeakPolarHBondContact O-CD2 3.41Å; K240-Y244 PolarHBondContact O-N 2.87Å; T241-Y244 PolarHBondContact O-N 3.43Å; T241-Y244 VanDerWaalsContact O-N 3.11Å; Y244-G246 VanDerWaalsContact C-N 3.26Å; Y244-G246 PolarHBondContact O-N 3.37Å; Y244-A247 WeakPolarHBondContact O-CB 3.39Å; Y244-A247 PolarHBondContact O-N 2.68Å; Y244-F248 WeakPolarHBondContact O-CD2 3.43Å; Y244-F248 PolarHBondContact O-N 2.86Å
245	L	98.8	Very high	98.3	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-61.8	-35.4	172.6	-62.6	-167.6	0	0	0	112.3	I212 T215 I216 T241 L243 A247 F248 H249 I284	I212-L245 HydrophobicContact CG1-CD2 4.47Å; T215-L245 HydrophobicContact CG2-CD2 4.11Å; I216-L245 HydrophobicContact CD1-CD1 3.72Å; I216-L245 HydrophobicContact CG1-CD1 3.5Å; I216-L245 VanDerWaalsContact CG1-CD1 3.5Å; T241-L245 HydrophobicContact CG2-CD1 3.86Å; T241-L245 HydrophobicContact CG2-CD2 4.47Å; T241-L245 HydrophobicContact CG2-CG 3.91Å; T241-L245 VanDerWaalsContact O-CG 3.29Å; T241-L245 WeakPolarHBondContact O-CG 3.43Å; T241-L245 PolarHBondContact O-N 3.16Å; L243-L245 VanDerWaalsContact C-N 3.32Å; L243-L245 PolarHBondContact O-N 2.99Å; L245-A247 VanDerWaalsContact C-N 3.33Å; L245-F248 PolarHBondContact O-N 3.25Å; L245-H249 VanDerWaalsContact O-CB 3.3Å; L245-H249 WeakPolarHBondContact O-CB 3.35Å; L245-H249 PolarHBondContact O-N 3.24Å; L245-I284 HydrophobicContact CB-CD1 4.04Å; L245-I284 HydrophobicContact CB-CG1 4.28Å; L245-I284 HydrophobicContact CB-CG2 4.08Å; L245-I284 HydrophobicContact CD1-CG1 4.43Å; L245-I284 HydrophobicContact CD1-CG2 4.43Å
246	G	98.7	Very high	98.4	Very high	26 Å²	26	54.8 Å²	54.8	27%	0.268	30%	0.298	S	S	.	.	H	α-helix	trans	-60.6	-39.9	170.5	0	0	0	0	0	112.7	K242 L243 Y244 H249 M250	K242-G246 PolarHBondContact O-N 2.79Å; L243-G246 WeakPolarHBondContact O-CA 3.28Å; L243-G246 PolarHBondContact O-N 3.07Å; L243-G246 VanDerWaalsContact O-N 3.09Å; Y244-G246 VanDerWaalsContact C-N 3.26Å; Y244-G246 PolarHBondContact O-N 3.37Å; G246-H249 WeakPolarHBondContact O-CB 3.46Å; G246-H249 PolarHBondContact O-N 3.47Å; G246-M250 WeakPolarHBondContact O-CG 3.37Å; G246-M250 PolarHBondContact O-N 3.2Å
247	A	98.8	Very high	98.4	Very high	50 Å²	50	54.2 Å²	54.2	41%	0.413	30%	0.295	S	S	.	.	H	α-helix	trans	-65.4	-45.6	175.3	0	0	0	0	0	112.5	L243 Y244 L245 H249 M250 G251	L243-A247 PolarHBondContact O-N 3.34Å; L243-A247 VanDerWaalsContact O-N 3.15Å; Y244-A247 WeakPolarHBondContact O-CB 3.39Å; Y244-A247 PolarHBondContact O-N 2.68Å; L245-A247 VanDerWaalsContact C-N 3.33Å; A247-H249 VanDerWaalsContact C-N 3.27Å; A247-H249 PolarHBondContact O-N 3.1Å; A247-M250 HydrophobicContact CB-CE 4.47Å; A247-M250 PolarHBondContact O-N 3.5Å; A247-G251 PolarHBondContact O-N 3.39Å
248	F	98.8	Very high	98.4	Very high	32 Å²	32	56.5 Å²	56.5	14%	0.14	31%	0.31	C	S	.	.	H	α-helix	trans	-64.4	-32.2	173.8	-73.2	-74.4	0	0	0	112	W170 N208 I211 I212 F237 Y244 L245 G251 M252	W170-F248 HydrophobicContact CH2-CZ 4.32Å; W170-F248 HydrophobicContact CZ3-CE2 4.34Å; W170-F248 AromaticContact CZ3-CZ 3.88Å; W170-F248 HydrophobicContact CZ3-CZ 3.88Å; N208-F248 HydrophobicContact CB-CB 4.49Å; N208-F248 WeakPolarHBondContact CB-O 3.36Å; N208-F248 VanDerWaalsContact OD1-CD1 3.28Å; N208-F248 WeakPolarHBondContact OD1-CD1 3.44Å; N208-F248 PolarHBondContact OD1-O 3.25Å; I211-F248 HydrophobicContact CB-CD1 4.19Å; I211-F248 HydrophobicContact CB-CE1 4.44Å; I211-F248 HydrophobicContact CB-CG 4.32Å; I211-F248 HydrophobicContact CD1-CD1 3.66Å; I211-F248 HydrophobicContact CD1-CE1 3.37Å; I211-F248 HydrophobicContact CD1-CZ 4.05Å; I211-F248 HydrophobicContact CG1-CE1 4.47Å; I211-F248 HydrophobicContact CG2-CD1 4.03Å; I211-F248 HydrophobicContact CG2-CD2 3.7Å; I211-F248 HydrophobicContact CG2-CE1 4.06Å; I211-F248 HydrophobicContact CG2-CE2 3.72Å; I211-F248 HydrophobicContact CG2-CG 3.89Å; I211-F248 HydrophobicContact CG2-CZ 3.93Å; I212-F248 HydrophobicContact CD1-CB 4.18Å; I212-F248 HydrophobicContact CG1-CB 3.83Å; F237-F248 HydrophobicContact CE2-CE2 4.15Å; F237-F248 AromaticContact CZ-CE2 3.9Å; F237-F248 HydrophobicContact CZ-CE2 3.9Å; Y244-F248 WeakPolarHBondContact O-CD2 3.43Å; Y244-F248 PolarHBondContact O-N 2.86Å; L245-F248 PolarHBondContact O-N 3.25Å; F248-G251 PolarHBondContact O-N 3.3Å; F248-M252 WeakPolarHBondContact O-CB 3.29Å; F248-M252 PolarHBondContact O-N 3.23Å
249	H	98.9	Very high	98.6	Very high	31 Å²	31	55.2 Å²	55.2	14%	0.144	30%	0.297	C	S	.	.	H	α-helix	trans	-66.2	-40.9	174.1	172.2	-105.4	0	0	0	112.3	I212 L245 G246 A247 M252 T253 M277 I284	I212-H249 HydrophobicContact CD1-CB 4.04Å; L245-H249 VanDerWaalsContact O-CB 3.3Å; L245-H249 WeakPolarHBondContact O-CB 3.35Å; L245-H249 PolarHBondContact O-N 3.24Å; G246-H249 WeakPolarHBondContact O-CB 3.46Å; G246-H249 PolarHBondContact O-N 3.47Å; A247-H249 VanDerWaalsContact C-N 3.27Å; A247-H249 PolarHBondContact O-N 3.1Å; H249-M252 PolarHBondContact O-N 3.17Å; H249-T253 PolarHBondContact O-N 3.34Å; H249-T253 PolarHBondContact O-OG1 3.22Å; H249-M277 PolarHBondContact NE2-O 3.12Å; H249-I284 HydrophobicContact CB-CD1 4.05Å
250	M	98.8	Very high	98.7	Very high	126 Å²	126	46 Å²	46	62%	0.621	25%	0.254	S	S	*	.	H	α-helix	trans	-63.8	-42	171.5	-68.7	-173.1	-67	0	0	111.6	G246 A247 T253 A254	G246-M250 WeakPolarHBondContact O-CG 3.37Å; G246-M250 PolarHBondContact O-N 3.2Å; A247-M250 HydrophobicContact CB-CE 4.47Å; A247-M250 PolarHBondContact O-N 3.5Å; M250-T253 WeakPolarHBondContact O-CB 3.36Å; M250-T253 PolarHBondContact O-N 3.46Å; M250-A254 PolarHBondContact O-N 3.03Å
251	G	98.8	Very high	98.8	Very high	23 Å²	23	44.9 Å²	44.9	24%	0.237	25%	0.253	C	S	.	.	H	α-helix	trans	-60.6	-44.2	174.8	0	0	0	0	0	112.8	A247 F248 A254 C255	A247-G251 PolarHBondContact O-N 3.39Å; F248-G251 PolarHBondContact O-N 3.3Å; G251-A254 PolarHBondContact O-N 2.93Å; G251-C255 WeakPolarHBondContact O-CB 3.23Å; G251-C255 PolarHBondContact O-N 3Å; G251-C255 PolarHBondContact O-SG 3.37Å
252	M	98.8	Very high	98.8	Very high	1 Å²	1	48 Å²	48	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-57.6	-49.5	172.1	-177.8	-175.7	-175.5	0	0	110.6	N208 W209 F248 H249 A254 C255 L256 M277 V280 T305	N208-M252 HydrophobicContact CB-CB 3.79Å; W209-M252 HydrophobicContact CB-CE 3.74Å; W209-M252 HydrophobicContact CB-SD 3.79Å; W209-M252 HydrophobicContact CG-CE 3.82Å; W209-M252 HydrophobicContact CG-SD 4.22Å; F248-M252 WeakPolarHBondContact O-CB 3.29Å; F248-M252 PolarHBondContact O-N 3.23Å; H249-M252 PolarHBondContact O-N 3.17Å; M252-A254 PolarHBondContact O-N 3.27Å; M252-C255 PolarHBondContact O-N 3.48Å; M252-L256 HydrophobicContact CE-CD1 3.94Å; M252-L256 HydrophobicContact CG-CD1 4.16Å; M252-L256 HydrophobicContact CG-CG 4.39Å; M252-L256 WeakPolarHBondContact O-CG 3.45Å; M252-L256 PolarHBondContact O-N 3.35Å; M252-M277 HydrophobicContact CE-CE 3.64Å; M252-M277 HydrophobicContact CG-CE 4.17Å; M252-M277 HydrophobicContact CG-SD 4.15Å; M252-M277 HydrophobicContact SD-CE 3.84Å; M252-M277 HydrophobicContact SD-SD 4.17Å; M252-V280 HydrophobicContact CE-CG2 4.42Å; M252-V280 HydrophobicContact SD-CG2 4.25Å; M252-T305 HydrophobicContact CE-CG2 4.43Å
