A0A060W6W5_ONCMY Loading...

Ankyrin repeat and death domain containing 1B

AlphaFold DB , UniProt , Accession A0A060W6W5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110525791, Length 557 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	38.5	Very low	33.7	Very low	246 Å²	246	166.5 Å²	166.5	100%	1.212	81%	0.812	S	S	*	*				0	105.7	0	-68.8	167.2	115	0	0	104.4
2	E	29.6	Very low	33.7	Very low	196 Å²	196	164.3 Å²	164.3	92%	0.916	81%	0.805	S	S	*	*				-145.7	150.8	65.2	-78.8	169.2	140.8	0	0	112.9
3	K	32	Very low	33.5	Very low	212 Å²	212	165.5 Å²	165.5	92%	0.922	80%	0.804	S	S	*	*			trans	-73.7	122.7	-179.1	-70.1	170.8	171.5	178.7	0	110.3
4	R	30.9	Very low	33.7	Very low	247 Å²	247	162.4 Å²	162.4	93%	0.932	79%	0.787	S	S	*	*			trans	-84.6	116.2	158.1	-88.5	-178	173.1	177	-1.8	108.6	L6	R4-L6 PolarHBondContact O-N 3.11Å
5	S	32.8	Very low	33.7	Very low	109 Å²	109	162.9 Å²	162.9	76%	0.762	78%	0.777	S	S	*	*			trans	-67.2	114.2	173.7	57.3	0	0	0	0	110.4	K7	S5-K7 PolarHBondContact O-N 2.84Å
6	L	33.1	Very low	33.4	Very low	169 Å²	169	159.4 Å²	159.4	89%	0.885	76%	0.762	S	S	*	*			trans	-66.8	113.3	162.2	-77.1	151.4	0	0	0	107.3	R4 E8	R4-L6 PolarHBondContact O-N 3.11Å; L6-E8 PolarHBondContact O-N 3.49Å
7	K	35.2	Very low	33.2	Very low	194 Å²	194	152.1 Å²	152.1	84%	0.843	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-68.3	120.6	165.1	-81.6	-177.9	174	-178.1	0	107.1	S5 I9	S5-K7 PolarHBondContact O-N 2.84Å; K7-I9 PolarHBondContact O-N 3.05Å
8	E	33.4	Very low	32.9	Very low	190 Å²	190	147.1 Å²	147.1	89%	0.888	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-57.2	124.3	174.1	-72.1	171.6	158.6	0	0	109.7	L6	L6-E8 PolarHBondContact O-N 3.49Å
9	I	35.8	Very low	32.7	Very low	146 Å²	146	147.1 Å²	147.1	75%	0.749	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-80.2	121.8	167.7	-62.2	166.9	0	0	0	105.3	K7 S11	K7-I9 PolarHBondContact O-N 3.05Å; I9-S11 PolarHBondContact O-N 2.95Å
10	P	33.1	Very low	32.5	Very low	66 Å²	66	146.4 Å²	146.4	43%	0.429	72%	0.722	S	S	.	*	P	Polyproline II helix	trans	-61.8	139.4	-179	22.3	-30.7	0	0	0	110.5	E14	P10-E14 WeakPolarHBondContact CA-OE2 3.48Å; P10-E14 HydrophobicContact CB-CB 4.21Å; P10-E14 WeakPolarHBondContact CB-OE2 3.48Å
11	S	36.4	Very low	32.3	Very low	57 Å²	57	148.5 Å²	148.5	40%	0.399	73%	0.728	S	S	.	*	P	Polyproline II helix	trans	-65.3	155.9	-175.4	68.4	0	0	0	0	111.7	I9 K13 E14 R15	I9-S11 PolarHBondContact O-N 2.95Å; S11-K13 PolarHBondContact O-N 3.46Å; S11-E14 PolarHBondContact N-OE2 3.34Å; S11-E14 WeakPolarHBondContact O-CB 3.44Å; S11-E14 PolarHBondContact O-N 3.15Å; S11-E14 PolarHBondContact OG-N 2.8Å; S11-E14 PolarHBondContact OG-OE2 2.87Å; S11-R15 PolarHBondContact O-N 3.14Å; S11-R15 VanDerWaalsContact O-N 3.15Å
12	L	33.6	Very low	31.7	Very low	139 Å²	139	145.2 Å²	145.2	73%	0.728	71%	0.709	S	S	*	*	H	α-helix	trans	-52	-29.2	171.6	-100.4	124.6	0	0	0	112.4	R15 M16	L12-R15 PolarHBondContact O-N 3.05Å; L12-M16 HydrophobicContact CD2-SD 4.42Å; L12-M16 WeakPolarHBondContact O-CB 3.32Å; L12-M16 WeakPolarHBondContact O-CG 3.3Å; L12-M16 PolarHBondContact O-N 3.43Å
13	K	31.6	Very low	31.6	Very low	181 Å²	181	141.1 Å²	141.1	79%	0.787	69%	0.693	S	S	*	*	H	α-helix	trans	-68	-33.4	175.7	-149.5	175	-173.7	176.6	0	112.9	S11 G17	S11-K13 PolarHBondContact O-N 3.46Å; K13-G17 WeakPolarHBondContact O-CA 3.4Å; K13-G17 PolarHBondContact O-N 3.2Å
14	E	35.3	Very low	31.4	Very low	122 Å²	122	138.7 Å²	138.7	57%	0.57	69%	0.69	S	S	*	*	H	α-helix	trans	-79.5	-30.5	175.2	-71	166.1	141.3	0	0	111.9	P10 S11 A18	P10-E14 WeakPolarHBondContact CA-OE2 3.48Å; P10-E14 HydrophobicContact CB-CB 4.21Å; P10-E14 WeakPolarHBondContact CB-OE2 3.48Å; S11-E14 PolarHBondContact N-OE2 3.34Å; S11-E14 WeakPolarHBondContact O-CB 3.44Å; S11-E14 PolarHBondContact O-N 3.15Å; S11-E14 PolarHBondContact OG-N 2.8Å; S11-E14 PolarHBondContact OG-OE2 2.87Å; E14-A18 WeakPolarHBondContact O-CB 3.18Å; E14-A18 PolarHBondContact O-N 2.97Å
15	R	33.6	Very low	31.5	Very low	169 Å²	169	130.3 Å²	130.3	64%	0.638	66%	0.664	S	S	*	*	H	α-helix	trans	-72.8	-38.6	173.1	-75.4	-179.8	168.5	-179.2	-3.5	113	S11 L12	S11-R15 PolarHBondContact O-N 3.14Å; S11-R15 VanDerWaalsContact O-N 3.15Å; L12-R15 PolarHBondContact O-N 3.05Å
16	M	30	Very low	31.4	Very low	107 Å²	107	127.4 Å²	127.4	53%	0.527	64%	0.64	S	S	.	*	H	α-helix	trans	-84.3	-33	177.9	-67.7	176.5	64.1	0	0	113	L12 A18 Q19 L20	L12-M16 HydrophobicContact CD2-SD 4.42Å; L12-M16 WeakPolarHBondContact O-CB 3.32Å; L12-M16 WeakPolarHBondContact O-CG 3.3Å; L12-M16 PolarHBondContact O-N 3.43Å; M16-A18 VanDerWaalsContact C-N 3.26Å; M16-A18 PolarHBondContact O-N 2.96Å; M16-Q19 PolarHBondContact O-N 3.01Å; M16-L20 PolarHBondContact O-N 3.47Å
17	G	29.4	Very low	31.1	Very low	36 Å²	36	123.3 Å²	123.3	37%	0.371	62%	0.623	S	S	.	*	H	α-helix	trans	-67.9	-24.6	175.8	0	0	0	0	0	113.7	K13	K13-G17 WeakPolarHBondContact O-CA 3.4Å; K13-G17 PolarHBondContact O-N 3.2Å
18	A	28.7	Very low	30.9	Very low	62 Å²	62	121.7 Å²	121.7	51%	0.512	62%	0.616	S	S	.	*	H	α-helix	trans	-75	-34.9	170.7	0	0	0	0	0	112.3	E14 M16 K21	E14-A18 WeakPolarHBondContact O-CB 3.18Å; E14-A18 PolarHBondContact O-N 2.97Å; M16-A18 VanDerWaalsContact C-N 3.26Å; M16-A18 PolarHBondContact O-N 2.96Å; A18-K21 PolarHBondContact O-N 3.08Å
19	Q	28	Very low	30.9	Very low	147 Å²	147	115.7 Å²	115.7	69%	0.687	59%	0.592	S	S	*	*	H	α-helix	trans	-71.3	-26.4	175.9	-97.7	174.4	-27.4	0	0	113.8	M16	M16-Q19 PolarHBondContact O-N 3.01Å
20	L	28.3	Very low	30.5	Very low	132 Å²	132	111.9 Å²	111.9	69%	0.691	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-3.1	178.1	-76.8	163.2	0	0	0	114.3	M16	M16-L20 PolarHBondContact O-N 3.47Å
21	K	28.2	Very low	30.4	Very low	192 Å²	192	115.2 Å²	115.2	84%	0.835	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	0.6	178.3	-91.7	-176.1	175.8	-179.3	0	114.9	A18	A18-K21 PolarHBondContact O-N 3.08Å
22	E	26.1	Very low	30.3	Very low	177 Å²	177	117.9 Å²	117.9	83%	0.827	59%	0.591	S	S	*	*	S	Bend	trans	-112.4	10.7	175	-79.8	-172.6	163.7	0	0	114.3	N24	E22-N24 PolarHBondContact O-N 3.19Å
23	L	27.6	Very low	30.6	Very low	109 Å²	109	113.1 Å²	113.1	57%	0.571	57%	0.569	S	S	*	*			trans	-98	86.4	173.1	-72.6	166.7	0	0	0	110	L25	L23-L25 HydrophobicContact CB-CD1 3.81Å; L23-L25 HydrophobicContact CB-CG 4.05Å; L23-L25 HydrophobicContact CD1-CD1 4.21Å; L23-L25 HydrophobicContact CD2-CD1 4.16Å; L23-L25 HydrophobicContact CD2-CG 4.35Å; L23-L25 HydrophobicContact CG-CD1 4.29Å; L23-L25 PolarHBondContact O-N 3.26Å
24	N	27.8	Very low	31.1	Very low	162 Å²	162	110.8 Å²	110.8	87%	0.866	56%	0.559	S	S	*	*			trans	-71.9	59.7	166.5	-119.5	-3.4	0	0	0	109.7	E22	E22-N24 PolarHBondContact O-N 3.19Å
25	L	32.8	Very low	31.5	Very low	71 Å²	71	112.1 Å²	112.1	37%	0.372	56%	0.563	S	S	.	*			trans	-80.1	140.1	179.5	-75.3	162.2	0	0	0	110.8	L23	L23-L25 HydrophobicContact CB-CD1 3.81Å; L23-L25 HydrophobicContact CB-CG 4.05Å; L23-L25 HydrophobicContact CD1-CD1 4.21Å; L23-L25 HydrophobicContact CD2-CD1 4.16Å; L23-L25 HydrophobicContact CD2-CG 4.35Å; L23-L25 HydrophobicContact CG-CD1 4.29Å; L23-L25 PolarHBondContact O-N 3.26Å
26	N	31.4	Very low	32.1	Very low	48 Å²	48	105.9 Å²	105.9	26%	0.257	55%	0.547	S	S	.	.			trans	-58.8	123.4	-179	-168	-20.1	0	0	0	111.2	K28 T29 D275	N26-K28 PolarHBondContact O-N 3.22Å; N26-K28 VanDerWaalsContact O-N 3.11Å; N26-K28 PolarHBondContact OD1-N 2.71Å; N26-T29 PolarHBondContact O-OG1 3.17Å; N26-D275 PolarHBondContact ND2-OD2 2.93Å
27	P	26.7	Very low	33.6	Very low	82 Å²	82	101.7 Å²	101.7	53%	0.532	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-7.6	-175.2	24.6	-33.5	0	0	0	114.7	K31	P27-K31 VanDerWaalsContact O-CB 3.26Å; P27-K31 WeakPolarHBondContact O-CB 3.24Å; P27-K31 VanDerWaalsContact O-CD 3.32Å; P27-K31 WeakPolarHBondContact O-CD 3.46Å; P27-K31 WeakPolarHBondContact O-CG 3.46Å; P27-K31 PolarHBondContact O-N 3.05Å
28	K	30.6	Very low	35.2	Very low	161 Å²	161	105.4 Å²	105.4	70%	0.7	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-45.8	179.9	-71.7	-178.2	178.4	177.6	0	113	N26 K31 N32	N26-K28 PolarHBondContact O-N 3.22Å; N26-K28 VanDerWaalsContact O-N 3.11Å; N26-K28 PolarHBondContact OD1-N 2.71Å; K28-K31 PolarHBondContact O-N 2.99Å; K28-N32 PolarHBondContact O-N 3.35Å
29	T	34.2	Very low	36.7	Very low	63 Å²	63	102.6 Å²	102.6	39%	0.387	51%	0.51	S	S	.	.	H	α-helix	trans	-69.2	-42.7	177.1	44.9	0	0	0	0	111.4	N26 K31 N32 S33	N26-T29 PolarHBondContact O-OG1 3.17Å; T29-K31 PolarHBondContact O-N 2.98Å; T29-N32 PolarHBondContact O-N 2.98Å; T29-N32 VanDerWaalsContact O-N 3.15Å; T29-S33 PolarHBondContact O-N 3.42Å
30	L	27.3	Very low	38.9	Very low	67 Å²	67	95.6 Å²	95.6	35%	0.351	48%	0.478	S	S	.	.	H	α-helix	trans	-63	-27.4	174.6	-156.1	77.5	0	0	0	112.9	K34	L30-K34 HydrophobicContact CD2-CD 4.25Å; L30-K34 VanDerWaalsContact CD2-NZ 3.25Å; L30-K34 HydrophobicContact CG-CD 3.87Å; L30-K34 HydrophobicContact CG-CG 4.38Å; L30-K34 WeakPolarHBondContact O-CB 3.45Å; L30-K34 WeakPolarHBondContact O-CD 3.32Å; L30-K34 WeakPolarHBondContact O-CG 3.3Å; L30-K34 PolarHBondContact O-N 3.45Å
31	K	29.9	Very low	40.7	Very low	135 Å²	135	91.4 Å²	91.4	59%	0.587	46%	0.458	S	S	*	.	H	α-helix	trans	-76.5	-27.7	177.1	-92.2	176.9	-177.2	175.7	0	113	P27 K28 T29 K35	P27-K31 VanDerWaalsContact O-CB 3.26Å; P27-K31 WeakPolarHBondContact O-CB 3.24Å; P27-K31 VanDerWaalsContact O-CD 3.32Å; P27-K31 WeakPolarHBondContact O-CD 3.46Å; P27-K31 WeakPolarHBondContact O-CG 3.46Å; P27-K31 PolarHBondContact O-N 3.05Å; K28-K31 PolarHBondContact O-N 2.99Å; T29-K31 PolarHBondContact O-N 2.98Å; K31-K35 WeakPolarHBondContact O-CB 3.36Å; K31-K35 WeakPolarHBondContact O-CD 3.31Å; K31-K35 WeakPolarHBondContact O-CG 3.31Å; K31-K35 PolarHBondContact O-N 3.2Å