253	T	98.9	Very high	98.7	Very high	35 Å²	35	45.2 Å²	45.2	22%	0.215	26%	0.262	C	S	.	.	H	α-helix	trans	-57.2	-51	179.9	-56.4	0	0	0	0	111.1	H249 M250 C255 L256 L257 M277	H249-T253 PolarHBondContact O-N 3.34Å; H249-T253 PolarHBondContact O-OG1 3.22Å; M250-T253 WeakPolarHBondContact O-CB 3.36Å; M250-T253 PolarHBondContact O-N 3.46Å; T253-C255 VanDerWaalsContact C-N 3.35Å; T253-C255 PolarHBondContact O-N 3.29Å; T253-L256 PolarHBondContact O-N 2.9Å; T253-L257 HydrophobicContact CG2-CD1 3.98Å; T253-L257 HydrophobicContact CG2-CG 4.37Å; T253-L257 VanDerWaalsContact O-CG 3.31Å; T253-L257 WeakPolarHBondContact O-CG 3.34Å; T253-L257 PolarHBondContact O-N 3.07Å; T253-M277 HydrophobicContact CG2-CG 4.03Å; T253-M277 WeakPolarHBondContact OG1-CG 3.37Å; T253-M277 PolarHBondContact OG1-SD 2.89Å
254	A	98.9	Very high	98.6	Very high	53 Å²	53	46 Å²	46	44%	0.438	27%	0.267	S	S	.	.	H	α-helix	trans	-58.1	-47.3	179.6	0	0	0	0	0	111.6	M250 G251 M252 L256 L257 T258	M250-A254 PolarHBondContact O-N 3.03Å; G251-A254 PolarHBondContact O-N 2.93Å; M252-A254 PolarHBondContact O-N 3.27Å; A254-L256 PolarHBondContact O-N 3.22Å; A254-L257 PolarHBondContact O-N 2.97Å; A254-T258 PolarHBondContact O-N 2.92Å; A254-T258 PolarHBondContact O-OG1 3.07Å
255	C	98.9	Very high	98.5	Very high	24 Å²	24	42 Å²	42	16%	0.162	25%	0.254	C	S	.	.	H	α-helix	trans	-58.8	-48.1	178	-71.6	0	0	0	0	112.4	P201 G251 M252 T253 L257 T258 V259	P201-C255 WeakPolarHBondContact O-CB 3.32Å; G251-C255 WeakPolarHBondContact O-CB 3.23Å; G251-C255 PolarHBondContact O-N 3Å; G251-C255 PolarHBondContact O-SG 3.37Å; M252-C255 PolarHBondContact O-N 3.48Å; T253-C255 VanDerWaalsContact C-N 3.35Å; T253-C255 PolarHBondContact O-N 3.29Å; C255-L257 PolarHBondContact O-N 3.44Å; C255-T258 WeakPolarHBondContact O-CB 3.48Å; C255-T258 PolarHBondContact O-N 3.47Å; C255-V259 WeakPolarHBondContact O-CG2 3.22Å; C255-V259 PolarHBondContact O-N 3.31Å
256	L	98.9	Very high	98.5	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-71.5	-30	-178	-59.7	-170.9	0	0	0	112.4	L202 M252 T253 A254 V259 G260 Y269 T273 M277 Y309	L202-L256 HydrophobicContact CD1-CD2 4.24Å; M252-L256 HydrophobicContact CE-CD1 3.94Å; M252-L256 HydrophobicContact CG-CD1 4.16Å; M252-L256 HydrophobicContact CG-CG 4.39Å; M252-L256 WeakPolarHBondContact O-CG 3.45Å; M252-L256 PolarHBondContact O-N 3.35Å; T253-L256 PolarHBondContact O-N 2.9Å; A254-L256 PolarHBondContact O-N 3.22Å; L256-V259 WeakPolarHBondContact O-CB 3.45Å; L256-V259 PolarHBondContact O-N 2.84Å; L256-G260 PolarHBondContact O-N 2.73Å; L256-Y269 WeakPolarHBondContact O-CE1 3.46Å; L256-Y269 PolarHBondContact O-OH 3.1Å; L256-T273 HydrophobicContact CB-CG2 4.06Å; L256-M277 HydrophobicContact CD1-CE 3.85Å; L256-Y309 HydrophobicContact CB-CE2 4.43Å; L256-Y309 HydrophobicContact CD1-CD1 4.38Å; L256-Y309 HydrophobicContact CD1-CD2 4.15Å; L256-Y309 HydrophobicContact CD1-CE1 4.13Å; L256-Y309 HydrophobicContact CD1-CE2 3.9Å; L256-Y309 HydrophobicContact CD1-CG 4.4Å; L256-Y309 HydrophobicContact CD2-CE1 3.89Å
257	L	98.8	Very high	98.4	Very high	67 Å²	67	47 Å²	47	35%	0.351	29%	0.286	S	S	.	.	H	α-helix	trans	-66.7	-42	170	-68.7	177	0	0	0	111.3	T253 A254 C255 V259 G260 I261 Y270 T273	T253-L257 HydrophobicContact CG2-CD1 3.98Å; T253-L257 HydrophobicContact CG2-CG 4.37Å; T253-L257 VanDerWaalsContact O-CG 3.31Å; T253-L257 WeakPolarHBondContact O-CG 3.34Å; T253-L257 PolarHBondContact O-N 3.07Å; A254-L257 PolarHBondContact O-N 2.97Å; C255-L257 PolarHBondContact O-N 3.44Å; L257-V259 VanDerWaalsContact C-N 3.29Å; L257-V259 PolarHBondContact O-N 3.36Å; L257-G260 PolarHBondContact O-N 3.22Å; L257-G260 VanDerWaalsContact O-N 3.12Å; L257-I261 WeakPolarHBondContact O-CG1 3.31Å; L257-I261 PolarHBondContact O-N 3Å; L257-Y270 HydrophobicContact CD2-CD1 3.89Å; L257-Y270 HydrophobicContact CD2-CE1 4.33Å; L257-T273 HydrophobicContact CD2-CG2 4.33Å
258	T	98.9	Very high	98.4	Very high	59 Å²	59	47.3 Å²	47.3	36%	0.362	28%	0.283	S	S	.	.	H	α-helix	trans	-59.7	-38.9	173.9	-58.3	0	0	0	0	112.1	P201 A254 C255 G260 I261 N262	P201-T258 HydrophobicContact CB-CG2 4.08Å; P201-T258 HydrophobicContact CG-CG2 4.13Å; A254-T258 PolarHBondContact O-N 2.92Å; A254-T258 PolarHBondContact O-OG1 3.07Å; C255-T258 WeakPolarHBondContact O-CB 3.48Å; C255-T258 PolarHBondContact O-N 3.47Å; T258-G260 PolarHBondContact O-N 3.45Å; T258-I261 PolarHBondContact O-N 2.89Å; T258-N262 WeakPolarHBondContact CG2-ND2 3.48Å; T258-N262 WeakPolarHBondContact O-CB 3.43Å; T258-N262 PolarHBondContact O-N 3.12Å; T258-N262 PolarHBondContact O-ND2 3.3Å
259	V	98.9	Very high	98.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-57.2	-48.9	172.4	170	0	0	0	0	111	L65 I198 P201 L202 C255 L256 L257 I261 N262 A263 Y269	L65-V259 HydrophobicContact CD1-CG1 3.65Å; L65-V259 HydrophobicContact CD2-CG1 4.03Å; I198-V259 HydrophobicContact CG2-CG1 4.34Å; P201-V259 HydrophobicContact CB-CG2 3.94Å; P201-V259 HydrophobicContact CG-CG2 3.91Å; L202-V259 HydrophobicContact CB-CG2 3.8Å; L202-V259 HydrophobicContact CD1-CG2 4.4Å; L202-V259 VanDerWaalsContact N-CG2 3.31Å; C255-V259 WeakPolarHBondContact O-CG2 3.22Å; C255-V259 PolarHBondContact O-N 3.31Å; L256-V259 WeakPolarHBondContact O-CB 3.45Å; L256-V259 PolarHBondContact O-N 2.84Å; L257-V259 VanDerWaalsContact C-N 3.29Å; L257-V259 PolarHBondContact O-N 3.36Å; V259-I261 PolarHBondContact O-N 2.78Å; V259-N262 PolarHBondContact O-N 2.8Å; V259-A263 WeakPolarHBondContact O-CB 3.28Å; V259-A263 PolarHBondContact O-N 2.82Å; V259-Y269 WeakPolarHBondContact CB-OH 3.29Å; V259-Y269 WeakPolarHBondContact CG1-OH 3.19Å
260	G	98.6	Very high	98.4	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60.8	-44.1	-179.8	0	0	0	0	0	112.7	L256 L257 T258 A263 N264 A265	L256-G260 PolarHBondContact O-N 2.73Å; L257-G260 PolarHBondContact O-N 3.22Å; L257-G260 VanDerWaalsContact O-N 3.12Å; T258-G260 PolarHBondContact O-N 3.45Å; G260-A263 PolarHBondContact O-N 3.4Å; G260-N264 PolarHBondContact O-N 2.89Å; G260-N264 VanDerWaalsContact O-N 3.15Å; G260-A265 WeakPolarHBondContact O-CB 3.35Å; G260-A265 PolarHBondContact O-N 3.4Å
261	I	98.6	Very high	98.3	Very high	109 Å²	109	47.6 Å²	47.6	56%	0.559	28%	0.283	S	S	*	.	H	α-helix	trans	-61.6	-50.1	177.5	-65.6	163.8	0	0	0	110.4	L257 T258 V259 A263 N264 Y270	L257-I261 WeakPolarHBondContact O-CG1 3.31Å; L257-I261 PolarHBondContact O-N 3Å; T258-I261 PolarHBondContact O-N 2.89Å; V259-I261 PolarHBondContact O-N 2.78Å; I261-A263 VanDerWaalsContact C-N 3.3Å; I261-A263 PolarHBondContact O-N 3.1Å; I261-N264 PolarHBondContact O-N 3.23Å; I261-N264 VanDerWaalsContact O-N 3.16Å; I261-Y270 PolarHBondContact N-OH 3.33Å
262	N	98.6	Very high	98.3	Very high	65 Å²	65	46.9 Å²	46.9	35%	0.348	28%	0.276	S	S	.	.	H	α-helix	trans	-72.4	-23.1	-176.8	-69.9	-21.3	0	0	0	113.4	L197 I198 T258 V259 N264	L197-N262 HydrophobicContact CB-CB 4.09Å; L197-N262 WeakPolarHBondContact O-CB 3.3Å; L197-N262 PolarHBondContact O-ND2 3.48Å; I198-N262 HydrophobicContact CG1-CB 4.19Å; T258-N262 WeakPolarHBondContact CG2-ND2 3.48Å; T258-N262 WeakPolarHBondContact O-CB 3.43Å; T258-N262 PolarHBondContact O-N 3.12Å; T258-N262 PolarHBondContact O-ND2 3.3Å; V259-N262 PolarHBondContact O-N 2.8Å; N262-N264 VanDerWaalsContact C-N 3.33Å
263	A	97.1	Very high	98.3	Very high	25 Å²	25	46.9 Å²	46.9	21%	0.207	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-0.2	174	0	0	0	0	0	113.3	L65 I198 V259 G260 I261 A265	L65-A263 HydrophobicContact CD2-CB 4.25Å; I198-A263 HydrophobicContact CD1-CB 4Å; I198-A263 HydrophobicContact CG1-CB 4.3Å; V259-A263 WeakPolarHBondContact O-CB 3.28Å; V259-A263 PolarHBondContact O-N 2.82Å; G260-A263 PolarHBondContact O-N 3.4Å; I261-A263 VanDerWaalsContact C-N 3.3Å; I261-A263 PolarHBondContact O-N 3.1Å; A263-A265 PolarHBondContact O-N 3.4Å
264	N	96.5	Very high	98.3	Very high	141 Å²	141	51.5 Å²	51.5	75%	0.754	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	45.1	-172.6	-159.1	17.8	0	0	0	112.3	G260 I261 N262	G260-N264 PolarHBondContact O-N 2.89Å; G260-N264 VanDerWaalsContact O-N 3.15Å; I261-N264 PolarHBondContact O-N 3.23Å; I261-N264 VanDerWaalsContact O-N 3.16Å; N262-N264 VanDerWaalsContact C-N 3.33Å
265	A	97.5	Very high	98.3	Very high	13 Å²	13	53.5 Å²	53.5	11%	0.107	30%	0.296	C	S	.	.			trans	-71.2	153.3	-174.4	0	0	0	0	0	112.4	G260 A263 Y269 Y270	G260-A265 WeakPolarHBondContact O-CB 3.35Å; G260-A265 PolarHBondContact O-N 3.4Å; A263-A265 PolarHBondContact O-N 3.4Å; A265-Y269 HydrophobicContact CB-CD1 3.88Å; A265-Y269 HydrophobicContact CB-CD2 4.11Å; A265-Y269 HydrophobicContact CB-CG 3.58Å; A265-Y270 WeakPolarHBondContact O-CE2 3.33Å
266	G	97	Very high	98.3	Very high	17 Å²	17	52.3 Å²	52.3	18%	0.175	29%	0.288	C	S	.	.			trans	-80.8	-179.7	-179.2	0	0	0	0	0	114.2	V268 Y269 Y270 D316	G266-V268 PolarHBondContact O-N 3Å; G266-Y269 WeakPolarHBondContact O-CB 3.49Å; G266-Y269 PolarHBondContact O-N 3.49Å; G266-Y270 WeakPolarHBondContact O-CD2 3.35Å; G266-D316 VanDerWaalsContact C-OD1 3.26Å; G266-D316 WeakPolarHBondContact CA-OD1 3.4Å; G266-D316 PolarHBondContact N-OD1 2.77Å; G266-D316 PolarHBondContact N-OD2 2.98Å
267	C	97.4	Very high	98.3	Very high	115 Å²	115	52.9 Å²	52.9	78%	0.777	29%	0.291	S	S	*	.	H	α-helix	trans	-60.6	-29.7	177.9	-67.3	0	0	0	0	112.9	Y269 Y270 L271	C267-Y269 VanDerWaalsContact C-N 3.33Å; C267-Y269 PolarHBondContact O-N 2.63Å; C267-Y270 PolarHBondContact O-N 3.31Å; C267-L271 PolarHBondContact O-N 3.25Å; C267-L271 VanDerWaalsContact O-N 3.1Å
268	V	98.3	Very high	98.3	Very high	57 Å²	57	56 Å²	56	35%	0.345	30%	0.302	S	S	.	.	H	α-helix	trans	-62.9	-42.2	179	176.9	0	0	0	0	110.2	G266 Y270 L271 G272 L315 D316	G266-V268 PolarHBondContact O-N 3Å; V268-Y270 PolarHBondContact O-N 2.9Å; V268-L271 PolarHBondContact O-N 2.86Å; V268-G272 PolarHBondContact O-N 2.83Å; V268-L315 HydrophobicContact CG1-CB 3.87Å; V268-D316 HydrophobicContact CB-CB 4.2Å; V268-D316 HydrophobicContact CG1-CB 4.31Å
269	Y	98.7	Very high	98.3	Very high	1 Å²	1	54.9 Å²	54.9	0%	0.004	29%	0.293	C	S	.	.	H	α-helix	trans	-58.1	-48	176.2	-179.5	-89.7	0	0	0	112.7	L256 V259 A265 G266 C267 G272 T273 Y309 T312 I313 D316	L256-Y269 WeakPolarHBondContact O-CE1 3.46Å; L256-Y269 PolarHBondContact O-OH 3.1Å; V259-Y269 WeakPolarHBondContact CB-OH 3.29Å; V259-Y269 WeakPolarHBondContact CG1-OH 3.19Å; A265-Y269 HydrophobicContact CB-CD1 3.88Å; A265-Y269 HydrophobicContact CB-CD2 4.11Å; A265-Y269 HydrophobicContact CB-CG 3.58Å; G266-Y269 WeakPolarHBondContact O-CB 3.49Å; G266-Y269 PolarHBondContact O-N 3.49Å; C267-Y269 VanDerWaalsContact C-N 3.33Å; C267-Y269 PolarHBondContact O-N 2.63Å; Y269-G272 PolarHBondContact O-N 3.5Å; Y269-T273 WeakPolarHBondContact CE1-OG1 3.46Å; Y269-T273 VanDerWaalsContact O-CB 3.26Å; Y269-T273 WeakPolarHBondContact O-CB 3.29Å; Y269-T273 PolarHBondContact O-N 3.35Å; Y269-T273 PolarHBondContact O-OG1 3.23Å; Y269-Y309 AromaticContact CE2-CE2 3.95Å; Y269-Y309 HydrophobicContact CE2-CE2 3.95Å; Y269-Y309 PolarHBondContact OH-OH 3.24Å; Y269-T312 HydrophobicContact CD2-CG2 4.24Å; Y269-T312 WeakPolarHBondContact O-CG2 3.41Å; Y269-I313 HydrophobicContact CD2-CG1 4.41Å; Y269-I313 HydrophobicContact CE2-CG1 4.06Å; Y269-D316 VanDerWaalsContact CB-CG 3.45Å; Y269-D316 WeakPolarHBondContact CB-OD1 3.43Å; Y269-D316 PolarHBondContact N-OD1 2.96Å
270	Y	98.7	Very high	98.3	Very high	84 Å²	84	55 Å²	55	33%	0.329	29%	0.294	S	S	.	.	H	α-helix	trans	-68	-40.4	-177.4	-63.7	-73.8	0	0	0	111.9	L257 I261 A265 G266 C267 V268 T273 F274	L257-Y270 HydrophobicContact CD2-CD1 3.89Å; L257-Y270 HydrophobicContact CD2-CE1 4.33Å; I261-Y270 PolarHBondContact N-OH 3.33Å; A265-Y270 WeakPolarHBondContact O-CE2 3.33Å; G266-Y270 WeakPolarHBondContact O-CD2 3.35Å; C267-Y270 PolarHBondContact O-N 3.31Å; V268-Y270 PolarHBondContact O-N 2.9Å; Y270-T273 PolarHBondContact O-N 2.87Å; Y270-F274 WeakPolarHBondContact O-CB 3.48Å; Y270-F274 PolarHBondContact O-N 3.38Å
271	L	98.5	Very high	98.3	Very high	110 Å²	110	57 Å²	57	58%	0.576	31%	0.31	S	S	*	.	H	α-helix	trans	-63.3	-47.2	174.6	179.2	60.1	0	0	0	111.6	C267 V268 T273 F274 L275	C267-L271 PolarHBondContact O-N 3.25Å; C267-L271 VanDerWaalsContact O-N 3.1Å; V268-L271 PolarHBondContact O-N 2.86Å; L271-T273 VanDerWaalsContact C-N 3.34Å; L271-T273 PolarHBondContact O-N 3.48Å; L271-F274 WeakPolarHBondContact O-CB 3.38Å; L271-F274 PolarHBondContact O-N 3.44Å; L271-L275 WeakPolarHBondContact O-CG 3.44Å; L271-L275 PolarHBondContact O-N 3.4Å
272	G	98.7	Very high	98.3	Very high	8 Å²	8	56 Å²	56	8%	0.082	30%	0.303	C	S	.	.	H	α-helix	trans	-67	-34.2	178.3	0	0	0	0	0	113.1	V268 Y269 L275 T276 T312	V268-G272 PolarHBondContact O-N 2.83Å; Y269-G272 PolarHBondContact O-N 3.5Å; G272-L275 PolarHBondContact O-N 3.4Å; G272-T276 WeakPolarHBondContact O-CB 3.08Å; G272-T276 PolarHBondContact O-N 3.33Å; G272-T276 PolarHBondContact O-OG1 3.18Å; G272-T312 VanDerWaalsContact CA-OG1 3.27Å; G272-T312 WeakPolarHBondContact CA-OG1 3.3Å; G272-T312 PolarHBondContact O-OG1 2.95Å
273	T	98.8	Very high	98.3	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.006	29%	0.289	C	S	.	.	H	α-helix	trans	-64.2	-43.5	172.5	-61.4	0	0	0	0	110.4	L256 L257 Y269 Y270 L271 L275 T276 M277	L256-T273 HydrophobicContact CB-CG2 4.06Å; L257-T273 HydrophobicContact CD2-CG2 4.33Å; Y269-T273 WeakPolarHBondContact CE1-OG1 3.46Å; Y269-T273 VanDerWaalsContact O-CB 3.26Å; Y269-T273 WeakPolarHBondContact O-CB 3.29Å; Y269-T273 PolarHBondContact O-N 3.35Å; Y269-T273 PolarHBondContact O-OG1 3.23Å; Y270-T273 PolarHBondContact O-N 2.87Å; L271-T273 VanDerWaalsContact C-N 3.34Å; L271-T273 PolarHBondContact O-N 3.48Å; T273-L275 PolarHBondContact O-N 2.92Å; T273-T276 WeakPolarHBondContact O-CB 3.41Å; T273-T276 PolarHBondContact O-N 3.01Å; T273-M277 WeakPolarHBondContact O-CG 3.49Å; T273-M277 PolarHBondContact O-N 3.45Å