32	N	36.1	Very low	42.6	Very low	114 Å²	114	83.8 Å²	83.8	61%	0.61	43%	0.426	S	S	*	.	H	α-helix	trans	-83.3	-48.4	179.9	-73.4	-5.1	0	0	0	110.8	K28 T29 K34 K35 A36	K28-N32 PolarHBondContact O-N 3.35Å; T29-N32 PolarHBondContact O-N 2.98Å; T29-N32 VanDerWaalsContact O-N 3.15Å; N32-K34 PolarHBondContact O-N 3.02Å; N32-K35 PolarHBondContact O-N 2.85Å; N32-K35 VanDerWaalsContact O-N 3.16Å; N32-A36 PolarHBondContact O-N 2.97Å
33	S	38.9	Very low	44.5	Very low	38 Å²	38	76.7 Å²	76.7	27%	0.266	39%	0.393	S	S	.	.	H	α-helix	trans	-63.2	-41.8	176	122.3	0	0	0	0	112.4	T29 K35 A36 V37	T29-S33 PolarHBondContact O-N 3.42Å; S33-K35 VanDerWaalsContact C-N 3.29Å; S33-K35 PolarHBondContact O-N 2.9Å; S33-A36 PolarHBondContact O-N 3.2Å; S33-V37 PolarHBondContact O-N 2.87Å
34	K	42.2	Very low	45.9	Very low	132 Å²	132	75.9 Å²	75.9	57%	0.574	39%	0.388	S	S	*	.	H	α-helix	trans	-69.6	-20.8	176.2	-70.3	-178.3	175.7	177	0	114.3	L30 N32	L30-K34 HydrophobicContact CD2-CD 4.25Å; L30-K34 VanDerWaalsContact CD2-NZ 3.25Å; L30-K34 HydrophobicContact CG-CD 3.87Å; L30-K34 HydrophobicContact CG-CG 4.38Å; L30-K34 WeakPolarHBondContact O-CB 3.45Å; L30-K34 WeakPolarHBondContact O-CD 3.32Å; L30-K34 WeakPolarHBondContact O-CG 3.3Å; L30-K34 PolarHBondContact O-N 3.45Å; N32-K34 PolarHBondContact O-N 3.02Å
35	K	44.8	Very low	46.8	Very low	151 Å²	151	74.8 Å²	74.8	66%	0.657	38%	0.377	S	S	*	.	H	α-helix	trans	-82.6	-37	173	-83.7	178.9	-179.8	-178	0	111.5	K31 N32 S33 V37	K31-K35 WeakPolarHBondContact O-CB 3.36Å; K31-K35 WeakPolarHBondContact O-CD 3.31Å; K31-K35 WeakPolarHBondContact O-CG 3.31Å; K31-K35 PolarHBondContact O-N 3.2Å; N32-K35 PolarHBondContact O-N 2.85Å; N32-K35 VanDerWaalsContact O-N 3.16Å; S33-K35 VanDerWaalsContact C-N 3.29Å; S33-K35 PolarHBondContact O-N 2.9Å; K35-V37 VanDerWaalsContact C-N 3.33Å; K35-V37 PolarHBondContact O-N 3.25Å
36	A	46.1	Very low	47.4	Very low	37 Å²	37	74.6 Å²	74.6	31%	0.306	38%	0.377	S	S	.	.	H	α-helix	trans	-63.9	-36.8	-177.4	0	0	0	0	0	112.7	N32 S33 L162	N32-A36 PolarHBondContact O-N 2.97Å; S33-A36 PolarHBondContact O-N 3.2Å; A36-L162 HydrophobicContact CB-CD1 4.17Å; A36-L162 WeakPolarHBondContact O-CD1 3.35Å
37	V	61.2	Low	47.7	Very low	20 Å²	20	81.7 Å²	81.7	12%	0.121	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	1.4	-172.7	-164.2	0	0	0	0	113.3	S33 K35 G39 F40 T41 W139	S33-V37 PolarHBondContact O-N 2.87Å; K35-V37 VanDerWaalsContact C-N 3.33Å; K35-V37 PolarHBondContact O-N 3.25Å; V37-G39 VanDerWaalsContact C-N 3.28Å; V37-G39 PolarHBondContact O-N 3.49Å; V37-G39 VanDerWaalsContact O-N 3.14Å; V37-F40 HydrophobicContact CG1-CB 3.93Å; V37-F40 HydrophobicContact CG1-CD2 4.22Å; V37-F40 WeakPolarHBondContact O-CA 3.41Å; V37-F40 WeakPolarHBondContact O-CB 3.4Å; V37-F40 PolarHBondContact O-N 2.93Å; V37-T41 HydrophobicContact CB-CG2 4.07Å; V37-T41 HydrophobicContact CG1-CG2 3.77Å; V37-T41 PolarHBondContact O-N 3.45Å; V37-W139 HydrophobicContact CB-CH2 4.22Å; V37-W139 HydrophobicContact CG1-CH2 3.17Å; V37-W139 HydrophobicContact CG1-CZ2 3.16Å; V37-W139 HydrophobicContact CG1-CZ3 4.15Å; V37-W139 HydrophobicContact CG2-CH2 4.01Å
38	K	62.6	Low	47.9	Very low	113 Å²	113	86.5 Å²	86.5	49%	0.491	42%	0.421	S	S	.	.	H	α-helix	trans	-56.1	-40	-171	-167.7	175.9	178.9	-177.7	0	113.5	F40 T41 D42	K38-F40 PolarHBondContact O-N 3.2Å; K38-T41 WeakPolarHBondContact CA-OG1 3.43Å; K38-T41 PolarHBondContact O-N 2.93Å; K38-T41 PolarHBondContact O-OG1 3Å; K38-D42 VanDerWaalsContact O-CG 3.31Å; K38-D42 PolarHBondContact O-N 3.17Å
39	G	59.3	Low	47.9	Very low	3 Å²	3	82.9 Å²	82.9	3%	0.031	41%	0.412	C	S	.	.	H	α-helix	trans	-61.9	-20.5	176.1	0	0	0	0	0	114.3	V37 F43 R98	V37-G39 VanDerWaalsContact C-N 3.28Å; V37-G39 PolarHBondContact O-N 3.49Å; V37-G39 VanDerWaalsContact O-N 3.14Å; G39-F43 WeakPolarHBondContact O-CE2 3.28Å; G39-R98 PolarHBondContact O-NH2 3.45Å
40	F	75.2	Confident	47.8	Very low	1 Å²	1	90 Å²	90	0%	0.004	44%	0.441	C	S	.	.	H	α-helix	trans	-101.6	-39.5	177.7	-56.4	-82.4	0	0	0	112.5	V37 K38 D42 F43 V131 H135 L136 W139 L164	V37-F40 HydrophobicContact CG1-CB 3.93Å; V37-F40 HydrophobicContact CG1-CD2 4.22Å; V37-F40 WeakPolarHBondContact O-CA 3.41Å; V37-F40 WeakPolarHBondContact O-CB 3.4Å; V37-F40 PolarHBondContact O-N 2.93Å; K38-F40 PolarHBondContact O-N 3.2Å; F40-D42 VanDerWaalsContact C-N 3.26Å; F40-D42 PolarHBondContact O-N 3Å; F40-F43 WeakPolarHBondContact O-CB 2.96Å; F40-F43 PolarHBondContact O-N 3.28Å; F40-F43 VanDerWaalsContact O-N 3.12Å; F40-V131 HydrophobicContact CD1-CG1 4.22Å; F40-V131 HydrophobicContact CE1-CG1 3.64Å; F40-V131 HydrophobicContact CE1-CG2 4.1Å; F40-V131 HydrophobicContact CE2-CG2 4.14Å; F40-V131 HydrophobicContact CZ-CG1 4.12Å; F40-V131 HydrophobicContact CZ-CG2 3.8Å; F40-H135 HydrophobicContact CE1-CB 4.19Å; F40-H135 HydrophobicContact CZ-CB 4.4Å; F40-L136 HydrophobicContact CD1-CD2 3.99Å; F40-L136 HydrophobicContact CE1-CD2 4.35Å; F40-W139 HydrophobicContact CB-CD2 3.78Å; F40-W139 HydrophobicContact CB-CE3 4.35Å; F40-W139 HydrophobicContact CB-CG 4.16Å; F40-W139 HydrophobicContact CB-CZ2 3.99Å; F40-W139 HydrophobicContact CD1-CB 3.76Å; F40-W139 AromaticContact CD1-CD1 3.96Å; F40-W139 AromaticContact CD1-CD2 3.42Å; F40-W139 HydrophobicContact CD1-CD2 3.42Å; F40-W139 VanDerWaalsContact CD1-CD2 3.42Å; F40-W139 AromaticContact CD1-CE3 3.73Å; F40-W139 HydrophobicContact CD1-CE3 3.73Å; F40-W139 AromaticContact CD1-CG 3.38Å; F40-W139 HydrophobicContact CD1-CG 3.38Å; F40-W139 HydrophobicContact CD2-CD2 4Å; F40-W139 AromaticContact CD2-CE3 3.7Å; F40-W139 HydrophobicContact CD2-CE3 3.7Å; F40-W139 HydrophobicContact CD2-CH2 4.29Å; F40-W139 AromaticContact CD2-CZ3 3.85Å; F40-W139 HydrophobicContact CD2-CZ3 3.85Å; F40-W139 HydrophobicContact CE1-CB 3.85Å; F40-W139 AromaticContact CE1-CD2 3.94Å; F40-W139 HydrophobicContact CE1-CD2 3.94Å; F40-W139 AromaticContact CE1-CE3 3.85Å; F40-W139 HydrophobicContact CE1-CE3 3.85Å; F40-W139 AromaticContact CE1-CG 3.92Å; F40-W139 HydrophobicContact CE1-CG 3.92Å; F40-W139 HydrophobicContact CE2-CD2 4.46Å; F40-W139 AromaticContact CE2-CE3 3.82Å; F40-W139 HydrophobicContact CE2-CE3 3.82Å; F40-W139 HydrophobicContact CE2-CZ3 4.06Å; F40-W139 AromaticContact CG-CD2 3.46Å; F40-W139 HydrophobicContact CG-CD2 3.46Å; F40-W139 VanDerWaalsContact CG-CD2 3.46Å; F40-W139 AromaticContact CG-CE2 3.78Å; F40-W139 AromaticContact CG-CE3 3.67Å; F40-W139 HydrophobicContact CG-CE3 3.67Å; F40-W139 AromaticContact CG-CG 3.9Å; F40-W139 HydrophobicContact CG-CG 3.9Å; F40-W139 HydrophobicContact CG-CH2 4.49Å; F40-W139 HydrophobicContact CG-CZ2 4.31Å; F40-W139 HydrophobicContact CG-CZ3 4.17Å; F40-W139 HydrophobicContact CZ-CD2 4.43Å; F40-W139 AromaticContact CZ-CE3 3.89Å; F40-W139 HydrophobicContact CZ-CE3 3.89Å; F40-L164 HydrophobicContact CE2-CD1 4.41Å
41	T	66.3	Low	48	Very low	44 Å²	44	94.3 Å²	94.3	27%	0.27	46%	0.46	S	S	.	.	H	α-helix	trans	-63.8	-28.4	-176.6	55.1	0	0	0	0	113.8	V37 K38 F43 I44 Q45	V37-T41 HydrophobicContact CB-CG2 4.07Å; V37-T41 HydrophobicContact CG1-CG2 3.77Å; V37-T41 PolarHBondContact O-N 3.45Å; K38-T41 WeakPolarHBondContact CA-OG1 3.43Å; K38-T41 PolarHBondContact O-N 2.93Å; K38-T41 PolarHBondContact O-OG1 3Å; T41-F43 PolarHBondContact O-N 2.89Å; T41-I44 PolarHBondContact O-N 3.1Å; T41-Q45 PolarHBondContact O-N 2.92Å
42	D	67.7	Low	48.3	Very low	32 Å²	32	93.7 Å²	93.7	17%	0.171	47%	0.467	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-20.8	177.3	-68.1	-9.3	0	0	0	112.6	K38 F40 N46 R98	K38-D42 VanDerWaalsContact O-CG 3.31Å; K38-D42 PolarHBondContact O-N 3.17Å; F40-D42 VanDerWaalsContact C-N 3.26Å; F40-D42 PolarHBondContact O-N 3Å; D42-N46 PolarHBondContact O-ND2 3.15Å; D42-R98 IonicContact OD2-NH2 3.72Å
43	F	66	Low	48.8	Very low	28 Å²	28	90.7 Å²	90.7	12%	0.123	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-20.3	172.9	-68.2	-83	0	0	0	112.8	G39 F40 T41 R98 H102 Y103 A106 L136 F140	G39-F43 WeakPolarHBondContact O-CE2 3.28Å; F40-F43 WeakPolarHBondContact O-CB 2.96Å; F40-F43 PolarHBondContact O-N 3.28Å; F40-F43 VanDerWaalsContact O-N 3.12Å; T41-F43 PolarHBondContact O-N 2.89Å; F43-R98 VanDerWaalsContact CZ-CD 3.42Å; F43-R98 HydrophobicContact CZ-CG 4.21Å; F43-R98 VanDerWaalsContact CZ-NE 3.27Å; F43-H102 HydrophobicContact CE1-CB 4.29Å; F43-H102 HydrophobicContact CZ-CB 4.08Å; F43-Y103 HydrophobicContact CD1-CD1 4.15Å; F43-Y103 HydrophobicContact CD1-CE1 4.22Å; F43-Y103 AromaticContact CE1-CD1 3.93Å; F43-Y103 HydrophobicContact CE1-CD1 3.93Å; F43-Y103 AromaticContact CE1-CE1 3.97Å; F43-Y103 HydrophobicContact CE1-CE1 3.97Å; F43-Y103 HydrophobicContact CE1-CG 4.41Å; F43-A106 HydrophobicContact CB-CB 4.15Å; F43-A106 HydrophobicContact CD1-CB 3.5Å; F43-A106 VanDerWaalsContact CD1-CB 3.5Å; F43-A106 HydrophobicContact CE1-CB 3.98Å; F43-A106 HydrophobicContact CG-CB 3.89Å; F43-L136 HydrophobicContact CD2-CD2 3.92Å; F43-L136 HydrophobicContact CE2-CD1 4.21Å; F43-L136 HydrophobicContact CE2-CD2 3.63Å; F43-L136 HydrophobicContact CZ-CD1 3.92Å; F43-L136 HydrophobicContact CZ-CD2 4.18Å; F43-F140 HydrophobicContact CB-CE2 4.31Å; F43-F140 HydrophobicContact CB-CZ 3.84Å
44	I	57.1	Low	49	Very low	92 Å²	92	95.3 Å²	95.3	47%	0.472	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-43.8	-175.8	-58.9	175.1	0	0	0	111.6	T41 N46 K47 F140	T41-I44 PolarHBondContact O-N 3.1Å; I44-N46 PolarHBondContact O-N 2.93Å; I44-K47 PolarHBondContact O-N 3.09Å; I44-F140 HydrophobicContact CD1-CE1 4.39Å; I44-F140 HydrophobicContact CG1-CE1 4.04Å; I44-F140 HydrophobicContact CG1-CZ 4.32Å
45	Q	47.3	Very low	49.4	Very low	138 Å²	138	90.4 Å²	90.4	65%	0.645	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-62.2	-18.5	-176.8	-72.3	-177.8	-7.5	0	0	114	T41 K47	T41-Q45 PolarHBondContact O-N 2.92Å; Q45-K47 VanDerWaalsContact C-N 3.3Å; Q45-K47 PolarHBondContact O-N 3.12Å