274	F	98.7	Very high	98.4	Very high	133 Å²	133	53 Å²	53	58%	0.583	28%	0.283	S	S	*	.	H	α-helix	trans	-57.9	-47.3	173.3	172.3	-96.1	0	0	0	112	Y270 L271 T276 M277 F278	Y270-F274 WeakPolarHBondContact O-CB 3.48Å; Y270-F274 PolarHBondContact O-N 3.38Å; L271-F274 WeakPolarHBondContact O-CB 3.38Å; L271-F274 PolarHBondContact O-N 3.44Å; F274-T276 VanDerWaalsContact C-N 3.32Å; F274-T276 PolarHBondContact O-N 3.18Å; F274-M277 PolarHBondContact O-N 3.44Å; F274-F278 WeakPolarHBondContact O-CB 3.32Å; F274-F278 PolarHBondContact O-N 3.3Å
275	L	98.7	Very high	98.5	Very high	94 Å²	94	56.2 Å²	56.2	49%	0.492	28%	0.284	S	S	.	.	H	α-helix	trans	-62.4	-38.8	177	-66.7	175.9	0	0	0	112.4	L271 G272 T273 F278 H279	L271-L275 WeakPolarHBondContact O-CG 3.44Å; L271-L275 PolarHBondContact O-N 3.4Å; G272-L275 PolarHBondContact O-N 3.4Å; T273-L275 PolarHBondContact O-N 2.92Å; L275-F278 PolarHBondContact O-N 2.66Å; L275-H279 PolarHBondContact O-N 2.94Å
276	T	98.8	Very high	98.5	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-62.8	-46.2	174.5	-58.3	0	0	0	0	110.7	G272 T273 F274 F278 H279 V280 T305	G272-T276 WeakPolarHBondContact O-CB 3.08Å; G272-T276 PolarHBondContact O-N 3.33Å; G272-T276 PolarHBondContact O-OG1 3.18Å; T273-T276 WeakPolarHBondContact O-CB 3.41Å; T273-T276 PolarHBondContact O-N 3.01Å; F274-T276 VanDerWaalsContact C-N 3.32Å; F274-T276 PolarHBondContact O-N 3.18Å; T276-F278 VanDerWaalsContact C-N 3.32Å; T276-F278 PolarHBondContact O-N 3.03Å; T276-H279 WeakPolarHBondContact O-CB 3.39Å; T276-H279 PolarHBondContact O-N 3.01Å; T276-V280 WeakPolarHBondContact O-CG2 3.5Å; T276-V280 PolarHBondContact O-N 2.94Å; T276-T305 HydrophobicContact CG2-CG2 3.64Å
277	M	98.8	Very high	98.6	Very high	12 Å²	12	61.2 Å²	61.2	6%	0.059	30%	0.299	C	S	.	.	H	α-helix	trans	-65.2	-37.2	177.9	-68.2	-49	92	0	0	111.9	H249 M252 T253 L256 T273 F274 H279 V280 A281	H249-M277 PolarHBondContact NE2-O 3.12Å; M252-M277 HydrophobicContact CE-CE 3.64Å; M252-M277 HydrophobicContact CG-CE 4.17Å; M252-M277 HydrophobicContact CG-SD 4.15Å; M252-M277 HydrophobicContact SD-CE 3.84Å; M252-M277 HydrophobicContact SD-SD 4.17Å; T253-M277 HydrophobicContact CG2-CG 4.03Å; T253-M277 WeakPolarHBondContact OG1-CG 3.37Å; T253-M277 PolarHBondContact OG1-SD 2.89Å; L256-M277 HydrophobicContact CD1-CE 3.85Å; T273-M277 WeakPolarHBondContact O-CG 3.49Å; T273-M277 PolarHBondContact O-N 3.45Å; F274-M277 PolarHBondContact O-N 3.44Å; M277-H279 VanDerWaalsContact C-N 3.35Å; M277-V280 PolarHBondContact O-N 2.83Å; M277-A281 WeakPolarHBondContact O-CB 3.45Å; M277-A281 PolarHBondContact O-N 2.72Å
278	F	98.7	Very high	98.6	Very high	132 Å²	132	59.4 Å²	59.4	58%	0.579	28%	0.282	S	S	*	.	H	α-helix	trans	-61.2	-43.7	173.1	-176.8	-94	0	0	0	111.5	F274 L275 T276 A281 H282	F274-F278 WeakPolarHBondContact O-CB 3.32Å; F274-F278 PolarHBondContact O-N 3.3Å; L275-F278 PolarHBondContact O-N 2.66Å; T276-F278 VanDerWaalsContact C-N 3.32Å; T276-F278 PolarHBondContact O-N 3.03Å; F278-A281 PolarHBondContact O-N 2.87Å; F278-H282 WeakPolarHBondContact O-CB 3.45Å; F278-H282 PolarHBondContact O-N 2.95Å
279	H	98.8	Very high	98.6	Very high	35 Å²	35	58 Å²	58	16%	0.162	27%	0.272	C	S	.	.	H	α-helix	trans	-61.4	-44	176.1	-178.5	-106.1	0	0	0	112.3	L275 T276 M277 H282 L283 T305 L308	L275-H279 PolarHBondContact O-N 2.94Å; T276-H279 WeakPolarHBondContact O-CB 3.39Å; T276-H279 PolarHBondContact O-N 3.01Å; M277-H279 VanDerWaalsContact C-N 3.35Å; H279-H282 WeakPolarHBondContact O-CB 3.14Å; H279-H282 PolarHBondContact O-N 3.08Å; H279-L283 WeakPolarHBondContact O-CG 3.45Å; H279-L283 PolarHBondContact O-N 3.23Å; H279-T305 PolarHBondContact CE1-OG1 3.12Å; H279-T305 VanDerWaalsContact CE1-OG1 3.28Å; H279-T305 PolarHBondContact ND1-OG1 2.88Å; H279-L308 HydrophobicContact CB-CD1 4Å
280	V	98.9	Very high	98.6	Very high	3 Å²	3	67 Å²	67	2%	0.018	31%	0.311	C	S	.	.	H	α-helix	trans	-62.2	-46.6	176.1	178.4	0	0	0	0	111.4	I212 M252 T276 M277 H282 L283 I284 T305	I212-V280 HydrophobicContact CD1-CG1 4.02Å; I212-V280 HydrophobicContact CG2-CG1 4.26Å; M252-V280 HydrophobicContact CE-CG2 4.42Å; M252-V280 HydrophobicContact SD-CG2 4.25Å; T276-V280 WeakPolarHBondContact O-CG2 3.5Å; T276-V280 PolarHBondContact O-N 2.94Å; M277-V280 PolarHBondContact O-N 2.83Å; V280-H282 VanDerWaalsContact C-N 3.29Å; V280-H282 PolarHBondContact O-N 3.33Å; V280-L283 PolarHBondContact O-N 3.37Å; V280-I284 HydrophobicContact CG1-CD1 3.87Å; V280-I284 HydrophobicContact CG1-CG1 4.42Å; V280-I284 WeakPolarHBondContact O-CG1 3.38Å; V280-I284 PolarHBondContact O-N 2.74Å; V280-T305 HydrophobicContact CG2-CG2 3.31Å
281	A	98.9	Very high	98.5	Very high	41 Å²	41	66.1 Å²	66.1	34%	0.339	31%	0.312	S	S	.	.	H	α-helix	trans	-60.5	-40.8	177.5	0	0	0	0	0	111.7	M277 F278 I284 R285	M277-A281 WeakPolarHBondContact O-CB 3.45Å; M277-A281 PolarHBondContact O-N 2.72Å; F278-A281 PolarHBondContact O-N 2.87Å; A281-I284 PolarHBondContact O-N 2.83Å; A281-R285 WeakPolarHBondContact O-CB 3.28Å; A281-R285 PolarHBondContact O-N 3.39Å
282	H	98.7	Very high	98.5	Very high	90 Å²	90	63.8 Å²	63.8	42%	0.417	30%	0.304	S	S	.	.	H	α-helix	trans	-59.9	-46.9	174	175.9	78.1	0	0	0	111.8	F278 H279 V280 R285 K286	F278-H282 WeakPolarHBondContact O-CB 3.45Å; F278-H282 PolarHBondContact O-N 2.95Å; H279-H282 WeakPolarHBondContact O-CB 3.14Å; H279-H282 PolarHBondContact O-N 3.08Å; V280-H282 VanDerWaalsContact C-N 3.29Å; V280-H282 PolarHBondContact O-N 3.33Å; H282-R285 PolarHBondContact O-N 3.37Å; H282-K286 WeakPolarHBondContact O-CB 3.4Å; H282-K286 PolarHBondContact O-N 3.47Å
283	L	98.7	Very high	98.4	Very high	9 Å²	9	71.7 Å²	71.7	5%	0.047	34%	0.336	C	S	.	.	H	α-helix	trans	-59	-52.6	177	-72.3	-177.4	0	0	0	111.3	H279 V280 R285 K286 T287 T298 D301	H279-L283 WeakPolarHBondContact O-CG 3.45Å; H279-L283 PolarHBondContact O-N 3.23Å; V280-L283 PolarHBondContact O-N 3.37Å; L283-R285 VanDerWaalsContact C-N 3.26Å; L283-R285 PolarHBondContact O-N 3.13Å; L283-K286 PolarHBondContact O-N 2.93Å; L283-T287 PolarHBondContact O-N 3.16Å; L283-T287 PolarHBondContact O-OG1 3.27Å; L283-T298 HydrophobicContact CB-CG2 3.99Å; L283-T298 HydrophobicContact CD1-CG2 4.43Å; L283-T298 HydrophobicContact CD2-CG2 4.37Å; L283-T298 HydrophobicContact CG-CG2 4.5Å; L283-D301 HydrophobicContact CD1-CB 4.42Å; L283-D301 HydrophobicContact CD2-CB 3.88Å
284	I	98.8	Very high	98.4	Very high	16 Å²	16	73 Å²	73	8%	0.082	35%	0.345	C	S	.	.	H	α-helix	trans	-55.3	-43.6	178.8	-66.3	166.9	0	0	0	111	I212 K242 L245 H249 V280 A281	I212-I284 HydrophobicContact CD1-CD1 4.47Å; I212-I284 HydrophobicContact CG2-CD1 3.85Å; I212-I284 HydrophobicContact CG2-CG1 3.81Å; K242-I284 HydrophobicContact CB-CG2 4.42Å; K242-I284 WeakPolarHBondContact CE-O 3.45Å; K242-I284 HydrophobicContact CG-CG2 4.4Å; K242-I284 PolarHBondContact NZ-O 3.1Å; L245-I284 HydrophobicContact CB-CD1 4.04Å; L245-I284 HydrophobicContact CB-CG1 4.28Å; L245-I284 HydrophobicContact CB-CG2 4.08Å; L245-I284 HydrophobicContact CD1-CG1 4.43Å; L245-I284 HydrophobicContact CD1-CG2 4.43Å; H249-I284 HydrophobicContact CB-CD1 4.05Å; V280-I284 HydrophobicContact CG1-CD1 3.87Å; V280-I284 HydrophobicContact CG1-CG1 4.42Å; V280-I284 WeakPolarHBondContact O-CG1 3.38Å; V280-I284 PolarHBondContact O-N 2.74Å; A281-I284 PolarHBondContact O-N 2.83Å
285	R	98.3	Very high	98.4	Very high	210 Å²	210	66.7 Å²	66.7	79%	0.792	32%	0.318	S	S	*	.	H	α-helix	trans	-66.7	-48.2	-179.7	-173.6	179.8	175.1	93.8	0.1	111.5	K242 A281 H282 L283	K242-R285 PolarHBondContact NZ-O 3.26Å; A281-R285 WeakPolarHBondContact O-CB 3.28Å; A281-R285 PolarHBondContact O-N 3.39Å; H282-R285 PolarHBondContact O-N 3.37Å; L283-R285 VanDerWaalsContact C-N 3.26Å; L283-R285 PolarHBondContact O-N 3.13Å
286	K	97.8	Very high	98.4	Very high	132 Å²	132	65.8 Å²	65.8	57%	0.574	31%	0.307	S	S	*	.	H	α-helix	trans	-67.9	-32.7	-174.6	179.4	-176.9	173.2	-172.9	0	113.3	H282 L283 D288	H282-K286 WeakPolarHBondContact O-CB 3.4Å; H282-K286 PolarHBondContact O-N 3.47Å; L283-K286 PolarHBondContact O-N 2.93Å; K286-D288 PolarHBondContact O-N 3.08Å
287	T	98.6	Very high	98.4	Very high	2 Å²	2	69.2 Å²	69.2	1%	0.012	32%	0.324	C	S	.	.			trans	-61.7	130.7	-175.1	-52.2	0	0	0	0	112	I216 K242 L283 L289 T298	I216-T287 HydrophobicContact CG2-CG2 3.76Å; K242-T287 WeakPolarHBondContact CE-O 3.46Å; K242-T287 PolarHBondContact NZ-O 3.47Å; L283-T287 PolarHBondContact O-N 3.16Å; L283-T287 PolarHBondContact O-OG1 3.27Å; T287-L289 HydrophobicContact CG2-CD2 3.93Å; T287-T298 WeakPolarHBondContact OG1-CB 3.07Å; T287-T298 WeakPolarHBondContact OG1-CG2 3.48Å; T287-T298 PolarHBondContact OG1-OG1 2.98Å
288	D	98.4	Very high	98.4	Very high	78 Å²	78	69 Å²	69	42%	0.417	32%	0.323	S	S	.	.			trans	-93.2	105	165.1	176.2	9.7	0	0	0	108.5	K286 K290 N291 S294	K286-D288 PolarHBondContact O-N 3.08Å; D288-K290 PolarHBondContact O-N 2.95Å; D288-K290 PolarHBondContact OD1-N 3.11Å; D288-K290 VanDerWaalsContact OD1-N 3.09Å; D288-N291 HydrophobicContact CB-CB 4.12Å; D288-N291 PolarHBondContact O-N 2.98Å; D288-N291 VanDerWaalsContact O-N 3.12Å; D288-N291 WeakPolarHBondContact OD2-CB 3.33Å; D288-S294 PolarHBondContact N-OG 2.95Å; D288-S294 VanDerWaalsContact N-OG 3.07Å; D288-S294 WeakPolarHBondContact O-CB 3.29Å
289	L	98.4	Very high	98.4	Very high	28 Å²	28	63.1 Å²	63.1	15%	0.147	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-21.3	-175.4	-63	176.9	0	0	0	112.9	I216 T241 K242 T287 N291	I216-L289 HydrophobicContact CG1-CD2 4.28Å; T241-L289 HydrophobicContact CG2-CD1 3.66Å; T241-L289 HydrophobicContact CG2-CD2 4.42Å; K242-L289 HydrophobicContact CG-CD1 4.03Å; T287-L289 HydrophobicContact CG2-CD2 3.93Å; L289-N291 VanDerWaalsContact C-N 3.28Å
290	K	97.2	Very high	98.3	Very high	189 Å²	189	64.6 Å²	64.6	82%	0.822	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-8.4	177.4	-63.2	-174.6	178.5	-175.3	0	112.6	D288 P292	D288-K290 PolarHBondContact O-N 2.95Å; D288-K290 PolarHBondContact OD1-N 3.11Å; D288-K290 VanDerWaalsContact OD1-N 3.09Å; K290-P292 WeakPolarHBondContact O-CD 3.22Å
291	N	97.9	Very high	98.3	Very high	65 Å²	65	66 Å²	66	35%	0.348	31%	0.31	S	S	.	.			trans	-110.5	104	-179.3	-178.1	-12.2	0	0	0	110.4	D288 L289 K293 S294 C295	D288-N291 HydrophobicContact CB-CB 4.12Å; D288-N291 PolarHBondContact O-N 2.98Å; D288-N291 VanDerWaalsContact O-N 3.12Å; D288-N291 WeakPolarHBondContact OD2-CB 3.33Å; L289-N291 VanDerWaalsContact C-N 3.28Å; N291-K293 PolarHBondContact O-N 3.28Å; N291-K293 WeakPolarHBondContact OD1-CB 3.4Å; N291-K293 PolarHBondContact OD1-N 2.84Å; N291-S294 WeakPolarHBondContact O-CA 3.48Å; N291-S294 VanDerWaalsContact O-CB 3.3Å; N291-S294 WeakPolarHBondContact O-CB 3.42Å; N291-S294 PolarHBondContact O-N 2.83Å; N291-C295 PolarHBondContact O-N 2.84Å; N291-C295 VanDerWaalsContact O-N 3.12Å
292	P	97.7	Very high	98.3	Very high	62 Å²	62	64.2 Å²	64.2	40%	0.403	30%	0.295	S	S	.	.	H	α-helix	trans	-52.7	-34.2	179.3	-30.6	36.6	0	0	0	114.2	Q220 K290 C295 W296	Q220-P292 HydrophobicContact CB-CB 4.22Å; Q220-P292 HydrophobicContact CG-CB 3.99Å; Q220-P292 VanDerWaalsContact CG-O 3.3Å; Q220-P292 WeakPolarHBondContact CG-O 3.45Å; K290-P292 WeakPolarHBondContact O-CD 3.22Å; P292-C295 PolarHBondContact O-N 2.95Å; P292-W296 WeakPolarHBondContact O-CB 3.37Å; P292-W296 PolarHBondContact O-N 2.71Å
293	K	97.9	Very high	98.3	Very high	174 Å²	174	62.8 Å²	62.8	76%	0.757	29%	0.288	S	S	*	.	H	α-helix	trans	-68.3	-36	177.3	-65	-177.8	179.3	177.3	0	112	N291 Q297	N291-K293 PolarHBondContact O-N 3.28Å; N291-K293 WeakPolarHBondContact OD1-CB 3.4Å; N291-K293 PolarHBondContact OD1-N 2.84Å; K293-Q297 WeakPolarHBondContact O-CB 3.45Å; K293-Q297 PolarHBondContact O-N 2.88Å
294	S	98.5	Very high	98.3	Very high	29 Å²	29	65.7 Å²	65.7	20%	0.203	30%	0.303	C	S	.	.	H	α-helix	trans	-66.1	-46.7	175.6	-165.5	0	0	0	0	110.4	D288 N291 W296 Q297 T298	D288-S294 PolarHBondContact N-OG 2.95Å; D288-S294 VanDerWaalsContact N-OG 3.07Å; D288-S294 WeakPolarHBondContact O-CB 3.29Å; N291-S294 WeakPolarHBondContact O-CA 3.48Å; N291-S294 VanDerWaalsContact O-CB 3.3Å; N291-S294 WeakPolarHBondContact O-CB 3.42Å; N291-S294 PolarHBondContact O-N 2.83Å; S294-W296 PolarHBondContact O-N 3.21Å; S294-Q297 PolarHBondContact O-N 3.44Å; S294-T298 PolarHBondContact O-N 2.73Å; S294-T298 PolarHBondContact O-OG1 3.38Å
295	C	98.6	Very high	98.3	Very high	0 Å²	0	65 Å²	65	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-57.9	-46.3	174.5	-65.8	0	0	0	0	112.7	I216 Q220 N291 P292 Q297 T298 F299	I216-C295 HydrophobicContact CG2-CB 4.14Å; I216-C295 WeakPolarHBondContact O-CB 3.26Å; Q220-C295 HydrophobicContact CG-CB 3.84Å; N291-C295 PolarHBondContact O-N 2.84Å; N291-C295 VanDerWaalsContact O-N 3.12Å; P292-C295 PolarHBondContact O-N 2.95Å; C295-Q297 VanDerWaalsContact C-N 3.33Å; C295-Q297 PolarHBondContact O-N 2.86Å; C295-T298 PolarHBondContact O-N 2.99Å; C295-F299 PolarHBondContact O-N 3.1Å
296	W	98	Very high	98.3	Very high	74 Å²	74	55 Å²	55	28%	0.28	26%	0.262	S	S	.	.	H	α-helix	trans	-59.8	-43.4	175.5	176	-126.1	0	0	0	112.4	Y217 P292 S294 F299 K300	Y217-W296 HydrophobicContact CD2-CE3 4.06Å; Y217-W296 HydrophobicContact CD2-CZ3 4.27Å; Y217-W296 AromaticContact CE2-CE3 3.61Å; Y217-W296 HydrophobicContact CE2-CE3 3.61Å; Y217-W296 AromaticContact CE2-CZ3 3.58Å; Y217-W296 HydrophobicContact CE2-CZ3 3.58Å; P292-W296 WeakPolarHBondContact O-CB 3.37Å; P292-W296 PolarHBondContact O-N 2.71Å; S294-W296 PolarHBondContact O-N 3.21Å; W296-F299 AromaticContact CE3-CD1 3.88Å; W296-F299 HydrophobicContact CE3-CD1 3.88Å; W296-F299 HydrophobicContact CH2-CD1 4.37Å; W296-F299 AromaticContact CZ3-CD1 3.48Å; W296-F299 HydrophobicContact CZ3-CD1 3.48Å; W296-F299 VanDerWaalsContact CZ3-CD1 3.48Å; W296-F299 AromaticContact CZ3-CE1 3.85Å; W296-F299 HydrophobicContact CZ3-CE1 3.85Å; W296-F299 PolarHBondContact O-N 3.31Å; W296-K300 HydrophobicContact CD2-CD 4.31Å; W296-K300 HydrophobicContact CD2-CG 4.3Å; W296-K300 HydrophobicContact CH2-CG 4.35Å; W296-K300 HydrophobicContact CZ2-CD 3.91Å; W296-K300 HydrophobicContact CZ2-CG 3.98Å; W296-K300 PolarHBondContact O-N 3.37Å