46	N	44.5	Very low	49.5	Very low	68 Å²	68	84.3 Å²	84.3	36%	0.364	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-85.6	9.8	-177.6	-73.8	-37.6	0	0	0	114.8	D42 I44	D42-N46 PolarHBondContact O-ND2 3.15Å; I44-N46 PolarHBondContact O-N 2.93Å
47	K	38.6	Very low	49.5	Very low	196 Å²	196	88.8 Å²	88.8	85%	0.852	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-95.3	-16.5	176.7	-119.2	-177.2	-179.3	-179.9	0	114.3	I44 Q45	I44-K47 PolarHBondContact O-N 3.09Å; Q45-K47 VanDerWaalsContact C-N 3.3Å; Q45-K47 PolarHBondContact O-N 3.12Å
48	E	29.5	Very low	49.2	Very low	184 Å²	184	90.8 Å²	90.8	86%	0.86	46%	0.457	S	S	*	.	S	Bend	trans	-113.8	-3.9	-166.7	-67.3	-171.4	164.4	0	0	115.9
49	T	31.3	Very low	48.5	Very low	84 Å²	84	94.5 Å²	94.5	52%	0.515	47%	0.473	S	S	.	.			trans	-118.6	118.1	-179	51.6	0	0	0	0	112.3	E51	T49-E51 PolarHBondContact O-N 3.21Å; T49-E51 VanDerWaalsContact O-N 3.11Å
50	E	32.2	Very low	48.4	Very low	212 Å²	212	103.6 Å²	103.6	99%	0.991	52%	0.515	S	S	*	.			trans	-71.1	18.6	161.6	-69.6	-169.9	159.8	0	0	112.5
51	E	31.6	Very low	47.8	Very low	159 Å²	159	108.7 Å²	108.7	74%	0.743	54%	0.54	S	S	*	.	S	Bend	trans	-88.2	133.3	174.2	-70.8	-175	173.5	0	0	109.2	T49 D53	T49-E51 PolarHBondContact O-N 3.21Å; T49-E51 VanDerWaalsContact O-N 3.11Å; E51-D53 PolarHBondContact O-N 2.63Å; E51-D53 VanDerWaalsContact O-N 3.14Å
52	T	36.9	Very low	48.4	Very low	121 Å²	121	107.7 Å²	107.7	74%	0.742	53%	0.533	S	S	*	.			trans	-46.6	118.3	-179	44.8	0	0	0	0	111.6	N54	T52-N54 PolarHBondContact O-N 3.38Å; T52-N54 PolarHBondContact O-OD1 2.86Å
53	D	45.8	Very low	49.4	Very low	52 Å²	52	111.7 Å²	111.7	28%	0.278	55%	0.554	S	S	.	*			trans	-56.5	99.1	178.6	-172.3	-11.1	0	0	0	111.3	E51 S55 Y56 K74	E51-D53 PolarHBondContact O-N 2.63Å; E51-D53 VanDerWaalsContact O-N 3.14Å; D53-S55 VanDerWaalsContact CG-OG 3.27Å; D53-S55 PolarHBondContact O-N 3.48Å; D53-S55 WeakPolarHBondContact OD1-CA 3.35Å; D53-S55 WeakPolarHBondContact OD1-CB 3.48Å; D53-S55 PolarHBondContact OD1-N 2.99Å; D53-S55 PolarHBondContact OD1-OG 3.02Å; D53-S55 PolarHBondContact OD2-OG 3.46Å; D53-Y56 HydrophobicContact CB-CD2 3.96Å; D53-Y56 HydrophobicContact CB-CE2 4.14Å; D53-Y56 WeakPolarHBondContact OD2-CE2 3.4Å; D53-K74 IonicContact OD2-NZ 2.83Å
54	N	43.6	Very low	50.4	Low	135 Å²	135	114.4 Å²	114.4	72%	0.722	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-80.3	5.8	175	-69.8	-20.4	0	0	0	112.7	T52 Y56 D57	T52-N54 PolarHBondContact O-N 3.38Å; T52-N54 PolarHBondContact O-OD1 2.86Å; N54-Y56 PolarHBondContact O-N 3.12Å; N54-Y56 VanDerWaalsContact O-N 3.17Å; N54-D57 PolarHBondContact O-N 3.49Å
55	S	49.2	Very low	52	Low	28 Å²	28	114 Å²	114	20%	0.196	58%	0.579	C	S	.	*	G	3₁₀ helix	trans	-66.7	-8.4	167.2	77.8	0	0	0	0	112.5	D53	D53-S55 VanDerWaalsContact CG-OG 3.27Å; D53-S55 PolarHBondContact O-N 3.48Å; D53-S55 WeakPolarHBondContact OD1-CA 3.35Å; D53-S55 WeakPolarHBondContact OD1-CB 3.48Å; D53-S55 PolarHBondContact OD1-N 2.99Å; D53-S55 PolarHBondContact OD1-OG 3.02Å; D53-S55 PolarHBondContact OD2-OG 3.46Å
56	Y	48.4	Very low	54.1	Low	24 Å²	24	108.6 Å²	108.6	9%	0.094	55%	0.554	C	S	.	*	G	3₁₀ helix	trans	-106.5	44.4	174.8	-59.8	-68.7	0	0	0	113	D53 N54 N58 K67 D71	D53-Y56 HydrophobicContact CB-CD2 3.96Å; D53-Y56 HydrophobicContact CB-CE2 4.14Å; D53-Y56 WeakPolarHBondContact OD2-CE2 3.4Å; N54-Y56 PolarHBondContact O-N 3.12Å; N54-Y56 VanDerWaalsContact O-N 3.17Å; Y56-N58 PolarHBondContact O-N 3.02Å; Y56-K67 VanDerWaalsContact CB-NZ 3.33Å; Y56-K67 HydrophobicContact CD1-CD 3.88Å; Y56-K67 VanDerWaalsContact CD1-CE 3.46Å; Y56-K67 HydrophobicContact CD1-CG 4.1Å; Y56-K67 HydrophobicContact CE1-CD 4.14Å; Y56-K67 HydrophobicContact CE1-CG 3.87Å; Y56-K67 HydrophobicContact CG-CD 4.22Å; Y56-K67 VanDerWaalsContact CG-NZ 3.28Å; Y56-D71 PolarHBondContact OH-OD1 3.39Å
57	D	46.1	Very low	56.3	Low	130 Å²	130	108.1 Å²	108.1	70%	0.695	55%	0.549	S	S	*	.			trans	-70.8	74.1	165.4	-145.9	-7	0	0	0	109.1	N54 K59	N54-D57 PolarHBondContact O-N 3.49Å; D57-K59 PolarHBondContact O-N 3.32Å
58	N	54.4	Low	58.8	Low	63 Å²	63	103.3 Å²	103.3	34%	0.337	53%	0.529	S	S	.	.			trans	-85.7	76.9	-168.3	-80.9	-14.4	0	0	0	110	Y56	Y56-N58 PolarHBondContact O-N 3.02Å
59	K	48.4	Very low	61.9	Low	191 Å²	191	94.6 Å²	94.6	83%	0.83	49%	0.489	S	S	*	.	S	Bend	trans	-91.7	-20.5	161.3	-81.6	-175.9	176.4	175.9	0	114.9	D57	D57-K59 PolarHBondContact O-N 3.32Å
60	E	57.1	Low	64.8	Low	193 Å²	193	90.8 Å²	90.8	90%	0.902	47%	0.465	S	S	*	.	S	Bend	trans	-157.3	3.4	-170.9	-110.3	156.8	-151.4	0	0	120.6
61	M	62.3	Low	67.7	Low	109 Å²	109	83 Å²	83	54%	0.537	43%	0.43	S	S	.	.	S	Bend	trans	-111.9	-30.9	-172.5	-72.1	-165.7	74.6	0	0	118.6	L95	M61-L95 HydrophobicContact CG-CD2 4.49Å; M61-L95 HydrophobicContact SD-CD2 3.78Å; M61-L95 HydrophobicContact SD-CG 4.45Å
62	L	78.3	Confident	70.7	Confident	23 Å²	23	75.6 Å²	75.6	12%	0.12	40%	0.396	C	S	.	.			trans	-123.3	137.2	-177.1	-78	171.4	0	0	0	111.6	E66 I70 A92 K93 N94	L62-E66 HydrophobicContact CD2-CB 3.83Å; L62-I70 HydrophobicContact CD1-CD1 3.92Å; L62-I70 HydrophobicContact CD2-CD1 4.27Å; L62-A92 HydrophobicContact CD2-CB 3.67Å; L62-K93 VanDerWaalsContact CD2-O 3.3Å; L62-K93 WeakPolarHBondContact CD2-O 3.26Å; L62-K93 WeakPolarHBondContact CG-O 3.37Å; L62-N94 HydrophobicContact CD1-CB 3.7Å
63	L	88.1	Confident	73.5	Confident	116 Å²	116	69.9 Å²	69.9	61%	0.607	36%	0.361	S	S	*	.			trans	-68.2	152	168.5	-60.4	175.4	0	0	0	110.1	L65 E66 K67	L63-L65 PolarHBondContact O-N 2.96Å; L63-E66 HydrophobicContact CB-CB 4.38Å; L63-E66 HydrophobicContact CB-CG 4.06Å; L63-E66 WeakPolarHBondContact CB-OE2 3.45Å; L63-E66 PolarHBondContact N-OE2 3.42Å; L63-E66 WeakPolarHBondContact O-CB 3.38Å; L63-E66 PolarHBondContact O-N 2.9Å; L63-K67 PolarHBondContact O-N 3.25Å
64	A	87.8	Confident	75.7	Confident	85 Å²	85	70.3 Å²	70.3	70%	0.702	36%	0.361	S	S	*	.	H	α-helix	trans	-55.1	-40	179.5	0	0	0	0	0	112.6	K67 E68	A64-K67 PolarHBondContact O-N 2.99Å; A64-E68 PolarHBondContact O-N 3.43Å
65	L	90.1	Very high	78.1	Confident	82 Å²	82	69.9 Å²	69.9	43%	0.429	36%	0.357	S	S	.	.	H	α-helix	trans	-69	-32.7	177	-63	172.3	0	0	0	113	L63 Y69 L84 V88	L63-L65 PolarHBondContact O-N 2.96Å; L65-Y69 VanDerWaalsContact O-CB 3.31Å; L65-Y69 WeakPolarHBondContact O-CB 3.36Å; L65-Y69 PolarHBondContact O-N 3.19Å; L65-L84 HydrophobicContact CD2-CD2 4.01Å; L65-V88 HydrophobicContact CB-CG2 3.73Å
66	E	91.8	Very high	80.3	Confident	25 Å²	25	70.9 Å²	70.9	12%	0.117	36%	0.36	C	S	.	.	H	α-helix	trans	-70.6	-39.8	175.8	-69.2	167.2	161	0	0	110.8	L62 L63 Y69 I70 V88 A92	L62-E66 HydrophobicContact CD2-CB 3.83Å; L63-E66 HydrophobicContact CB-CB 4.38Å; L63-E66 HydrophobicContact CB-CG 4.06Å; L63-E66 WeakPolarHBondContact CB-OE2 3.45Å; L63-E66 PolarHBondContact N-OE2 3.42Å; L63-E66 WeakPolarHBondContact O-CB 3.38Å; L63-E66 PolarHBondContact O-N 2.9Å; E66-Y69 PolarHBondContact O-N 3.01Å; E66-I70 WeakPolarHBondContact O-CG1 3.34Å; E66-I70 PolarHBondContact O-N 3.48Å; E66-V88 HydrophobicContact CB-CG1 4.27Å; E66-V88 HydrophobicContact CG-CG1 3.73Å; E66-A92 HydrophobicContact CB-CB 3.83Å; E66-A92 HydrophobicContact CG-CB 3.66Å
67	K	89.9	Confident	82.6	Confident	59 Å²	59	72.3 Å²	72.3	26%	0.257	37%	0.369	S	S	.	.	H	α-helix	trans	-59.9	-51.2	172.3	-179.3	178.8	-179.7	173.2	0	111.2	Y56 L63 A64 Y69 I70 D71	Y56-K67 VanDerWaalsContact CB-NZ 3.33Å; Y56-K67 HydrophobicContact CD1-CD 3.88Å; Y56-K67 VanDerWaalsContact CD1-CE 3.46Å; Y56-K67 HydrophobicContact CD1-CG 4.1Å; Y56-K67 HydrophobicContact CE1-CD 4.14Å; Y56-K67 HydrophobicContact CE1-CG 3.87Å; Y56-K67 HydrophobicContact CG-CD 4.22Å; Y56-K67 VanDerWaalsContact CG-NZ 3.28Å; L63-K67 PolarHBondContact O-N 3.25Å; A64-K67 PolarHBondContact O-N 2.99Å; K67-Y69 PolarHBondContact O-N 3.13Å; K67-I70 PolarHBondContact O-N 3.44Å; K67-I70 VanDerWaalsContact O-N 3.13Å; K67-D71 PolarHBondContact O-N 3.47Å
68	E	92.2	Very high	84.9	Confident	94 Å²	94	67.1 Å²	67.1	44%	0.439	34%	0.342	S	S	.	.	H	α-helix	trans	-60	-36.6	179.2	-167.5	-178.8	173.2	0	0	111.7	A64 D71 A72 T80 L84	A64-E68 PolarHBondContact O-N 3.43Å; E68-D71 PolarHBondContact O-N 2.89Å; E68-A72 VanDerWaalsContact O-CB 3.3Å; E68-A72 WeakPolarHBondContact O-CB 3.44Å; E68-A72 PolarHBondContact O-N 2.84Å; E68-T80 HydrophobicContact CG-CG2 4.47Å; E68-L84 HydrophobicContact CB-CD1 3.9Å; E68-L84 HydrophobicContact CG-CD1 3.67Å
69	Y	94.3	Very high	86.9	Confident	2 Å²	2	70.5 Å²	70.5	1%	0.008	36%	0.356	C	S	.	.	H	α-helix	trans	-65.8	-42.6	174.9	-171.7	-100.3	0	0	0	113.1	L65 E66 K67 A72 A73 M81 L84 V88 V90 A100 L116	L65-Y69 VanDerWaalsContact O-CB 3.31Å; L65-Y69 WeakPolarHBondContact O-CB 3.36Å; L65-Y69 PolarHBondContact O-N 3.19Å; E66-Y69 PolarHBondContact O-N 3.01Å; K67-Y69 PolarHBondContact O-N 3.13Å; Y69-A72 PolarHBondContact O-N 2.99Å; Y69-A73 PolarHBondContact O-N 3.02Å; Y69-M81 HydrophobicContact CD2-CB 4.31Å; Y69-M81 HydrophobicContact CD2-CG 4.35Å; Y69-M81 HydrophobicContact CE1-CE 4.18Å; Y69-M81 HydrophobicContact CE2-CB 3.76Å; Y69-M81 HydrophobicContact CE2-CE 4.24Å; Y69-M81 HydrophobicContact CE2-CG 4.07Å; Y69-M81 WeakPolarHBondContact CE2-O 3.42Å; Y69-L84 HydrophobicContact CD2-CB 4.1Å; Y69-V88 HydrophobicContact CD1-CG1 4.22Å; Y69-V88 HydrophobicContact CG-CG1 3.98Å; Y69-V90 HydrophobicContact CE1-CB 4.33Å; Y69-V90 HydrophobicContact CE1-CG1 4.12Å; Y69-A100 HydrophobicContact CD1-CB 3.8Å; Y69-A100 HydrophobicContact CE1-CB 3.77Å; Y69-L116 HydrophobicContact CE1-CD2 3.69Å; Y69-L116 WeakPolarHBondContact OH-CD2 3.37Å