297	Q	98.5	Very high	98.3	Very high	73 Å²	73	51.5 Å²	51.5	34%	0.341	25%	0.249	S	C	.	.	H	α-helix	trans	-66.5	-42.2	-179.4	-174.2	54	40.5	0	0	111.2	K293 S294 C295 F299 K300 D301	K293-Q297 WeakPolarHBondContact O-CB 3.45Å; K293-Q297 PolarHBondContact O-N 2.88Å; S294-Q297 PolarHBondContact O-N 3.44Å; C295-Q297 VanDerWaalsContact C-N 3.33Å; C295-Q297 PolarHBondContact O-N 2.86Å; Q297-F299 PolarHBondContact O-N 2.98Å; Q297-K300 WeakPolarHBondContact O-CB 3.35Å; Q297-K300 PolarHBondContact O-N 3.34Å; Q297-K300 VanDerWaalsContact O-N 3.16Å; Q297-D301 PolarHBondContact NE2-OD1 3.45Å; Q297-D301 PolarHBondContact NE2-OD2 3.26Å; Q297-D301 VanDerWaalsContact O-CG 3.25Å; Q297-D301 PolarHBondContact O-N 2.79Å
298	T	98.7	Very high	98.3	Very high	7 Å²	7	54.4 Å²	54.4	4%	0.043	26%	0.264	C	S	.	.	H	α-helix	trans	-62	-40.7	173.8	-62.2	0	0	0	0	112.7	I216 L283 T287 S294 C295 K300 D301 S302	I216-T298 HydrophobicContact CD1-CG2 3.83Å; I216-T298 HydrophobicContact CG2-CG2 3.98Å; L283-T298 HydrophobicContact CB-CG2 3.99Å; L283-T298 HydrophobicContact CD1-CG2 4.43Å; L283-T298 HydrophobicContact CD2-CG2 4.37Å; L283-T298 HydrophobicContact CG-CG2 4.5Å; T287-T298 WeakPolarHBondContact OG1-CB 3.07Å; T287-T298 WeakPolarHBondContact OG1-CG2 3.48Å; T287-T298 PolarHBondContact OG1-OG1 2.98Å; S294-T298 PolarHBondContact O-N 2.73Å; S294-T298 PolarHBondContact O-OG1 3.38Å; C295-T298 PolarHBondContact O-N 2.99Å; T298-K300 VanDerWaalsContact C-N 3.31Å; T298-K300 PolarHBondContact O-N 3.05Å; T298-D301 PolarHBondContact O-N 2.87Å; T298-S302 PolarHBondContact O-N 3.25Å; T298-S302 PolarHBondContact O-OG 3.39Å
299	F	98.4	Very high	98.3	Very high	9 Å²	9	50.7 Å²	50.7	4%	0.039	24%	0.244	C	C	.	.	H	α-helix	trans	-60.2	-41.7	173.7	178	-99.9	0	0	0	111.7	T50 L54 Y213 Y217 C295 W296 Q297 S302	T50-F299 HydrophobicContact CG2-CD1 3.73Å; T50-F299 HydrophobicContact CG2-CE1 3.56Å; T50-F299 HydrophobicContact CG2-CZ 4.34Å; L54-F299 HydrophobicContact CD1-CD2 4.15Å; L54-F299 HydrophobicContact CD1-CE1 4.15Å; L54-F299 HydrophobicContact CD1-CE2 3.51Å; L54-F299 HydrophobicContact CD1-CZ 3.5Å; Y213-F299 AromaticContact CD2-CD2 3.7Å; Y213-F299 HydrophobicContact CD2-CD2 3.7Å; Y213-F299 AromaticContact CD2-CE2 3.56Å; Y213-F299 HydrophobicContact CD2-CE2 3.56Å; Y213-F299 HydrophobicContact CE2-CD2 4.47Å; Y213-F299 AromaticContact CE2-CE2 3.87Å; Y213-F299 HydrophobicContact CE2-CE2 3.87Å; Y213-F299 HydrophobicContact CG-CD2 4.45Å; Y217-F299 HydrophobicContact CD2-CB 3.84Å; Y217-F299 AromaticContact CD2-CD1 3.7Å; Y217-F299 HydrophobicContact CD2-CD1 3.7Å; Y217-F299 AromaticContact CD2-CD2 3.76Å; Y217-F299 HydrophobicContact CD2-CD2 3.76Å; Y217-F299 HydrophobicContact CD2-CE1 4.14Å; Y217-F299 HydrophobicContact CD2-CE2 4.18Å; Y217-F299 AromaticContact CD2-CG 3.48Å; Y217-F299 HydrophobicContact CD2-CG 3.48Å; Y217-F299 VanDerWaalsContact CD2-CG 3.48Å; Y217-F299 HydrophobicContact CD2-CZ 4.36Å; Y217-F299 HydrophobicContact CE2-CD1 4.02Å; Y217-F299 HydrophobicContact CE2-CE1 4.2Å; Y217-F299 HydrophobicContact CE2-CG 4.27Å; Y217-F299 HydrophobicContact CG-CB 4.47Å; Y217-F299 AromaticContact CG-CD2 3.81Å; Y217-F299 HydrophobicContact CG-CD2 3.81Å; Y217-F299 HydrophobicContact CG-CE2 4.09Å; Y217-F299 HydrophobicContact CG-CG 4.02Å; C295-F299 PolarHBondContact O-N 3.1Å; W296-F299 AromaticContact CE3-CD1 3.88Å; W296-F299 HydrophobicContact CE3-CD1 3.88Å; W296-F299 HydrophobicContact CH2-CD1 4.37Å; W296-F299 AromaticContact CZ3-CD1 3.48Å; W296-F299 HydrophobicContact CZ3-CD1 3.48Å; W296-F299 VanDerWaalsContact CZ3-CD1 3.48Å; W296-F299 AromaticContact CZ3-CE1 3.85Å; W296-F299 HydrophobicContact CZ3-CE1 3.85Å; W296-F299 PolarHBondContact O-N 3.31Å; Q297-F299 PolarHBondContact O-N 2.98Å; F299-S302 WeakPolarHBondContact O-CB 3.5Å; F299-S302 PolarHBondContact O-N 3.2Å
300	K	98.3	Very high	98.4	Very high	66 Å²	66	51.1 Å²	51.1	29%	0.287	25%	0.245	S	C	.	.	H	α-helix	trans	-63.2	-44.5	173.6	-76.3	175.4	56.9	-160.2	0	113	T50 W296 Q297 T298 S302 K303	T50-K300 HydrophobicContact CG2-CG 4.47Å; W296-K300 HydrophobicContact CD2-CD 4.31Å; W296-K300 HydrophobicContact CD2-CG 4.3Å; W296-K300 HydrophobicContact CH2-CG 4.35Å; W296-K300 HydrophobicContact CZ2-CD 3.91Å; W296-K300 HydrophobicContact CZ2-CG 3.98Å; W296-K300 PolarHBondContact O-N 3.37Å; Q297-K300 WeakPolarHBondContact O-CB 3.35Å; Q297-K300 PolarHBondContact O-N 3.34Å; Q297-K300 VanDerWaalsContact O-N 3.16Å; T298-K300 VanDerWaalsContact C-N 3.31Å; T298-K300 PolarHBondContact O-N 3.05Å; K300-S302 PolarHBondContact O-N 2.97Å; K300-K303 WeakPolarHBondContact O-CD 3.46Å; K300-K303 WeakPolarHBondContact O-CG 3.43Å; K300-K303 PolarHBondContact O-N 3.04Å
301	D	98.5	Very high	98.4	Very high	31 Å²	31	46.4 Å²	46.4	17%	0.166	23%	0.228	C	C	.	.	H	α-helix	trans	-70.6	-18.6	-178.2	-66.4	-21.8	0	0	0	111.8	L283 Q297 T298 K303 I304	L283-D301 HydrophobicContact CD1-CB 4.42Å; L283-D301 HydrophobicContact CD2-CB 3.88Å; Q297-D301 PolarHBondContact NE2-OD1 3.45Å; Q297-D301 PolarHBondContact NE2-OD2 3.26Å; Q297-D301 VanDerWaalsContact O-CG 3.25Å; Q297-D301 PolarHBondContact O-N 2.79Å; T298-D301 PolarHBondContact O-N 2.87Å; D301-K303 PolarHBondContact O-N 3.07Å; D301-I304 VanDerWaalsContact O-CB 3.26Å; D301-I304 WeakPolarHBondContact O-CB 3.35Å; D301-I304 PolarHBondContact O-N 3.45Å
302	S	98.5	Very high	98.5	Very high	4 Å²	4	43.8 Å²	43.8	3%	0.028	22%	0.215	C	C	.	.	H	α-helix	trans	-56.6	-37	175.6	-63.1	0	0	0	0	111.5	W209 Y213 T298 F299 K300 I304 T305 G306	W209-S302 VanDerWaalsContact CZ2-O 3.26Å; W209-S302 WeakPolarHBondContact CZ2-O 3.17Å; Y213-S302 WeakPolarHBondContact CB-OG 3.12Å; T298-S302 PolarHBondContact O-N 3.25Å; T298-S302 PolarHBondContact O-OG 3.39Å; F299-S302 WeakPolarHBondContact O-CB 3.5Å; F299-S302 PolarHBondContact O-N 3.2Å; K300-S302 PolarHBondContact O-N 2.97Å; S302-I304 PolarHBondContact O-N 2.8Å; S302-T305 WeakPolarHBondContact O-CA 3.23Å; S302-T305 WeakPolarHBondContact O-CB 3.31Å; S302-T305 PolarHBondContact O-N 3.12Å; S302-T305 PolarHBondContact O-OG1 3.03Å; S302-G306 PolarHBondContact O-N 3.07Å
303	K	98.2	Very high	98.5	Very high	61 Å²	61	41 Å²	41	27%	0.265	20%	0.196	S	C	.	.	H	α-helix	trans	-55	-30	175.5	78	-166.4	173.4	171.9	0	113.6	W53 L57 K300 D301 T305 G306 L307	W53-K303 HydrophobicContact CB-CB 4.04Å; L57-K303 HydrophobicContact CD1-CB 4.37Å; L57-K303 WeakPolarHBondContact CD1-O 3.41Å; K300-K303 WeakPolarHBondContact O-CD 3.46Å; K300-K303 WeakPolarHBondContact O-CG 3.43Å; K300-K303 PolarHBondContact O-N 3.04Å; D301-K303 PolarHBondContact O-N 3.07Å; K303-T305 VanDerWaalsContact C-N 3.34Å; K303-G306 PolarHBondContact O-N 3.09Å; K303-L307 WeakPolarHBondContact O-CG 3.35Å; K303-L307 PolarHBondContact O-N 2.98Å
304	I	98.5	Very high	98.6	Very high	70 Å²	70	33.4 Å²	33.4	36%	0.359	17%	0.165	S	C	.	.	H	α-helix	trans	-66.1	-40.2	176.3	-58.5	172.8	0	0	0	109.7	D301 S302 G306 L307 L308	D301-I304 VanDerWaalsContact O-CB 3.26Å; D301-I304 WeakPolarHBondContact O-CB 3.35Å; D301-I304 PolarHBondContact O-N 3.45Å; S302-I304 PolarHBondContact O-N 2.8Å; I304-G306 VanDerWaalsContact C-N 3.32Å; I304-G306 PolarHBondContact O-N 3.27Å; I304-L307 PolarHBondContact O-N 3.45Å; I304-L308 HydrophobicContact CG2-CD1 4.16Å; I304-L308 HydrophobicContact CG2-CG 4.22Å; I304-L308 WeakPolarHBondContact O-CB 3.35Å; I304-L308 VanDerWaalsContact O-CG 3.29Å; I304-L308 WeakPolarHBondContact O-CG 3.13Å; I304-L308 PolarHBondContact O-N 3.03Å
305	T	98.6	Very high	98.6	Very high	1 Å²	1	37 Å²	37	1%	0.006	18%	0.181	C	C	.	.	H	α-helix	trans	-53.7	-50.1	173.1	-52.4	0	0	0	0	111.4	W209 M252 T276 H279 V280 S302 K303 L307 L308 Y309	W209-T305 HydrophobicContact CZ2-CG2 4.43Å; M252-T305 HydrophobicContact CE-CG2 4.43Å; T276-T305 HydrophobicContact CG2-CG2 3.64Å; H279-T305 PolarHBondContact CE1-OG1 3.12Å; H279-T305 VanDerWaalsContact CE1-OG1 3.28Å; H279-T305 PolarHBondContact ND1-OG1 2.88Å; V280-T305 HydrophobicContact CG2-CG2 3.31Å; S302-T305 WeakPolarHBondContact O-CA 3.23Å; S302-T305 WeakPolarHBondContact O-CB 3.31Å; S302-T305 PolarHBondContact O-N 3.12Å; S302-T305 PolarHBondContact O-OG1 3.03Å; K303-T305 VanDerWaalsContact C-N 3.34Å; T305-L307 VanDerWaalsContact C-N 3.32Å; T305-L307 PolarHBondContact O-N 3.1Å; T305-L308 PolarHBondContact O-N 2.89Å; T305-Y309 PolarHBondContact O-N 3.47Å
306	G	98.6	Very high	98.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-70.7	-30.3	-177.9	0	0	0	0	0	113.1	W61 S302 K303 I304 F310	W61-G306 PolarHBondContact NE1-O 3.41Å; S302-G306 PolarHBondContact O-N 3.07Å; K303-G306 PolarHBondContact O-N 3.09Å; I304-G306 VanDerWaalsContact C-N 3.32Å; I304-G306 PolarHBondContact O-N 3.27Å; G306-F310 WeakPolarHBondContact O-CB 3.47Å; G306-F310 PolarHBondContact O-N 3.49Å
307	L	98.7	Very high	98.5	Very high	59 Å²	59	34.8 Å²	34.8	31%	0.309	17%	0.173	S	C	.	.	H	α-helix	trans	-67.5	-42.6	170.9	-74	168.5	0	0	0	112	W53 L57 K303 I304 T305 Y309 F310 L311	W53-L307 HydrophobicContact CZ3-CD2 4.06Å; L57-L307 HydrophobicContact CD2-CD2 3.71Å; L57-L307 HydrophobicContact CD2-CG 3.95Å; K303-L307 WeakPolarHBondContact O-CG 3.35Å; K303-L307 PolarHBondContact O-N 2.98Å; I304-L307 PolarHBondContact O-N 3.45Å; T305-L307 VanDerWaalsContact C-N 3.32Å; T305-L307 PolarHBondContact O-N 3.1Å; L307-Y309 VanDerWaalsContact C-N 3.3Å; L307-Y309 PolarHBondContact O-N 3.01Å; L307-F310 PolarHBondContact O-N 3.07Å; L307-L311 WeakPolarHBondContact O-CB 3.45Å; L307-L311 VanDerWaalsContact O-CG 3.31Å; L307-L311 WeakPolarHBondContact O-CG 3.43Å; L307-L311 PolarHBondContact O-N 3.13Å
308	L	98.8	Very high	98.4	Very high	62 Å²	62	35.4 Å²	35.4	33%	0.325	18%	0.178	S	C	.	.	H	α-helix	trans	-58.8	-43.7	175.6	-72.7	172.7	0	0	0	111.2	H279 I304 T305 L311 T312	H279-L308 HydrophobicContact CB-CD1 4Å; I304-L308 HydrophobicContact CG2-CD1 4.16Å; I304-L308 HydrophobicContact CG2-CG 4.22Å; I304-L308 WeakPolarHBondContact O-CB 3.35Å; I304-L308 VanDerWaalsContact O-CG 3.29Å; I304-L308 WeakPolarHBondContact O-CG 3.13Å; I304-L308 PolarHBondContact O-N 3.03Å; T305-L308 PolarHBondContact O-N 2.89Å; L308-L311 PolarHBondContact O-N 3.12Å; L308-T312 WeakPolarHBondContact O-CB 3.4Å; L308-T312 PolarHBondContact O-N 3.21Å; L308-T312 PolarHBondContact O-OG1 2.97Å
309	Y	98.9	Very high	98.2	Very high	1 Å²	1	38.4 Å²	38.4	0%	0.004	20%	0.199	C	C	.	.	H	α-helix	trans	-70.6	-39.1	178	-171.6	-123.2	0	0	0	112.6	W61 L202 L256 Y269 T305 L307 L311 T312 I313	W61-Y309 HydrophobicContact CB-CE1 4.36Å; W61-Y309 AromaticContact CD1-CD1 3.94Å; W61-Y309 AromaticContact CD2-CD1 3.61Å; W61-Y309 HydrophobicContact CD2-CD1 3.61Å; W61-Y309 HydrophobicContact CD2-CE1 4.01Å; W61-Y309 AromaticContact CE2-CD1 3.71Å; W61-Y309 HydrophobicContact CE3-CD1 4.05Å; W61-Y309 HydrophobicContact CE3-CE1 4.14Å; W61-Y309 AromaticContact CG-CD1 3.81Å; W61-Y309 HydrophobicContact CG-CD1 3.81Å; W61-Y309 HydrophobicContact CG-CE1 4.1Å; W61-Y309 HydrophobicContact CZ2-CD1 4.22Å; W61-Y309 HydrophobicContact CZ3-CD1 4.5Å; W61-Y309 AromaticContact NE1-CD1 3.88Å; L202-Y309 HydrophobicContact CD1-CE1 3.75Å; L256-Y309 HydrophobicContact CB-CE2 4.43Å; L256-Y309 HydrophobicContact CD1-CD1 4.38Å; L256-Y309 HydrophobicContact CD1-CD2 4.15Å; L256-Y309 HydrophobicContact CD1-CE1 4.13Å; L256-Y309 HydrophobicContact CD1-CE2 3.9Å; L256-Y309 HydrophobicContact CD1-CG 4.4Å; L256-Y309 HydrophobicContact CD2-CE1 3.89Å; Y269-Y309 AromaticContact CE2-CE2 3.95Å; Y269-Y309 HydrophobicContact CE2-CE2 3.95Å; Y269-Y309 PolarHBondContact OH-OH 3.24Å; T305-Y309 PolarHBondContact O-N 3.47Å; L307-Y309 VanDerWaalsContact C-N 3.3Å; L307-Y309 PolarHBondContact O-N 3.01Å; Y309-L311 PolarHBondContact O-N 2.95Å; Y309-T312 WeakPolarHBondContact O-CB 3.48Å; Y309-T312 PolarHBondContact O-N 3.04Å; Y309-I313 HydrophobicContact CD1-CD1 4.05Å; Y309-I313 HydrophobicContact CE1-CD1 3.68Å; Y309-I313 HydrophobicContact CE1-CG1 4.5Å; Y309-I313 HydrophobicContact CE2-CD1 4.39Å; Y309-I313 HydrophobicContact CE2-CG1 4.36Å; Y309-I313 WeakPolarHBondContact O-CG1 3.47Å; Y309-I313 PolarHBondContact O-N 3.14Å; Y309-I313 VanDerWaalsContact O-N 3.09Å
310	F	98.8	Very high	97.8	Very high	36 Å²	36	42.8 Å²	42.8	16%	0.158	22%	0.223	C	C	.	.	H	α-helix	trans	-58	-48.5	172	173.9	-117.3	0	0	0	111.7	T60 A64 P73 L78 G306 L307 T312 I313 V314	T60-F310 WeakPolarHBondContact O-CE2 3.3Å; T60-F310 WeakPolarHBondContact OG1-CD2 3.43Å; T60-F310 WeakPolarHBondContact OG1-CG 3.2Å; A64-F310 HydrophobicContact CB-CD2 4.25Å; A64-F310 HydrophobicContact CB-CE2 3.93Å; P73-F310 HydrophobicContact CG-CE2 4.25Å; P73-F310 HydrophobicContact CG-CZ 4.08Å; L78-F310 HydrophobicContact CD1-CZ 4.35Å; L78-F310 HydrophobicContact CD2-CE2 4.47Å; L78-F310 HydrophobicContact CD2-CZ 4.49Å; G306-F310 WeakPolarHBondContact O-CB 3.47Å; G306-F310 PolarHBondContact O-N 3.49Å; L307-F310 PolarHBondContact O-N 3.07Å; F310-T312 VanDerWaalsContact C-N 3.3Å; F310-T312 PolarHBondContact O-N 3.37Å; F310-I313 PolarHBondContact O-N 3.28Å; F310-V314 HydrophobicContact CD2-CG2 4.14Å; F310-V314 HydrophobicContact CE1-CG2 4.22Å; F310-V314 HydrophobicContact CE2-CG2 3.7Å; F310-V314 HydrophobicContact CZ-CG2 3.74Å; F310-V314 WeakPolarHBondContact O-CG2 3.45Å; F310-V314 PolarHBondContact O-N 3.02Å
311	L	98.7	Very high	97.8	Very high	90 Å²	90	41.6 Å²	41.6	47%	0.471	22%	0.22	S	C	.	.	H	α-helix	trans	-62.8	-37.4	177.3	-70.4	172.8	0	0	0	112	L307 L308 Y309 I313 V314 L315	L307-L311 WeakPolarHBondContact O-CB 3.45Å; L307-L311 VanDerWaalsContact O-CG 3.31Å; L307-L311 WeakPolarHBondContact O-CG 3.43Å; L307-L311 PolarHBondContact O-N 3.13Å; L308-L311 PolarHBondContact O-N 3.12Å; Y309-L311 PolarHBondContact O-N 2.95Å; L311-I313 VanDerWaalsContact C-N 3.34Å; L311-I313 PolarHBondContact O-N 2.85Å; L311-V314 PolarHBondContact O-N 2.88Å; L311-L315 WeakPolarHBondContact O-CB 3.37Å; L311-L315 VanDerWaalsContact O-CG 3.23Å; L311-L315 WeakPolarHBondContact O-CG 3.42Å; L311-L315 PolarHBondContact O-N 3.39Å