70	I	93	Very high	89.1	Confident	3 Å²	3	62.9 Å²	62.9	2%	0.015	33%	0.325	C	S	.	.	H	α-helix	trans	-64.6	-43.9	175.1	-69.2	170.5	0	0	0	110.6	L62 E66 K67 A73 K74 A100 Y103	L62-I70 HydrophobicContact CD1-CD1 3.92Å; L62-I70 HydrophobicContact CD2-CD1 4.27Å; E66-I70 WeakPolarHBondContact O-CG1 3.34Å; E66-I70 PolarHBondContact O-N 3.48Å; K67-I70 PolarHBondContact O-N 3.44Å; K67-I70 VanDerWaalsContact O-N 3.13Å; I70-A73 WeakPolarHBondContact O-CB 3.34Å; I70-A73 PolarHBondContact O-N 3.17Å; I70-K74 PolarHBondContact O-N 3.39Å; I70-A100 HydrophobicContact CG1-CB 4.02Å; I70-Y103 HydrophobicContact CG2-CD2 3.45Å; I70-Y103 VanDerWaalsContact CG2-CD2 3.45Å; I70-Y103 HydrophobicContact CG2-CE2 3.74Å; I70-Y103 HydrophobicContact CG2-CG 4.19Å
71	D	91.9	Very high	90.9	Very high	49 Å²	49	53.7 Å²	53.7	26%	0.262	28%	0.282	S	S	.	.	H	α-helix	trans	-62.6	-43.2	177.4	-74.3	-31.4	0	0	0	111.1	Y56 K67 E68 A73 K74 I75	Y56-D71 PolarHBondContact OH-OD1 3.39Å; K67-D71 PolarHBondContact O-N 3.47Å; E68-D71 PolarHBondContact O-N 2.89Å; D71-A73 VanDerWaalsContact C-N 3.33Å; D71-A73 PolarHBondContact O-N 3.3Å; D71-K74 WeakPolarHBondContact O-CB 3.35Å; D71-K74 PolarHBondContact O-N 3.07Å; D71-I75 WeakPolarHBondContact O-CG1 3.28Å; D71-I75 PolarHBondContact O-N 2.88Å; D71-I75 VanDerWaalsContact O-N 3.16Å
72	A	94.9	Very high	92.4	Very high	4 Å²	4	53.2 Å²	53.2	3%	0.033	28%	0.278	C	S	.	.	H	α-helix	trans	-59.9	-42	174.1	0	0	0	0	0	112	E68 Y69 K74 I75 N76 D77 T80 M81	E68-A72 VanDerWaalsContact O-CB 3.3Å; E68-A72 WeakPolarHBondContact O-CB 3.44Å; E68-A72 PolarHBondContact O-N 2.84Å; Y69-A72 PolarHBondContact O-N 2.99Å; A72-K74 VanDerWaalsContact C-N 3.35Å; A72-K74 PolarHBondContact O-N 3.27Å; A72-I75 PolarHBondContact O-N 2.6Å; A72-N76 PolarHBondContact O-N 3.17Å; A72-N76 VanDerWaalsContact O-N 3.13Å; A72-D77 HydrophobicContact CB-CB 4.14Å; A72-D77 PolarHBondContact O-N 3.41Å; A72-T80 HydrophobicContact CB-CG2 3.94Å; A72-M81 HydrophobicContact CB-CG 3.74Å
73	A	95.1	Very high	93	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64.2	-37.9	175.6	0	0	0	0	0	112.8	Y69 I70 D71 I75 N76 M81 A100 A104 N109	Y69-A73 PolarHBondContact O-N 3.02Å; I70-A73 WeakPolarHBondContact O-CB 3.34Å; I70-A73 PolarHBondContact O-N 3.17Å; D71-A73 VanDerWaalsContact C-N 3.33Å; D71-A73 PolarHBondContact O-N 3.3Å; A73-I75 VanDerWaalsContact C-N 3.35Å; A73-I75 PolarHBondContact O-N 2.95Å; A73-N76 PolarHBondContact O-N 3.46Å; A73-M81 VanDerWaalsContact CA-SD 3.53Å; A73-M81 HydrophobicContact CB-CE 3.64Å; A73-M81 HydrophobicContact CB-SD 3.82Å; A73-A100 HydrophobicContact CB-CB 3.82Å; A73-A104 HydrophobicContact CB-CB 4.31Å; A73-N109 PolarHBondContact O-ND2 3.04Å
74	K	92.4	Very high	93	Very high	62 Å²	62	54.4 Å²	54.4	27%	0.27	28%	0.284	S	S	.	.	H	α-helix	trans	-63.7	-36.4	177.6	-174.3	-179.6	176.6	-176.5	0	112.6	D53 I70 D71 A72 Y103 N109	D53-K74 IonicContact OD2-NZ 2.83Å; I70-K74 PolarHBondContact O-N 3.39Å; D71-K74 WeakPolarHBondContact O-CB 3.35Å; D71-K74 PolarHBondContact O-N 3.07Å; A72-K74 VanDerWaalsContact C-N 3.35Å; A72-K74 PolarHBondContact O-N 3.27Å; K74-Y103 HydrophobicContact CD-CD1 4.13Å; K74-Y103 HydrophobicContact CG-CD1 4.23Å; K74-N109 VanDerWaalsContact C-ND2 3.34Å; K74-N109 PolarHBondContact O-ND2 3.22Å
75	I	93.4	Very high	92.4	Very high	126 Å²	126	50.6 Å²	50.6	65%	0.646	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	8.6	-178.7	70	176.9	0	0	0	114.4	D71 A72 A73 D77	D71-I75 WeakPolarHBondContact O-CG1 3.28Å; D71-I75 PolarHBondContact O-N 2.88Å; D71-I75 VanDerWaalsContact O-N 3.16Å; A72-I75 PolarHBondContact O-N 2.6Å; A73-I75 VanDerWaalsContact C-N 3.35Å; A73-I75 PolarHBondContact O-N 2.95Å; I75-D77 VanDerWaalsContact C-N 3.3Å; I75-D77 HydrophobicContact CD1-CB 4.16Å; I75-D77 HydrophobicContact CG1-CB 3.95Å; I75-D77 PolarHBondContact O-N 2.65Å
76	N	95.7	Very high	92	Very high	49 Å²	49	55.3 Å²	55.3	26%	0.262	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	28.2	-175.3	-151.9	22	0	0	0	115	A72 A73 V78 N109 E111 A112	A72-N76 PolarHBondContact O-N 3.17Å; A72-N76 VanDerWaalsContact O-N 3.13Å; A73-N76 PolarHBondContact O-N 3.46Å; N76-V78 VanDerWaalsContact C-N 3.27Å; N76-V78 PolarHBondContact O-N 3.45Å; N76-N109 HydrophobicContact CB-CB 3.84Å; N76-N109 PolarHBondContact N-ND2 2.94Å; N76-N109 WeakPolarHBondContact OD1-CB 3.3Å; N76-E111 PolarHBondContact ND2-OE2 3.14Å; N76-A112 WeakPolarHBondContact OD1-CB 3.49Å; N76-A112 PolarHBondContact OD1-N 3.29Å; N76-A112 VanDerWaalsContact OD1-N 3.11Å
77	D	96.8	Very high	91.6	Very high	54 Å²	54	58.2 Å²	58.2	29%	0.289	30%	0.298	S	S	.	.			trans	-79.4	77.7	174	-175	-1.5	0	0	0	111.3	A72 I75 Q79 T80 M81	A72-D77 HydrophobicContact CB-CB 4.14Å; A72-D77 PolarHBondContact O-N 3.41Å; I75-D77 VanDerWaalsContact C-N 3.3Å; I75-D77 HydrophobicContact CD1-CB 4.16Å; I75-D77 HydrophobicContact CG1-CB 3.95Å; I75-D77 PolarHBondContact O-N 2.65Å; D77-Q79 PolarHBondContact O-N 2.86Å; D77-Q79 PolarHBondContact OD1-N 2.93Å; D77-T80 VanDerWaalsContact CG-CB 3.48Å; D77-T80 VanDerWaalsContact CG-OG1 3.24Å; D77-T80 PolarHBondContact O-N 2.96Å; D77-T80 PolarHBondContact OD1-N 3.03Å; D77-T80 VanDerWaalsContact OD1-N 3.07Å; D77-T80 PolarHBondContact OD1-OG1 3.1Å; D77-T80 WeakPolarHBondContact OD2-CB 3.49Å; D77-T80 PolarHBondContact OD2-OG1 3.36Å; D77-M81 WeakPolarHBondContact O-CG 3.26Å; D77-M81 PolarHBondContact O-N 2.95Å
78	V	95.9	Very high	91.7	Very high	20 Å²	20	56.1 Å²	56.1	12%	0.121	29%	0.29	C	S	.	.	H	α-helix	trans	-60.3	-29.4	179.3	167.8	0	0	0	0	113	N76 K82 E111 V115	N76-V78 VanDerWaalsContact C-N 3.27Å; N76-V78 PolarHBondContact O-N 3.45Å; V78-K82 HydrophobicContact CG1-CD 3.95Å; V78-K82 VanDerWaalsContact CG1-CE 3.49Å; V78-K82 HydrophobicContact CG1-CG 4.43Å; V78-K82 WeakPolarHBondContact O-CB 3.48Å; V78-K82 VanDerWaalsContact O-CG 3.26Å; V78-K82 WeakPolarHBondContact O-CG 3.3Å; V78-K82 PolarHBondContact O-N 3.37Å; V78-E111 HydrophobicContact CG2-CB 3.54Å; V78-V115 HydrophobicContact CG1-CG2 3.81Å
79	Q	95.1	Very high	91.6	Very high	134 Å²	134	55.7 Å²	55.7	63%	0.626	29%	0.291	S	S	*	.	H	α-helix	trans	-70.9	-48.8	-179.2	-62.1	-58.8	-24.4	0	0	110.4	D77 M81 K82 L83	D77-Q79 PolarHBondContact O-N 2.86Å; D77-Q79 PolarHBondContact OD1-N 2.93Å; Q79-M81 VanDerWaalsContact C-N 3.32Å; Q79-M81 PolarHBondContact O-N 3.28Å; Q79-K82 PolarHBondContact O-N 3.36Å; Q79-K82 VanDerWaalsContact O-N 3.17Å; Q79-L83 WeakPolarHBondContact O-CB 3.34Å; Q79-L83 PolarHBondContact O-N 2.85Å
80	T	93.9	Very high	91.5	Very high	31 Å²	31	56.6 Å²	56.6	19%	0.19	30%	0.296	C	S	.	.	H	α-helix	trans	-62.4	-41.4	175.7	-62.1	0	0	0	0	110.6	E68 A72 D77 K82 L83 L84	E68-T80 HydrophobicContact CG-CG2 4.47Å; A72-T80 HydrophobicContact CB-CG2 3.94Å; D77-T80 VanDerWaalsContact CG-CB 3.48Å; D77-T80 VanDerWaalsContact CG-OG1 3.24Å; D77-T80 PolarHBondContact O-N 2.96Å; D77-T80 PolarHBondContact OD1-N 3.03Å; D77-T80 VanDerWaalsContact OD1-N 3.07Å; D77-T80 PolarHBondContact OD1-OG1 3.1Å; D77-T80 WeakPolarHBondContact OD2-CB 3.49Å; D77-T80 PolarHBondContact OD2-OG1 3.36Å; T80-K82 PolarHBondContact O-N 3.24Å; T80-L83 PolarHBondContact O-N 3.48Å; T80-L84 HydrophobicContact CG2-CD1 3.57Å; T80-L84 HydrophobicContact CG2-CG 4.05Å; T80-L84 WeakPolarHBondContact O-CB 3.41Å; T80-L84 VanDerWaalsContact O-CG 3.31Å; T80-L84 WeakPolarHBondContact O-CG 3.28Å; T80-L84 PolarHBondContact O-N 3.18Å
81	M	95.4	Very high	91.6	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-58.7	-44.8	172.9	-68.7	179.5	79.2	0	0	112.5	Y69 A72 A73 D77 Q79 L83 G85 A112 V115 L116	Y69-M81 HydrophobicContact CD2-CB 4.31Å; Y69-M81 HydrophobicContact CD2-CG 4.35Å; Y69-M81 HydrophobicContact CE1-CE 4.18Å; Y69-M81 HydrophobicContact CE2-CB 3.76Å; Y69-M81 HydrophobicContact CE2-CE 4.24Å; Y69-M81 HydrophobicContact CE2-CG 4.07Å; Y69-M81 WeakPolarHBondContact CE2-O 3.42Å; A72-M81 HydrophobicContact CB-CG 3.74Å; A73-M81 VanDerWaalsContact CA-SD 3.53Å; A73-M81 HydrophobicContact CB-CE 3.64Å; A73-M81 HydrophobicContact CB-SD 3.82Å; D77-M81 WeakPolarHBondContact O-CG 3.26Å; D77-M81 PolarHBondContact O-N 2.95Å; Q79-M81 VanDerWaalsContact C-N 3.32Å; Q79-M81 PolarHBondContact O-N 3.28Å; M81-L83 VanDerWaalsContact C-N 3.32Å; M81-L83 PolarHBondContact O-N 2.99Å; M81-G85 WeakPolarHBondContact O-CA 3.45Å; M81-G85 PolarHBondContact O-N 3.18Å; M81-A112 HydrophobicContact CE-CB 4.26Å; M81-A112 HydrophobicContact SD-CB 3.66Å; M81-V115 HydrophobicContact CB-CG1 4.32Å; M81-V115 HydrophobicContact CE-CG1 4.38Å; M81-L116 HydrophobicContact CE-CD1 3.94Å; M81-L116 HydrophobicContact CE-CD2 3.8Å; M81-L116 HydrophobicContact CE-CG 3.61Å
82	K	93.3	Very high	91.6	Very high	100 Å²	100	56.4 Å²	56.4	44%	0.435	30%	0.296	S	S	.	.	H	α-helix	trans	-65.7	-36.9	179.7	-77.7	171.3	-179.6	173.1	0	112.2	V78 Q79 T80 V115	V78-K82 HydrophobicContact CG1-CD 3.95Å; V78-K82 VanDerWaalsContact CG1-CE 3.49Å; V78-K82 HydrophobicContact CG1-CG 4.43Å; V78-K82 WeakPolarHBondContact O-CB 3.48Å; V78-K82 VanDerWaalsContact O-CG 3.26Å; V78-K82 WeakPolarHBondContact O-CG 3.3Å; V78-K82 PolarHBondContact O-N 3.37Å; Q79-K82 PolarHBondContact O-N 3.36Å; Q79-K82 VanDerWaalsContact O-N 3.17Å; T80-K82 PolarHBondContact O-N 3.24Å; K82-V115 HydrophobicContact CG-CG1 4.48Å; K82-V115 HydrophobicContact CG-CG2 4.34Å
83	L	91.6	Very high	91.5	Very high	142 Å²	142	59.6 Å²	59.6	74%	0.743	31%	0.31	S	S	*	.	H	α-helix	trans	-67.6	-53	178.1	-176.1	66.5	0	0	0	111.4	Q79 T80 M81	Q79-L83 WeakPolarHBondContact O-CB 3.34Å; Q79-L83 PolarHBondContact O-N 2.85Å; T80-L83 PolarHBondContact O-N 3.48Å; M81-L83 VanDerWaalsContact C-N 3.32Å; M81-L83 PolarHBondContact O-N 2.99Å
84	L	88.1	Confident	91.1	Very high	22 Å²	22	59.8 Å²	59.8	12%	0.115	31%	0.311	C	S	.	.	H	α-helix	trans	-73.6	-34.6	-176.5	-62.7	-179.5	0	0	0	112.6	L65 E68 Y69 T80 K86 A87 V88	L65-L84 HydrophobicContact CD2-CD2 4.01Å; E68-L84 HydrophobicContact CB-CD1 3.9Å; E68-L84 HydrophobicContact CG-CD1 3.67Å; Y69-L84 HydrophobicContact CD2-CB 4.1Å; T80-L84 HydrophobicContact CG2-CD1 3.57Å; T80-L84 HydrophobicContact CG2-CG 4.05Å; T80-L84 WeakPolarHBondContact O-CB 3.41Å; T80-L84 VanDerWaalsContact O-CG 3.31Å; T80-L84 WeakPolarHBondContact O-CG 3.28Å; T80-L84 PolarHBondContact O-N 3.18Å; L84-K86 PolarHBondContact O-N 3.16Å; L84-A87 PolarHBondContact O-N 2.94Å; L84-V88 HydrophobicContact CB-CG2 4.25Å; L84-V88 WeakPolarHBondContact O-CG2 3.16Å; L84-V88 PolarHBondContact O-N 3.45Å
85	G	76	Confident	90.9	Very high	5 Å²	5	59.8 Å²	59.8	5%	0.052	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-0.6	-168.1	0	0	0	0	0	116.6	M81 R119	M81-G85 WeakPolarHBondContact O-CA 3.45Å; M81-G85 PolarHBondContact O-N 3.18Å; G85-R119 PolarHBondContact O-NH1 3.24Å
86	K	81.8	Confident	90.5	Very high	181 Å²	181	56.5 Å²	56.5	79%	0.787	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-24.7	168.3	-70.2	-174.5	-179.2	177.9	0	113.2	L84	L84-K86 PolarHBondContact O-N 3.16Å
87	A	83.6	Confident	90.3	Very high	85 Å²	85	56.5 Å²	56.5	70%	0.702	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	0.7	-173.5	0	0	0	0	0	113.1	L84	L84-A87 PolarHBondContact O-N 2.94Å
88	V	90.3	Very high	90.1	Very high	16 Å²	16	54.1 Å²	54.1	10%	0.097	28%	0.282	C	S	.	.	S	Bend	trans	-116.2	140	-171.6	175.5	0	0	0	0	110	L65 E66 Y69 L84 V90	L65-V88 HydrophobicContact CB-CG2 3.73Å; E66-V88 HydrophobicContact CB-CG1 4.27Å; E66-V88 HydrophobicContact CG-CG1 3.73Å; Y69-V88 HydrophobicContact CD1-CG1 4.22Å; Y69-V88 HydrophobicContact CG-CG1 3.98Å; L84-V88 HydrophobicContact CB-CG2 4.25Å; L84-V88 WeakPolarHBondContact O-CG2 3.16Å; L84-V88 PolarHBondContact O-N 3.45Å; V88-V90 PolarHBondContact O-N 3.48Å
89	N	91.3	Very high	90.1	Very high	85 Å²	85	53.1 Å²	53.1	46%	0.455	28%	0.276	S	S	.	.			trans	-69.6	109.9	166	177.3	13.7	0	0	0	109.3	D91 A92	N89-D91 PolarHBondContact O-N 3.27Å; N89-D91 PolarHBondContact OD1-N 2.98Å; N89-D91 VanDerWaalsContact OD1-N 3.11Å; N89-A92 HydrophobicContact CB-CB 4.33Å; N89-A92 VanDerWaalsContact O-CB 3.24Å; N89-A92 WeakPolarHBondContact O-CB 3.34Å; N89-A92 PolarHBondContact O-N 2.81Å; N89-A92 VanDerWaalsContact O-N 3.08Å
90	V	92.3	Very high	90.1	Very high	20 Å²	20	46.8 Å²	46.8	12%	0.121	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-20.6	-178.4	-62.6	0	0	0	0	113.4	Y69 V88 R119 A121	Y69-V90 HydrophobicContact CE1-CB 4.33Å; Y69-V90 HydrophobicContact CE1-CG1 4.12Å; V88-V90 PolarHBondContact O-N 3.48Å; V90-R119 HydrophobicContact CG1-CB 4Å; V90-R119 HydrophobicContact CG1-CG 4.48Å; V90-A121 HydrophobicContact CG2-CB 4.19Å
91	D	94.3	Very high	90.3	Very high	41 Å²	41	45.4 Å²	45.4	22%	0.219	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	18.1	178	-63.5	-39.6	0	0	0	112.5	N89 K93 A121 N122	N89-D91 PolarHBondContact O-N 3.27Å; N89-D91 PolarHBondContact OD1-N 2.98Å; N89-D91 VanDerWaalsContact OD1-N 3.11Å; D91-K93 PolarHBondContact O-N 3.45Å; D91-A121 WeakPolarHBondContact OD1-CA 3.32Å; D91-N122 PolarHBondContact OD1-N 2.86Å; D91-N122 PolarHBondContact OD2-N 3.14Å
92	A	92.8	Very high	90.3	Very high	7 Å²	7	45.5 Å²	45.5	6%	0.058	24%	0.238	C	C	.	.			trans	-58.1	137.2	173.6	0	0	0	0	0	110.7	L62 E66 N89 T99	L62-A92 HydrophobicContact CD2-CB 3.67Å; E66-A92 HydrophobicContact CB-CB 3.83Å; E66-A92 HydrophobicContact CG-CB 3.66Å; N89-A92 HydrophobicContact CB-CB 4.33Å; N89-A92 VanDerWaalsContact O-CB 3.24Å; N89-A92 WeakPolarHBondContact O-CB 3.34Å; N89-A92 PolarHBondContact O-N 2.81Å; N89-A92 VanDerWaalsContact O-N 3.08Å; A92-T99 WeakPolarHBondContact O-CA 3.34Å
93	K	92	Very high	90.4	Very high	72 Å²	72	41.2 Å²	41.2	31%	0.313	22%	0.22	S	C	.	.			trans	-112.8	136.2	-171.9	-63.7	-178	-169.8	-173.8	0	110.9	L62 D91 D97 R98 T99	L62-K93 VanDerWaalsContact CD2-O 3.3Å; L62-K93 WeakPolarHBondContact CD2-O 3.26Å; L62-K93 WeakPolarHBondContact CG-O 3.37Å; D91-K93 PolarHBondContact O-N 3.45Å; K93-D97 HydrophobicContact CD-CB 4.4Å; K93-R98 WeakPolarHBondContact CA-O 3.38Å; K93-T99 HydrophobicContact CG-CG2 4.13Å
94	N	88.1	Confident	90.7	Very high	4 Å²	4	34.5 Å²	34.5	2%	0.021	18%	0.184	C	C	.	.			trans	-83	-173.5	169.1	72.5	5.2	0	0	0	112.1	L62 H96 D97 R98 Y103	L62-N94 HydrophobicContact CD1-CB 3.7Å; N94-H96 PolarHBondContact O-N 3.08Å; N94-H96 WeakPolarHBondContact OD1-CA 3.13Å; N94-H96 WeakPolarHBondContact OD1-CB 3.34Å; N94-H96 PolarHBondContact OD1-N 3.4Å; N94-D97 PolarHBondContact O-N 3.16Å; N94-D97 PolarHBondContact OD1-N 2.96Å; N94-R98 PolarHBondContact N-O 3.46Å; N94-R98 WeakPolarHBondContact OD1-CB 3.4Å; N94-R98 PolarHBondContact OD1-N 2.94Å; N94-R98 PolarHBondContact OD1-O 3.4Å; N94-Y103 PolarHBondContact ND2-OH 3.4Å
95	L	86.3	Confident	91.2	Very high	61 Å²	61	33.4 Å²	33.4	32%	0.319	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-11.8	177.1	-72.1	160.2	0	0	0	114.4	M61 K128	M61-L95 HydrophobicContact CG-CD2 4.49Å; M61-L95 HydrophobicContact SD-CD2 3.78Å; M61-L95 HydrophobicContact SD-CG 4.45Å; L95-K128 WeakPolarHBondContact O-CE 3.29Å; L95-K128 PolarHBondContact O-NZ 2.84Å
96	H	86.4	Confident	92	Very high	57 Å²	57	34 Å²	34	26%	0.264	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	11.1	176.9	-64.2	-80.5	0	0	0	112.9	N94 R98 D127 K128	N94-H96 PolarHBondContact O-N 3.08Å; N94-H96 WeakPolarHBondContact OD1-CA 3.13Å; N94-H96 WeakPolarHBondContact OD1-CB 3.34Å; N94-H96 PolarHBondContact OD1-N 3.4Å; H96-R98 HydrophobicContact CB-CG 4.05Å; H96-R98 PolarHBondContact O-N 2.94Å; H96-D127 WeakPolarHBondContact O-CB 3.43Å; H96-K128 PolarHBondContact O-N 3.03Å
97	D	91.4	Very high	92.5	Very high	49 Å²	49	27.2 Å²	27.2	26%	0.262	17%	0.165	S	C	.	.	S	Bend	trans	61.5	18.8	-171.9	-63.1	-44.5	0	0	0	114.1	K93 N94 K128	K93-D97 HydrophobicContact CD-CB 4.4Å; N94-D97 PolarHBondContact O-N 3.16Å; N94-D97 PolarHBondContact OD1-N 2.96Å; D97-K128 HydrophobicContact CB-CG 4.23Å; D97-K128 WeakPolarHBondContact OD2-CG 3.4Å
98	R	92.7	Very high	93.1	Very high	4 Å²	4	28 Å²	28	2%	0.015	15%	0.152	C	C	.	.			trans	-88.8	140.9	179.1	-63.5	173.2	175.3	164.7	3.6	110.7	G39 D42 F43 K93 N94 H96 H102 Y103 D127	G39-R98 PolarHBondContact O-NH2 3.45Å; D42-R98 IonicContact OD2-NH2 3.72Å; F43-R98 VanDerWaalsContact CZ-CD 3.42Å; F43-R98 HydrophobicContact CZ-CG 4.21Å; F43-R98 VanDerWaalsContact CZ-NE 3.27Å; K93-R98 WeakPolarHBondContact CA-O 3.38Å; N94-R98 PolarHBondContact N-O 3.46Å; N94-R98 WeakPolarHBondContact OD1-CB 3.4Å; N94-R98 PolarHBondContact OD1-N 2.94Å; N94-R98 PolarHBondContact OD1-O 3.4Å; H96-R98 HydrophobicContact CB-CG 4.05Å; H96-R98 PolarHBondContact O-N 2.94Å; R98-H102 HydrophobicContact CB-CB 4.17Å; R98-H102 HydrophobicContact CG-CB 4.48Å; R98-Y103 HydrophobicContact CB-CE2 3.86Å; R98-D127 HydrophobicContact CG-CB 3.66Å; R98-D127 IonicContact CZ-OD2 2.7Å; R98-D127 IonicContact NE-OD2 2.7Å; R98-D127 PolarHBondContact NE-OD2 3.48Å; R98-D127 VanDerWaalsContact NE-OD2 3.08Å; R98-D127 IonicContact NH2-OD2 3.18Å; R98-D127 PolarHBondContact NH2-OD2 3.15Å
99	T	95.1	Very high	93.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.153	C	C	.	.			trans	-108.8	171.7	179.3	65.6	0	0	0	0	111.2	A92 K93 L101 H102 Y103 Q125	A92-T99 WeakPolarHBondContact O-CA 3.34Å; K93-T99 HydrophobicContact CG-CG2 4.13Å; T99-L101 PolarHBondContact O-N 3.26Å; T99-L101 VanDerWaalsContact O-N 3.12Å; T99-L101 PolarHBondContact OG1-N 3.31Å; T99-H102 PolarHBondContact N-ND1 2.55Å; T99-H102 VanDerWaalsContact N-ND1 3.15Å; T99-H102 WeakPolarHBondContact O-CB 3.46Å; T99-H102 PolarHBondContact O-N 3.45Å; T99-H102 PolarHBondContact OG1-ND1 2.95Å; T99-Y103 WeakPolarHBondContact O-CD2 3.19Å; T99-Y103 PolarHBondContact O-N 2.92Å; T99-Q125 HydrophobicContact CG2-CG 3.89Å
100	A	95.6	Very high	93.7	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.008	14%	0.144	C	C	.	.	H	α-helix	trans	-52.4	-33.6	173.4	0	0	0	0	0	112.7	Y69 I70 A73 Y103 A104 L116	Y69-A100 HydrophobicContact CD1-CB 3.8Å; Y69-A100 HydrophobicContact CE1-CB 3.77Å; I70-A100 HydrophobicContact CG1-CB 4.02Å; A73-A100 HydrophobicContact CB-CB 3.82Å; A100-Y103 PolarHBondContact O-N 3.19Å; A100-A104 WeakPolarHBondContact O-CB 3.21Å; A100-A104 PolarHBondContact O-N 3.23Å; A100-L116 HydrophobicContact CB-CD1 4.36Å; A100-L116 HydrophobicContact CB-CD2 3.96Å
101	L	97.7	Very high	94	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.01	16%	0.159	C	C	.	.	H	α-helix	trans	-65	-40.4	177.1	-174	64.3	0	0	0	113.1	T99 Y103 A104 V105 V113 L116 L123 A133 L149	T99-L101 PolarHBondContact O-N 3.26Å; T99-L101 VanDerWaalsContact O-N 3.12Å; T99-L101 PolarHBondContact OG1-N 3.31Å; L101-Y103 VanDerWaalsContact C-N 3.3Å; L101-Y103 PolarHBondContact O-N 3.48Å; L101-A104 PolarHBondContact O-N 2.87Å; L101-V105 HydrophobicContact CD1-CG2 3.96Å; L101-V105 HydrophobicContact CG-CG2 4.22Å; L101-V105 WeakPolarHBondContact O-CB 3.37Å; L101-V105 WeakPolarHBondContact O-CG2 3.44Å; L101-V105 PolarHBondContact O-N 2.97Å; L101-V113 HydrophobicContact CD1-CG1 4.27Å; L101-V113 HydrophobicContact CD1-CG2 4.46Å; L101-L116 HydrophobicContact CB-CD1 4.07Å; L101-L116 HydrophobicContact CD1-CB 4.15Å; L101-L116 HydrophobicContact CD1-CD1 3.89Å; L101-L123 HydrophobicContact CD2-CD2 3.53Å; L101-A133 HydrophobicContact CD2-CB 3.66Å; L101-A133 HydrophobicContact CG-CB 3.83Å; L101-L149 HydrophobicContact CD1-CD2 4.23Å; L101-L149 HydrophobicContact CD2-CD2 4.33Å