312	T	98.7	Very high	97.7	Very high	11 Å²	11	42.2 Å²	42.2	7%	0.067	22%	0.222	C	C	.	.	H	α-helix	trans	-55.8	-49.3	174.2	-63.8	0	0	0	0	111.1	Y269 G272 L308 Y309 F310 D316	Y269-T312 HydrophobicContact CD2-CG2 4.24Å; Y269-T312 WeakPolarHBondContact O-CG2 3.41Å; G272-T312 VanDerWaalsContact CA-OG1 3.27Å; G272-T312 WeakPolarHBondContact CA-OG1 3.3Å; G272-T312 PolarHBondContact O-OG1 2.95Å; L308-T312 WeakPolarHBondContact O-CB 3.4Å; L308-T312 PolarHBondContact O-N 3.21Å; L308-T312 PolarHBondContact O-OG1 2.97Å; Y309-T312 WeakPolarHBondContact O-CB 3.48Å; Y309-T312 PolarHBondContact O-N 3.04Å; F310-T312 VanDerWaalsContact C-N 3.3Å; F310-T312 PolarHBondContact O-N 3.37Å; T312-D316 WeakPolarHBondContact O-CB 3.45Å; T312-D316 PolarHBondContact O-N 3.05Å
313	I	98.8	Very high	97.7	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-64	-46.1	179.4	-63.3	161.4	0	0	0	110.7	W61 A64 L65 Y269 Y309 F310 L311 D316 K317	W61-I313 HydrophobicContact CB-CD1 3.74Å; W61-I313 HydrophobicContact CG-CD1 4.23Å; A64-I313 HydrophobicContact CB-CB 4.25Å; A64-I313 HydrophobicContact CB-CG2 3.52Å; L65-I313 HydrophobicContact CD1-CD1 4.09Å; L65-I313 HydrophobicContact CD2-CG1 4.46Å; L65-I313 HydrophobicContact CD2-CG2 3.96Å; L65-I313 HydrophobicContact CG-CD1 4.07Å; L65-I313 HydrophobicContact CG-CG1 4.33Å; L65-I313 HydrophobicContact CG-CG2 3.78Å; Y269-I313 HydrophobicContact CD2-CG1 4.41Å; Y269-I313 HydrophobicContact CE2-CG1 4.06Å; Y309-I313 HydrophobicContact CD1-CD1 4.05Å; Y309-I313 HydrophobicContact CE1-CD1 3.68Å; Y309-I313 HydrophobicContact CE1-CG1 4.5Å; Y309-I313 HydrophobicContact CE2-CD1 4.39Å; Y309-I313 HydrophobicContact CE2-CG1 4.36Å; Y309-I313 WeakPolarHBondContact O-CG1 3.47Å; Y309-I313 PolarHBondContact O-N 3.14Å; Y309-I313 VanDerWaalsContact O-N 3.09Å; F310-I313 PolarHBondContact O-N 3.28Å; L311-I313 VanDerWaalsContact C-N 3.34Å; L311-I313 PolarHBondContact O-N 2.85Å; I313-D316 PolarHBondContact O-N 2.87Å; I313-K317 HydrophobicContact CG2-CG 4.32Å; I313-K317 WeakPolarHBondContact O-CB 3.06Å; I313-K317 VanDerWaalsContact O-CG 3.29Å; I313-K317 WeakPolarHBondContact O-CG 3.5Å; I313-K317 PolarHBondContact O-N 2.93Å
314	V	98.7	Very high	97.7	Very high	16 Å²	16	43.3 Å²	43.3	10%	0.097	23%	0.231	C	C	.	.	H	α-helix	trans	-62.9	-45.5	-178.5	172.6	0	0	0	0	111.5	A64 L72 P73 F310 L311 K317 I318	A64-V314 HydrophobicContact CB-CG2 4.05Å; L72-V314 HydrophobicContact CD2-CG1 3.74Å; P73-V314 HydrophobicContact CG-CG2 4Å; F310-V314 HydrophobicContact CD2-CG2 4.14Å; F310-V314 HydrophobicContact CE1-CG2 4.22Å; F310-V314 HydrophobicContact CE2-CG2 3.7Å; F310-V314 HydrophobicContact CZ-CG2 3.74Å; F310-V314 WeakPolarHBondContact O-CG2 3.45Å; F310-V314 PolarHBondContact O-N 3.02Å; L311-V314 PolarHBondContact O-N 2.88Å; V314-K317 PolarHBondContact O-N 3.15Å; V314-I318 HydrophobicContact CG1-CD1 3.85Å; V314-I318 WeakPolarHBondContact O-CD1 3.42Å; V314-I318 VanDerWaalsContact O-CG1 3.3Å; V314-I318 WeakPolarHBondContact O-CG1 3.47Å; V314-I318 PolarHBondContact O-N 3.46Å; V314-I318 VanDerWaalsContact O-N 3.11Å
315	L	98.6	Very high	97.6	Very high	103 Å²	103	41.6 Å²	41.6	54%	0.539	22%	0.223	S	C	.	.	H	α-helix	trans	-65.1	-40.5	179	-70.5	171.9	0	0	0	111.7	V268 L311 S319	V268-L315 HydrophobicContact CG1-CB 3.87Å; L311-L315 WeakPolarHBondContact O-CB 3.37Å; L311-L315 VanDerWaalsContact O-CG 3.23Å; L311-L315 WeakPolarHBondContact O-CG 3.42Å; L311-L315 PolarHBondContact O-N 3.39Å; L315-S319 WeakPolarHBondContact O-CB 3.4Å; L315-S319 PolarHBondContact O-N 3.49Å; L315-S319 PolarHBondContact O-OG 3.02Å
316	D	98.5	Very high	97.6	Very high	5 Å²	5	44.3 Å²	44.3	3%	0.027	24%	0.238	C	C	.	.	H	α-helix	trans	-62.5	-47.6	174.9	-168	76.3	0	0	0	111.1	G266 V268 Y269 T312 I313 I318 S319 L320	G266-D316 VanDerWaalsContact C-OD1 3.26Å; G266-D316 WeakPolarHBondContact CA-OD1 3.4Å; G266-D316 PolarHBondContact N-OD1 2.77Å; G266-D316 PolarHBondContact N-OD2 2.98Å; V268-D316 HydrophobicContact CB-CB 4.2Å; V268-D316 HydrophobicContact CG1-CB 4.31Å; Y269-D316 VanDerWaalsContact CB-CG 3.45Å; Y269-D316 WeakPolarHBondContact CB-OD1 3.43Å; Y269-D316 PolarHBondContact N-OD1 2.96Å; T312-D316 WeakPolarHBondContact O-CB 3.45Å; T312-D316 PolarHBondContact O-N 3.05Å; I313-D316 PolarHBondContact O-N 2.87Å; D316-I318 VanDerWaalsContact C-N 3.32Å; D316-I318 PolarHBondContact O-N 3.46Å; D316-S319 WeakPolarHBondContact CA-OG 3.43Å; D316-S319 WeakPolarHBondContact O-CA 3.43Å; D316-S319 PolarHBondContact O-N 3.12Å; D316-S319 PolarHBondContact O-OG 2.8Å; D316-L320 WeakPolarHBondContact O-CG 3.45Å; D316-L320 PolarHBondContact O-N 3.35Å
317	K	96.3	Very high	97.5	Very high	23 Å²	23	47.5 Å²	47.5	10%	0.1	26%	0.255	C	S	.	.	H	α-helix	trans	-57.9	-39.5	179.4	-77.8	-72.3	-177.4	170.6	0	113.9	A64 L65 A67 G70 I313 V314 S319	A64-K317 WeakPolarHBondContact O-CE 3.4Å; L65-K317 VanDerWaalsContact O-CE 3.3Å; L65-K317 WeakPolarHBondContact O-CE 3.17Å; L65-K317 PolarHBondContact O-NZ 3.46Å; A67-K317 WeakPolarHBondContact O-CE 3.5Å; A67-K317 PolarHBondContact O-NZ 3.11Å; G70-K317 WeakPolarHBondContact CA-O 3.42Å; G70-K317 PolarHBondContact N-O 2.95Å; I313-K317 HydrophobicContact CG2-CG 4.32Å; I313-K317 WeakPolarHBondContact O-CB 3.06Å; I313-K317 VanDerWaalsContact O-CG 3.29Å; I313-K317 WeakPolarHBondContact O-CG 3.5Å; I313-K317 PolarHBondContact O-N 2.93Å; V314-K317 PolarHBondContact O-N 3.15Å; K317-S319 VanDerWaalsContact C-N 3.28Å
318	I	96.7	Very high	97.4	Very high	86 Å²	86	46.6 Å²	46.6	44%	0.441	25%	0.251	S	S	.	.	H	α-helix	trans	-72.6	-25.5	177.4	-62.8	163.1	0	0	0	111.4	L72 V314 D316	L72-I318 HydrophobicContact CD2-CD1 3.58Å; L72-I318 HydrophobicContact CD2-CG1 4.21Å; L72-I318 HydrophobicContact CG-CD1 4.39Å; V314-I318 HydrophobicContact CG1-CD1 3.85Å; V314-I318 WeakPolarHBondContact O-CD1 3.42Å; V314-I318 VanDerWaalsContact O-CG1 3.3Å; V314-I318 WeakPolarHBondContact O-CG1 3.47Å; V314-I318 PolarHBondContact O-N 3.46Å; V314-I318 VanDerWaalsContact O-N 3.11Å; D316-I318 VanDerWaalsContact C-N 3.32Å; D316-I318 PolarHBondContact O-N 3.46Å
319	S	94.9	Very high	97.3	Very high	70 Å²	70	45.3 Å²	45.3	49%	0.49	24%	0.244	S	C	.	.	H	α-helix	trans	-83.5	-11.6	-179.5	73.5	0	0	0	0	114.8	L315 D316 K317	L315-S319 WeakPolarHBondContact O-CB 3.4Å; L315-S319 PolarHBondContact O-N 3.49Å; L315-S319 PolarHBondContact O-OG 3.02Å; D316-S319 WeakPolarHBondContact CA-OG 3.43Å; D316-S319 WeakPolarHBondContact O-CA 3.43Å; D316-S319 PolarHBondContact O-N 3.12Å; D316-S319 PolarHBondContact O-OG 2.8Å; K317-S319 VanDerWaalsContact C-N 3.28Å
320	L	89.6	Confident	97.1	Very high	101 Å²	101	49.4 Å²	49.4	53%	0.529	27%	0.266	S	S	.	.			trans	-88.5	0	175.2	-64.8	173.7	0	0	0	110.8	P69 G70 D316	P69-L320 HydrophobicContact CB-CB 3.96Å; G70-L320 WeakPolarHBondContact CA-OXT 3.38Å; G70-L320 PolarHBondContact N-OXT 3.44Å; D316-L320 WeakPolarHBondContact O-CG 3.45Å; D316-L320 PolarHBondContact O-N 3.35Å

Retrieved 320 of 320 residues in 639.5 ms (Link to these results)

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