102	H	96.4	Very high	94.1	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-58.9	-46.3	177.2	-68.4	80.2	0	0	0	110.7	F43 R98 T99 A106 Q125 V131 L136	F43-H102 HydrophobicContact CE1-CB 4.29Å; F43-H102 HydrophobicContact CZ-CB 4.08Å; R98-H102 HydrophobicContact CB-CB 4.17Å; R98-H102 HydrophobicContact CG-CB 4.48Å; T99-H102 PolarHBondContact N-ND1 2.55Å; T99-H102 VanDerWaalsContact N-ND1 3.15Å; T99-H102 WeakPolarHBondContact O-CB 3.46Å; T99-H102 PolarHBondContact O-N 3.45Å; T99-H102 PolarHBondContact OG1-ND1 2.95Å; H102-A106 VanDerWaalsContact O-CB 3.27Å; H102-A106 WeakPolarHBondContact O-CB 3.34Å; H102-A106 PolarHBondContact O-N 3.38Å; H102-Q125 PolarHBondContact CE1-O 3.44Å; H102-Q125 PolarHBondContact NE2-O 3.31Å; H102-Q125 VanDerWaalsContact NE2-O 3.12Å; H102-V131 PolarHBondContact NE2-O 2.93Å; H102-V131 VanDerWaalsContact NE2-O 3.16Å; H102-L136 HydrophobicContact CB-CD1 3.79Å; H102-L136 WeakPolarHBondContact O-CD1 3.19Å
103	Y	95.4	Very high	94.4	Very high	11 Å²	11	27.9 Å²	27.9	4%	0.043	15%	0.146	C	C	.	.	H	α-helix	trans	-69.8	-41.3	179.7	-69.8	-78.1	0	0	0	113.1	F43 I70 K74 N94 R98 T99 A100 L101 V105 A106 G107	F43-Y103 HydrophobicContact CD1-CD1 4.15Å; F43-Y103 HydrophobicContact CD1-CE1 4.22Å; F43-Y103 AromaticContact CE1-CD1 3.93Å; F43-Y103 HydrophobicContact CE1-CD1 3.93Å; F43-Y103 AromaticContact CE1-CE1 3.97Å; F43-Y103 HydrophobicContact CE1-CE1 3.97Å; F43-Y103 HydrophobicContact CE1-CG 4.41Å; I70-Y103 HydrophobicContact CG2-CD2 3.45Å; I70-Y103 VanDerWaalsContact CG2-CD2 3.45Å; I70-Y103 HydrophobicContact CG2-CE2 3.74Å; I70-Y103 HydrophobicContact CG2-CG 4.19Å; K74-Y103 HydrophobicContact CD-CD1 4.13Å; K74-Y103 HydrophobicContact CG-CD1 4.23Å; N94-Y103 PolarHBondContact ND2-OH 3.4Å; R98-Y103 HydrophobicContact CB-CE2 3.86Å; T99-Y103 WeakPolarHBondContact O-CD2 3.19Å; T99-Y103 PolarHBondContact O-N 2.92Å; A100-Y103 PolarHBondContact O-N 3.19Å; L101-Y103 VanDerWaalsContact C-N 3.3Å; L101-Y103 PolarHBondContact O-N 3.48Å; Y103-V105 VanDerWaalsContact C-N 3.33Å; Y103-V105 PolarHBondContact O-N 3.47Å; Y103-A106 PolarHBondContact O-N 3.49Å; Y103-G107 PolarHBondContact O-N 3.11Å
104	A	97.4	Very high	94.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.6	-43.6	175.8	0	0	0	0	0	111.6	A73 A100 L101 G107 K108 N109 A112 V113 L116	A73-A104 HydrophobicContact CB-CB 4.31Å; A100-A104 WeakPolarHBondContact O-CB 3.21Å; A100-A104 PolarHBondContact O-N 3.23Å; L101-A104 PolarHBondContact O-N 2.87Å; A104-G107 PolarHBondContact O-N 2.97Å; A104-K108 PolarHBondContact O-N 3.4Å; A104-N109 HydrophobicContact CB-CB 4.49Å; A104-N109 WeakPolarHBondContact O-CB 3.38Å; A104-N109 PolarHBondContact O-N 2.83Å; A104-A112 HydrophobicContact CB-CB 3.9Å; A104-V113 HydrophobicContact CB-CG2 3.88Å; A104-L116 HydrophobicContact CB-CD1 3.84Å
105	V	97.4	Very high	95.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-68.9	-47.1	179	174.8	0	0	0	0	111.4	L101 Y103 G107 K108 V113 A133 L136 A137 I145 L149	L101-V105 HydrophobicContact CD1-CG2 3.96Å; L101-V105 HydrophobicContact CG-CG2 4.22Å; L101-V105 WeakPolarHBondContact O-CB 3.37Å; L101-V105 WeakPolarHBondContact O-CG2 3.44Å; L101-V105 PolarHBondContact O-N 2.97Å; Y103-V105 VanDerWaalsContact C-N 3.33Å; Y103-V105 PolarHBondContact O-N 3.47Å; V105-G107 PolarHBondContact O-N 2.91Å; V105-K108 PolarHBondContact O-N 2.6Å; V105-V113 HydrophobicContact CG2-CG2 3.77Å; V105-A133 WeakPolarHBondContact CG1-O 3.35Å; V105-A133 HydrophobicContact CG2-CB 4.19Å; V105-L136 HydrophobicContact CB-CB 4.4Å; V105-L136 HydrophobicContact CG1-CB 3.73Å; V105-A137 HydrophobicContact CG1-CB 3.77Å; V105-A137 VanDerWaalsContact CG1-N 3.32Å; V105-I145 HydrophobicContact CB-CG2 4.33Å; V105-I145 HydrophobicContact CG1-CG2 3.88Å; V105-I145 HydrophobicContact CG2-CG2 3.83Å; V105-L149 HydrophobicContact CG2-CD1 4.16Å
106	A	94	Very high	95.6	Very high	16 Å²	16	25.6 Å²	25.6	13%	0.132	14%	0.135	C	C	.	.	H	α-helix	trans	-60.7	-34.7	177.6	0	0	0	0	0	112.4	F43 H102 Y103 K108 F140	F43-A106 HydrophobicContact CB-CB 4.15Å; F43-A106 HydrophobicContact CD1-CB 3.5Å; F43-A106 VanDerWaalsContact CD1-CB 3.5Å; F43-A106 HydrophobicContact CE1-CB 3.98Å; F43-A106 HydrophobicContact CG-CB 3.89Å; H102-A106 VanDerWaalsContact O-CB 3.27Å; H102-A106 WeakPolarHBondContact O-CB 3.34Å; H102-A106 PolarHBondContact O-N 3.38Å; Y103-A106 PolarHBondContact O-N 3.49Å; A106-K108 PolarHBondContact O-N 3.16Å; A106-F140 HydrophobicContact CB-CD2 4.06Å; A106-F140 HydrophobicContact CB-CE2 3.57Å; A106-F140 HydrophobicContact CB-CZ 4.24Å
107	G	92	Very high	96.1	Very high	40 Å²	40	24.7 Å²	24.7	41%	0.412	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-6.7	173.6	0	0	0	0	0	114.9	Y103 A104 V105 N109	Y103-G107 PolarHBondContact O-N 3.11Å; A104-G107 PolarHBondContact O-N 2.97Å; V105-G107 PolarHBondContact O-N 2.91Å; G107-N109 PolarHBondContact O-N 3.41Å; G107-N109 PolarHBondContact O-OD1 3.39Å
108	K	95.9	Very high	96.3	Very high	101 Å²	101	29.3 Å²	29.3	44%	0.439	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	31.4	-169.7	-54.5	-175.1	178.8	-166.9	0	113.6	A104 V105 A106 I110 F140 I145	A104-K108 PolarHBondContact O-N 3.4Å; V105-K108 PolarHBondContact O-N 2.6Å; A106-K108 PolarHBondContact O-N 3.16Å; K108-I110 PolarHBondContact O-N 3.43Å; K108-I110 VanDerWaalsContact O-N 3.08Å; K108-F140 WeakPolarHBondContact CE-O 3.39Å; K108-F140 PolarHBondContact NZ-O 3.08Å; K108-I145 HydrophobicContact CB-CD1 4.39Å
109	N	97.1	Very high	96.3	Very high	22 Å²	22	33.6 Å²	33.6	12%	0.118	17%	0.168	C	C	.	.			trans	-84.2	80.9	-174.8	-65.2	-24	0	0	0	110.9	A73 K74 N76 A104 G107 E111 A112 V113	A73-N109 PolarHBondContact O-ND2 3.04Å; K74-N109 VanDerWaalsContact C-ND2 3.34Å; K74-N109 PolarHBondContact O-ND2 3.22Å; N76-N109 HydrophobicContact CB-CB 3.84Å; N76-N109 PolarHBondContact N-ND2 2.94Å; N76-N109 WeakPolarHBondContact OD1-CB 3.3Å; A104-N109 HydrophobicContact CB-CB 4.49Å; A104-N109 WeakPolarHBondContact O-CB 3.38Å; A104-N109 PolarHBondContact O-N 2.83Å; G107-N109 PolarHBondContact O-N 3.41Å; G107-N109 PolarHBondContact O-OD1 3.39Å; N109-E111 VanDerWaalsContact C-N 3.3Å; N109-E111 PolarHBondContact O-N 3.39Å; N109-A112 HydrophobicContact CB-CB 3.88Å; N109-A112 PolarHBondContact O-N 3.13Å; N109-V113 WeakPolarHBondContact O-CG2 3.27Å; N109-V113 PolarHBondContact O-N 2.81Å
110	I	97.5	Very high	96.3	Very high	51 Å²	51	44.5 Å²	44.5	26%	0.262	21%	0.209	S	C	.	.	H	α-helix	trans	-54.7	-44	-172.7	-64.1	169.9	0	0	0	111.9	K108 V113 Q114 T144 I145 L148	K108-I110 PolarHBondContact O-N 3.43Å; K108-I110 VanDerWaalsContact O-N 3.08Å; I110-V113 PolarHBondContact O-N 3.03Å; I110-Q114 WeakPolarHBondContact O-CG 3.2Å; I110-Q114 PolarHBondContact O-N 3.32Å; I110-T144 HydrophobicContact CD1-CG2 4.06Å; I110-I145 HydrophobicContact CG1-CD1 4.11Å; I110-I145 HydrophobicContact CG1-CG1 3.88Å; I110-L148 HydrophobicContact CG2-CD1 3.95Å
111	E	97.8	Very high	96.3	Very high	93 Å²	93	44.7 Å²	44.7	44%	0.435	21%	0.211	S	C	.	.	H	α-helix	trans	-69.6	-40.4	-177.1	-60	75.9	-166.4	0	0	111.9	N76 V78 N109 V113 Q114 V115	N76-E111 PolarHBondContact ND2-OE2 3.14Å; V78-E111 HydrophobicContact CG2-CB 3.54Å; N109-E111 VanDerWaalsContact C-N 3.3Å; N109-E111 PolarHBondContact O-N 3.39Å; E111-V113 VanDerWaalsContact C-N 3.34Å; E111-Q114 PolarHBondContact O-N 3.41Å; E111-V115 WeakPolarHBondContact O-CG2 3.43Å; E111-V115 PolarHBondContact O-N 2.95Å
112	A	97.6	Very high	96.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.2	-42.7	172.1	0	0	0	0	0	111.6	N76 M81 A104 N109 Q114 V115 L116	N76-A112 WeakPolarHBondContact OD1-CB 3.49Å; N76-A112 PolarHBondContact OD1-N 3.29Å; N76-A112 VanDerWaalsContact OD1-N 3.11Å; M81-A112 HydrophobicContact CE-CB 4.26Å; M81-A112 HydrophobicContact SD-CB 3.66Å; A104-A112 HydrophobicContact CB-CB 3.9Å; N109-A112 HydrophobicContact CB-CB 3.88Å; N109-A112 PolarHBondContact O-N 3.13Å; A112-Q114 VanDerWaalsContact C-N 3.34Å; A112-Q114 PolarHBondContact O-N 3.32Å; A112-V115 PolarHBondContact O-N 3.14Å; A112-L116 WeakPolarHBondContact O-CG 3.41Å; A112-L116 PolarHBondContact O-N 2.8Å
113	V	98.3	Very high	96.2	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-59.6	-44.3	173.9	175.4	0	0	0	0	110.9	L101 A104 V105 N109 I110 E111 V115 L116 L117 I145 L149	L101-V113 HydrophobicContact CD1-CG1 4.27Å; L101-V113 HydrophobicContact CD1-CG2 4.46Å; A104-V113 HydrophobicContact CB-CG2 3.88Å; V105-V113 HydrophobicContact CG2-CG2 3.77Å; N109-V113 WeakPolarHBondContact O-CG2 3.27Å; N109-V113 PolarHBondContact O-N 2.81Å; I110-V113 PolarHBondContact O-N 3.03Å; E111-V113 VanDerWaalsContact C-N 3.34Å; V113-V115 VanDerWaalsContact C-N 3.34Å; V113-V115 PolarHBondContact O-N 3.26Å; V113-L116 PolarHBondContact O-N 3.42Å; V113-L117 HydrophobicContact CG1-CD1 3.92Å; V113-L117 HydrophobicContact CG1-CG 4.3Å; V113-L117 WeakPolarHBondContact O-CG 3.08Å; V113-L117 PolarHBondContact O-N 3.18Å; V113-I145 HydrophobicContact CG1-CG2 4.31Å; V113-I145 HydrophobicContact CG2-CD1 4.19Å; V113-I145 HydrophobicContact CG2-CG1 4.47Å; V113-I145 HydrophobicContact CG2-CG2 4.19Å; V113-L149 HydrophobicContact CG1-CD2 4.38Å
114	Q	98	Very high	96.3	Very high	83 Å²	83	50.9 Å²	50.9	39%	0.388	25%	0.245	S	C	.	.	H	α-helix	trans	-61.1	-40.4	176.9	-73.3	174.9	-2.2	0	0	112.6	I110 E111 A112 L117 Q118 L148	I110-Q114 WeakPolarHBondContact O-CG 3.2Å; I110-Q114 PolarHBondContact O-N 3.32Å; E111-Q114 PolarHBondContact O-N 3.41Å; A112-Q114 VanDerWaalsContact C-N 3.34Å; A112-Q114 PolarHBondContact O-N 3.32Å; Q114-L117 PolarHBondContact O-N 3.46Å; Q114-Q118 VanDerWaalsContact O-CG 3.28Å; Q114-Q118 WeakPolarHBondContact O-CG 3.48Å; Q114-Q118 PolarHBondContact O-N 2.84Å; Q114-L148 HydrophobicContact CG-CD1 4.12Å
115	V	96.9	Very high	96.2	Very high	6 Å²	6	52.6 Å²	52.6	4%	0.036	25%	0.253	C	S	.	.	H	α-helix	trans	-62.2	-43.9	174.5	171.3	0	0	0	0	111.2	V78 M81 K82 E111 A112 V113 Q118 R119	V78-V115 HydrophobicContact CG1-CG2 3.81Å; M81-V115 HydrophobicContact CB-CG1 4.32Å; M81-V115 HydrophobicContact CE-CG1 4.38Å; K82-V115 HydrophobicContact CG-CG1 4.48Å; K82-V115 HydrophobicContact CG-CG2 4.34Å; E111-V115 WeakPolarHBondContact O-CG2 3.43Å; E111-V115 PolarHBondContact O-N 2.95Å; A112-V115 PolarHBondContact O-N 3.14Å; V113-V115 VanDerWaalsContact C-N 3.34Å; V113-V115 PolarHBondContact O-N 3.26Å; V115-Q118 PolarHBondContact O-N 3.39Å; V115-R119 VanDerWaalsContact O-CG 3.3Å; V115-R119 WeakPolarHBondContact O-CG 3.38Å; V115-R119 PolarHBondContact O-N 3.02Å
116	L	96.9	Very high	96.1	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-65.1	-39.7	179.3	-69.5	163.6	0	0	0	111.8	Y69 M81 A100 L101 A104 A112 V113 R119 R120 A121	Y69-L116 HydrophobicContact CE1-CD2 3.69Å; Y69-L116 WeakPolarHBondContact OH-CD2 3.37Å; M81-L116 HydrophobicContact CE-CD1 3.94Å; M81-L116 HydrophobicContact CE-CD2 3.8Å; M81-L116 HydrophobicContact CE-CG 3.61Å; A100-L116 HydrophobicContact CB-CD1 4.36Å; A100-L116 HydrophobicContact CB-CD2 3.96Å; L101-L116 HydrophobicContact CB-CD1 4.07Å; L101-L116 HydrophobicContact CD1-CB 4.15Å; L101-L116 HydrophobicContact CD1-CD1 3.89Å; A104-L116 HydrophobicContact CB-CD1 3.84Å; A112-L116 WeakPolarHBondContact O-CG 3.41Å; A112-L116 PolarHBondContact O-N 2.8Å; V113-L116 PolarHBondContact O-N 3.42Å; L116-R119 CarbonylContact O-C 3.49Å; L116-R119 PolarHBondContact O-N 3.5Å; L116-R120 PolarHBondContact O-N 3.02Å; L116-A121 HydrophobicContact CB-CB 4.07Å; L116-A121 HydrophobicContact CD2-CB 4.44Å; L116-A121 WeakPolarHBondContact O-CB 3.47Å; L116-A121 PolarHBondContact O-N 2.99Å
117	L	96.6	Very high	96.1	Very high	39 Å²	39	53.7 Å²	53.7	20%	0.204	26%	0.261	C	S	.	.	H	α-helix	trans	-62	-45.8	173.2	-72.6	168.7	0	0	0	111.9	V113 Q114 R119 R120 L123 L148	V113-L117 HydrophobicContact CG1-CD1 3.92Å; V113-L117 HydrophobicContact CG1-CG 4.3Å; V113-L117 WeakPolarHBondContact O-CG 3.08Å; V113-L117 PolarHBondContact O-N 3.18Å; Q114-L117 PolarHBondContact O-N 3.46Å; L117-R119 PolarHBondContact O-N 3.28Å; L117-R120 PolarHBondContact O-N 3.43Å; L117-L123 HydrophobicContact CD2-CD1 3.67Å; L117-L123 HydrophobicContact CD2-CD2 3.59Å; L117-L123 HydrophobicContact CD2-CG 4.26Å; L117-L148 HydrophobicContact CD1-CB 3.95Å
118	Q	95.4	Very high	96.1	Very high	146 Å²	146	57.8 Å²	57.8	68%	0.682	27%	0.267	S	S	*	.	H	α-helix	trans	-59.4	-30.1	175.1	-74	172.1	5.8	0	0	112.4	Q114 V115 R120	Q114-Q118 VanDerWaalsContact O-CG 3.28Å; Q114-Q118 WeakPolarHBondContact O-CG 3.48Å; Q114-Q118 PolarHBondContact O-N 2.84Å; V115-Q118 PolarHBondContact O-N 3.39Å; Q118-R120 VanDerWaalsContact C-N 3.31Å
119	R	93.8	Very high	95.9	Very high	93 Å²	93	55.9 Å²	55.9	35%	0.351	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	5.4	176.9	-66.5	-64.6	-172.6	144	9.4	114.1	G85 V90 V115 L116 L117 A121	G85-R119 PolarHBondContact O-NH1 3.24Å; V90-R119 HydrophobicContact CG1-CB 4Å; V90-R119 HydrophobicContact CG1-CG 4.48Å; V115-R119 VanDerWaalsContact O-CG 3.3Å; V115-R119 WeakPolarHBondContact O-CG 3.38Å; V115-R119 PolarHBondContact O-N 3.02Å; L116-R119 CarbonylContact O-C 3.49Å; L116-R119 PolarHBondContact O-N 3.5Å; L117-R119 PolarHBondContact O-N 3.28Å; R119-A121 VanDerWaalsContact C-N 3.29Å; R119-A121 PolarHBondContact O-N 3.28Å
120	R	93.8	Very high	95.7	Very high	229 Å²	229	55.7 Å²	55.7	86%	0.864	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	39.8	-180	-54.7	-175	176.4	-159.2	-2	113	L116 L117 Q118	L116-R120 PolarHBondContact O-N 3.02Å; L117-R120 PolarHBondContact O-N 3.43Å; Q118-R120 VanDerWaalsContact C-N 3.31Å
121	A	95.7	Very high	95.6	Very high	6 Å²	6	53.3 Å²	53.3	5%	0.05	25%	0.251	C	S	.	.			trans	-55.7	144.8	170.9	0	0	0	0	0	110.7	V90 D91 L116 R119 L123	V90-A121 HydrophobicContact CG2-CB 4.19Å; D91-A121 WeakPolarHBondContact OD1-CA 3.32Å; L116-A121 HydrophobicContact CB-CB 4.07Å; L116-A121 HydrophobicContact CD2-CB 4.44Å; L116-A121 WeakPolarHBondContact O-CB 3.47Å; L116-A121 PolarHBondContact O-N 2.99Å; R119-A121 VanDerWaalsContact C-N 3.29Å; R119-A121 PolarHBondContact O-N 3.28Å; A121-L123 WeakPolarHBondContact O-CD2 3.43Å; A121-L123 PolarHBondContact O-N 2.91Å; A121-L123 VanDerWaalsContact O-N 3.14Å
122	N	96.4	Very high	95.6	Very high	68 Å²	68	49 Å²	49	36%	0.364	23%	0.231	S	C	.	.			trans	-70.7	107.3	178.1	-177.7	-0.4	0	0	0	110.8	D91 N124 Q125	D91-N122 PolarHBondContact OD1-N 2.86Å; D91-N122 PolarHBondContact OD2-N 3.14Å; N122-N124 VanDerWaalsContact C-N 3.32Å; N122-N124 PolarHBondContact O-N 3.19Å; N122-N124 PolarHBondContact OD1-N 3.49Å; N122-N124 VanDerWaalsContact OD1-N 3.15Å; N122-Q125 HydrophobicContact CB-CB 4.38Å; N122-Q125 PolarHBondContact O-N 3.11Å; N122-Q125 PolarHBondContact OD1-N 3.15Å
123	L	97.3	Very high	95.6	Very high	12 Å²	12	49 Å²	49	6%	0.063	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-22.7	-174.5	-49.4	-175.8	0	0	0	113.6	L101 L117 A121 L149 G152 A154	L101-L123 HydrophobicContact CD2-CD2 3.53Å; L117-L123 HydrophobicContact CD2-CD1 3.67Å; L117-L123 HydrophobicContact CD2-CD2 3.59Å; L117-L123 HydrophobicContact CD2-CG 4.26Å; A121-L123 WeakPolarHBondContact O-CD2 3.43Å; A121-L123 PolarHBondContact O-N 2.91Å; A121-L123 VanDerWaalsContact O-N 3.14Å; L123-L149 HydrophobicContact CD2-CD2 4.1Å; L123-G152 VanDerWaalsContact CD1-C 3.47Å; L123-G152 VanDerWaalsContact CD1-O 3.28Å; L123-G152 WeakPolarHBondContact CD1-O 3.5Å; L123-A154 HydrophobicContact CB-CB 3.78Å; L123-A154 HydrophobicContact CD1-CB 4.04Å
124	N	96.8	Very high	95.6	Very high	64 Å²	64	49 Å²	49	34%	0.342	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	12.5	-177.9	-62.3	-31	0	0	0	112.1	N122 A126 D155	N122-N124 VanDerWaalsContact C-N 3.32Å; N122-N124 PolarHBondContact O-N 3.19Å; N122-N124 PolarHBondContact OD1-N 3.49Å; N122-N124 VanDerWaalsContact OD1-N 3.15Å; N124-A126 PolarHBondContact O-N 3.06Å; N124-A126 VanDerWaalsContact O-N 3.17Å; N124-D155 PolarHBondContact OD1-N 3.29Å
125	Q	95.6	Very high	95.5	Very high	35 Å²	35	45.1 Å²	45.1	16%	0.164	21%	0.213	C	C	.	.			trans	-64.8	118.7	171.8	-175.9	55.1	68.1	0	0	108.9	T99 H102 N122	T99-Q125 HydrophobicContact CG2-CG 3.89Å; H102-Q125 PolarHBondContact CE1-O 3.44Å; H102-Q125 PolarHBondContact NE2-O 3.31Å; H102-Q125 VanDerWaalsContact NE2-O 3.12Å; N122-Q125 HydrophobicContact CB-CB 4.38Å; N122-Q125 PolarHBondContact O-N 3.11Å; N122-Q125 PolarHBondContact OD1-N 3.15Å
126	A	95.6	Very high	95.5	Very high	32 Å²	32	44.8 Å²	44.8	26%	0.264	21%	0.211	S	C	.	.			trans	-91.1	146.3	173.8	0	0	0	0	0	111.1	N124 V131 T132	N124-A126 PolarHBondContact O-N 3.06Å; N124-A126 VanDerWaalsContact O-N 3.17Å; A126-V131 WeakPolarHBondContact CA-O 3.13Å; A126-T132 HydrophobicContact CB-CG2 3.9Å
127	D	93.5	Very high	95.6	Very high	8 Å²	8	44.8 Å²	44.8	4%	0.043	21%	0.211	C	C	.	.			trans	-79.7	-176.8	169.2	87.2	-11	0	0	0	111.8	H96 R98 H129 G130 V131	H96-D127 WeakPolarHBondContact O-CB 3.43Å; R98-D127 HydrophobicContact CG-CB 3.66Å; R98-D127 IonicContact CZ-OD2 2.7Å; R98-D127 IonicContact NE-OD2 2.7Å; R98-D127 PolarHBondContact NE-OD2 3.48Å; R98-D127 VanDerWaalsContact NE-OD2 3.08Å; R98-D127 IonicContact NH2-OD2 3.18Å; R98-D127 PolarHBondContact NH2-OD2 3.15Å; D127-H129 PolarHBondContact O-N 2.79Å; D127-H129 WeakPolarHBondContact OD1-CA 3.35Å; D127-H129 WeakPolarHBondContact OD1-CB 3.41Å; D127-H129 PolarHBondContact OD1-N 3.41Å; D127-G130 PolarHBondContact O-N 3.44Å; D127-G130 PolarHBondContact OD1-N 3.17Å; D127-V131 PolarHBondContact N-O 3.38Å; D127-V131 WeakPolarHBondContact OD1-CB 3.46Å; D127-V131 PolarHBondContact OD1-N 2.83Å
128	K	91.8	Very high	95.6	Very high	125 Å²	125	43 Å²	43	54%	0.543	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-16.9	179.3	-78.6	-171.9	175.6	178.7	0	115.1	L95 H96 D97	L95-K128 WeakPolarHBondContact O-CE 3.29Å; L95-K128 PolarHBondContact O-NZ 2.84Å; H96-K128 PolarHBondContact O-N 3.03Å; D97-K128 HydrophobicContact CB-CG 4.23Å; D97-K128 WeakPolarHBondContact OD2-CG 3.4Å
129	H	91.1	Very high	95.6	Very high	62 Å²	62	36.5 Å²	36.5	29%	0.287	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	9.8	179	-58.3	-70.9	0	0	0	112.2	D127 V131 A161	D127-H129 PolarHBondContact O-N 2.79Å; D127-H129 WeakPolarHBondContact OD1-CA 3.35Å; D127-H129 WeakPolarHBondContact OD1-CB 3.41Å; D127-H129 PolarHBondContact OD1-N 3.41Å; H129-V131 HydrophobicContact CB-CG2 4.06Å; H129-V131 PolarHBondContact O-N 3.43Å; H129-A161 WeakPolarHBondContact O-CB 3.49Å; H129-A161 PolarHBondContact O-N 3.42Å
130	G	94	Very high	95.6	Very high	18 Å²	18	33.7 Å²	33.7	19%	0.186	16%	0.161	C	C	.	.	S	Bend	trans	74.7	7	-175.2	0	0	0	0	0	113.2	D127 T132 N160	D127-G130 PolarHBondContact O-N 3.44Å; D127-G130 PolarHBondContact OD1-N 3.17Å; G130-T132 PolarHBondContact O-N 3.14Å; G130-N160 WeakPolarHBondContact O-CA 2.88Å; G130-N160 WeakPolarHBondContact O-CB 3.34Å
131	V	95.6	Very high	95.6	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.128	C	C	.	.			trans	-79.9	123.5	-176.8	179.8	0	0	0	0	108.7	F40 H102 A126 D127 H129 H135 L136 N160	F40-V131 HydrophobicContact CD1-CG1 4.22Å; F40-V131 HydrophobicContact CE1-CG1 3.64Å; F40-V131 HydrophobicContact CE1-CG2 4.1Å; F40-V131 HydrophobicContact CE2-CG2 4.14Å; F40-V131 HydrophobicContact CZ-CG1 4.12Å; F40-V131 HydrophobicContact CZ-CG2 3.8Å; H102-V131 PolarHBondContact NE2-O 2.93Å; H102-V131 VanDerWaalsContact NE2-O 3.16Å; A126-V131 WeakPolarHBondContact CA-O 3.13Å; D127-V131 PolarHBondContact N-O 3.38Å; D127-V131 WeakPolarHBondContact OD1-CB 3.46Å; D127-V131 PolarHBondContact OD1-N 2.83Å; H129-V131 HydrophobicContact CB-CG2 4.06Å; H129-V131 PolarHBondContact O-N 3.43Å; V131-H135 HydrophobicContact CG1-CB 3.89Å; V131-L136 HydrophobicContact CG1-CD2 3.72Å; V131-L136 HydrophobicContact CG1-CG 3.76Å; V131-N160 HydrophobicContact CG2-CB 4.32Å
132	T	97.4	Very high	95.7	Very high	4 Å²	4	23.8 Å²	23.8	3%	0.025	13%	0.129	C	C	.	.			trans	-103.2	171.6	175.3	65.9	0	0	0	0	111	A126 G130 I134 H135 L136 V158	A126-T132 HydrophobicContact CB-CG2 3.9Å; G130-T132 PolarHBondContact O-N 3.14Å; T132-I134 PolarHBondContact O-N 3.46Å; T132-I134 WeakPolarHBondContact OG1-CG2 3.38Å; T132-H135 PolarHBondContact N-ND1 3.27Å; T132-H135 WeakPolarHBondContact O-CB 3.36Å; T132-H135 PolarHBondContact O-N 3.46Å; T132-H135 VanDerWaalsContact O-N 3.16Å; T132-H135 PolarHBondContact OG1-ND1 2.89Å; T132-L136 PolarHBondContact O-N 3.29Å; T132-V158 HydrophobicContact CG2-CG2 4.46Å
133	A	97.3	Very high	95.7	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-52.3	-38.3	175.3	0	0	0	0	0	113.1	L101 V105 L136 A137 L149	L101-A133 HydrophobicContact CD2-CB 3.66Å; L101-A133 HydrophobicContact CG-CB 3.83Å; V105-A133 WeakPolarHBondContact CG1-O 3.35Å; V105-A133 HydrophobicContact CG2-CB 4.19Å; A133-L136 PolarHBondContact O-N 3.43Å; A133-A137 PolarHBondContact O-N 3.18Å; A133-L149 HydrophobicContact CB-CD1 3.92Å; A133-L149 HydrophobicContact CB-CD2 4.16Å
134	I	97.8	Very high	95.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-72.3	-33.6	-177.1	-152.3	170.2	0	0	0	112.6	T132 A137 A138 L146 V150 A154 P156 V158 I166	T132-I134 PolarHBondContact O-N 3.46Å; T132-I134 WeakPolarHBondContact OG1-CG2 3.38Å; I134-A137 PolarHBondContact O-N 2.95Å; I134-A138 WeakPolarHBondContact O-CB 3.39Å; I134-A138 PolarHBondContact O-N 3.12Å; I134-L146 HydrophobicContact CD1-CD1 3.71Å; I134-L146 HydrophobicContact CG1-CD1 3.16Å; I134-V150 HydrophobicContact CD1-CG2 3.63Å; I134-A154 HydrophobicContact CD1-CB 4.15Å; I134-P156 HydrophobicContact CD1-CB 4.02Å; I134-V158 HydrophobicContact CG2-CG2 3.76Å; I134-I166 HydrophobicContact CB-CG2 4.29Å; I134-I166 HydrophobicContact CG1-CG2 4.11Å; I134-I166 HydrophobicContact CG2-CG2 3.67Å
135	H	97.1	Very high	95.9	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.9	-43.2	169.9	-66.1	101.3	0	0	0	111.2	F40 V131 T132 A138 W139 V158 N160 L164	F40-H135 HydrophobicContact CE1-CB 4.19Å; F40-H135 HydrophobicContact CZ-CB 4.4Å; V131-H135 HydrophobicContact CG1-CB 3.89Å; T132-H135 PolarHBondContact N-ND1 3.27Å; T132-H135 WeakPolarHBondContact O-CB 3.36Å; T132-H135 PolarHBondContact O-N 3.46Å; T132-H135 VanDerWaalsContact O-N 3.16Å; T132-H135 PolarHBondContact OG1-ND1 2.89Å; H135-A138 PolarHBondContact O-N 3.25Å; H135-W139 WeakPolarHBondContact O-CB 3.43Å; H135-W139 PolarHBondContact O-N 2.93Å; H135-V158 WeakPolarHBondContact CE1-CG2 3.41Å; H135-N160 PolarHBondContact NE2-N 2.89Å; H135-L164 PolarHBondContact NE2-O 3.4Å; H135-L164 VanDerWaalsContact NE2-O 3.11Å
136	L	96.6	Very high	96	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-65.5	-41.6	177.9	-64.8	171.3	0	0	0	111.7	F40 F43 H102 V105 V131 T132 A133 A138 W139 F140	F40-L136 HydrophobicContact CD1-CD2 3.99Å; F40-L136 HydrophobicContact CE1-CD2 4.35Å; F43-L136 HydrophobicContact CD2-CD2 3.92Å; F43-L136 HydrophobicContact CE2-CD1 4.21Å; F43-L136 HydrophobicContact CE2-CD2 3.63Å; F43-L136 HydrophobicContact CZ-CD1 3.92Å; F43-L136 HydrophobicContact CZ-CD2 4.18Å; H102-L136 HydrophobicContact CB-CD1 3.79Å; H102-L136 WeakPolarHBondContact O-CD1 3.19Å; V105-L136 HydrophobicContact CB-CB 4.4Å; V105-L136 HydrophobicContact CG1-CB 3.73Å; V131-L136 HydrophobicContact CG1-CD2 3.72Å; V131-L136 HydrophobicContact CG1-CG 3.76Å; T132-L136 PolarHBondContact O-N 3.29Å; A133-L136 PolarHBondContact O-N 3.43Å; L136-A138 VanDerWaalsContact C-N 3.25Å; L136-A138 PolarHBondContact O-N 2.92Å; L136-W139 PolarHBondContact O-N 2.88Å; L136-F140 HydrophobicContact CB-CD2 4.37Å; L136-F140 HydrophobicContact CD2-CE2 3.98Å; L136-F140 WeakPolarHBondContact O-CB 3.42Å; L136-F140 VanDerWaalsContact O-CD2 3.25Å; L136-F140 WeakPolarHBondContact O-CD2 3.43Å; L136-F140 PolarHBondContact O-N 3.17Å
137	A	97.8	Very high	96.1	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-60.4	-40.3	176.5	0	0	0	0	0	111.3	V105 A133 I134 G141 S142 I145 L146 L149	V105-A137 HydrophobicContact CG1-CB 3.77Å; V105-A137 VanDerWaalsContact CG1-N 3.32Å; A133-A137 PolarHBondContact O-N 3.18Å; I134-A137 PolarHBondContact O-N 2.95Å; A137-G141 PolarHBondContact O-N 2.94Å; A137-S142 PolarHBondContact O-N 3.39Å; A137-I145 HydrophobicContact CB-CB 4.47Å; A137-I145 HydrophobicContact CB-CG2 4.01Å; A137-L146 HydrophobicContact CB-CB 4.03Å; A137-L146 HydrophobicContact CB-CD1 4.43Å; A137-L149 HydrophobicContact CB-CD1 3.95Å
138	A	97.4	Very high	96.3	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-69.2	-48.1	176.1	0	0	0	0	0	112.4	I134 H135 L136 F140 G141 I166 C169 H175 I178	I134-A138 WeakPolarHBondContact O-CB 3.39Å; I134-A138 PolarHBondContact O-N 3.12Å; H135-A138 PolarHBondContact O-N 3.25Å; L136-A138 VanDerWaalsContact C-N 3.25Å; L136-A138 PolarHBondContact O-N 2.92Å; A138-F140 VanDerWaalsContact C-N 3.35Å; A138-F140 PolarHBondContact O-N 3.31Å; A138-G141 PolarHBondContact O-N 3.5Å; A138-I166 HydrophobicContact CB-CB 3.84Å; A138-I166 HydrophobicContact CB-CG2 4.22Å; A138-I166 WeakPolarHBondContact CB-O 3.49Å; A138-C169 HydrophobicContact CB-CB 3.99Å; A138-H175 PolarHBondContact O-CD2 3.48Å; A138-H175 VanDerWaalsContact O-CD2 3.25Å; A138-I178 HydrophobicContact CB-CD1 4.35Å; A138-I178 HydrophobicContact CB-CG2 4.32Å; A138-I178 WeakPolarHBondContact O-CD1 2.94Å
139	W	95.3	Very high	96.7	Very high	11 Å²	11	17.6 Å²	17.6	4%	0.042	10%	0.099	C	C	.	.	H	α-helix	trans	-57.9	-43.6	179.6	-177.1	-84.8	0	0	0	113	V37 F40 H135 L136 C169 I172 N173 H175	V37-W139 HydrophobicContact CB-CH2 4.22Å; V37-W139 HydrophobicContact CG1-CH2 3.17Å; V37-W139 HydrophobicContact CG1-CZ2 3.16Å; V37-W139 HydrophobicContact CG1-CZ3 4.15Å; V37-W139 HydrophobicContact CG2-CH2 4.01Å; F40-W139 HydrophobicContact CB-CD2 3.78Å; F40-W139 HydrophobicContact CB-CE3 4.35Å; F40-W139 HydrophobicContact CB-CG 4.16Å; F40-W139 HydrophobicContact CB-CZ2 3.99Å; F40-W139 HydrophobicContact CD1-CB 3.76Å; F40-W139 AromaticContact CD1-CD1 3.96Å; F40-W139 AromaticContact CD1-CD2 3.42Å; F40-W139 HydrophobicContact CD1-CD2 3.42Å; F40-W139 VanDerWaalsContact CD1-CD2 3.42Å; F40-W139 AromaticContact CD1-CE3 3.73Å; F40-W139 HydrophobicContact CD1-CE3 3.73Å; F40-W139 AromaticContact CD1-CG 3.38Å; F40-W139 HydrophobicContact CD1-CG 3.38Å; F40-W139 HydrophobicContact CD2-CD2 4Å; F40-W139 AromaticContact CD2-CE3 3.7Å; F40-W139 HydrophobicContact CD2-CE3 3.7Å; F40-W139 HydrophobicContact CD2-CH2 4.29Å; F40-W139 AromaticContact CD2-CZ3 3.85Å; F40-W139 HydrophobicContact CD2-CZ3 3.85Å; F40-W139 HydrophobicContact CE1-CB 3.85Å; F40-W139 AromaticContact CE1-CD2 3.94Å; F40-W139 HydrophobicContact CE1-CD2 3.94Å; F40-W139 AromaticContact CE1-CE3 3.85Å; F40-W139 HydrophobicContact CE1-CE3 3.85Å; F40-W139 AromaticContact CE1-CG 3.92Å; F40-W139 HydrophobicContact CE1-CG 3.92Å; F40-W139 HydrophobicContact CE2-CD2 4.46Å; F40-W139 AromaticContact CE2-CE3 3.82Å; F40-W139 HydrophobicContact CE2-CE3 3.82Å; F40-W139 HydrophobicContact CE2-CZ3 4.06Å; F40-W139 AromaticContact CG-CD2 3.46Å; F40-W139 HydrophobicContact CG-CD2 3.46Å; F40-W139 VanDerWaalsContact CG-CD2 3.46Å; F40-W139 AromaticContact CG-CE2 3.78Å; F40-W139 AromaticContact CG-CE3 3.67Å; F40-W139 HydrophobicContact CG-CE3 3.67Å; F40-W139 AromaticContact CG-CG 3.9Å; F40-W139 HydrophobicContact CG-CG 3.9Å; F40-W139 HydrophobicContact CG-CH2 4.49Å; F40-W139 HydrophobicContact CG-CZ2 4.31Å; F40-W139 HydrophobicContact CG-CZ3 4.17Å; F40-W139 HydrophobicContact CZ-CD2 4.43Å; F40-W139 AromaticContact CZ-CE3 3.89Å; F40-W139 HydrophobicContact CZ-CE3 3.89Å; H135-W139 WeakPolarHBondContact O-CB 3.43Å; H135-W139 PolarHBondContact O-N 2.93Å; L136-W139 PolarHBondContact O-N 2.88Å; W139-C169 HydrophobicContact CB-CB 4.21Å; W139-C169 HydrophobicContact CE3-CB 4.06Å; W139-I172 HydrophobicContact CH2-CB 4.43Å; W139-I172 HydrophobicContact CH2-CG2 3.48Å; W139-I172 VanDerWaalsContact CH2-CG2 3.48Å; W139-I172 HydrophobicContact CZ2-CG2 4.42Å; W139-I172 HydrophobicContact CZ3-CB 4.17Å; W139-I172 HydrophobicContact CZ3-CD1 4.07Å; W139-I172 HydrophobicContact CZ3-CG2 3.7Å; W139-N173 VanDerWaalsContact CE3-ND2 3.31Å; W139-N173 WeakPolarHBondContact CH2-ND2 3.2Å; W139-N173 WeakPolarHBondContact CZ2-ND2 3.45Å; W139-N173 WeakPolarHBondContact CZ3-ND2 3.49Å; W139-N173 PolarHBondContact O-ND2 3.36Å; W139-H175 PolarHBondContact O-CD2 3Å; W139-H175 PolarHBondContact O-NE2 3.4Å
140	F	93.3	Very high	97	Very high	33 Å²	33	16.3 Å²	16.3	15%	0.145	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-5.4	-178.6	-72.2	-69.3	0	0	0	113.3	F43 I44 A106 K108 L136 A138 H175	F43-F140 HydrophobicContact CB-CE2 4.31Å; F43-F140 HydrophobicContact CB-CZ 3.84Å; I44-F140 HydrophobicContact CD1-CE1 4.39Å; I44-F140 HydrophobicContact CG1-CE1 4.04Å; I44-F140 HydrophobicContact CG1-CZ 4.32Å; A106-F140 HydrophobicContact CB-CD2 4.06Å; A106-F140 HydrophobicContact CB-CE2 3.57Å; A106-F140 HydrophobicContact CB-CZ 4.24Å; K108-F140 WeakPolarHBondContact CE-O 3.39Å; K108-F140 PolarHBondContact NZ-O 3.08Å; L136-F140 HydrophobicContact CB-CD2 4.37Å; L136-F140 HydrophobicContact CD2-CE2 3.98Å; L136-F140 WeakPolarHBondContact O-CB 3.42Å; L136-F140 VanDerWaalsContact O-CD2 3.25Å; L136-F140 WeakPolarHBondContact O-CD2 3.43Å; L136-F140 PolarHBondContact O-N 3.17Å; A138-F140 VanDerWaalsContact C-N 3.35Å; A138-F140 PolarHBondContact O-N 3.31Å; F140-H175 VanDerWaalsContact C-NE2 3.34Å
141	G	95	Very high	97.1	Very high	16 Å²	16	22.9 Å²	22.9	17%	0.165	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	45.2	176.5	0	0	0	0	0	113.4	A137 A138 H175	A137-G141 PolarHBondContact O-N 2.94Å; A138-G141 PolarHBondContact O-N 3.5Å; G141-H175 WeakPolarHBondContact CA-CD2 3.32Å; G141-H175 VanDerWaalsContact CA-CG 3.43Å; G141-H175 VanDerWaalsContact CA-NE2 3.33Å; G141-H175 WeakPolarHBondContact CA-NE2 3.31Å; G141-H175 PolarHBondContact N-CD2 2.84Å; G141-H175 PolarHBondContact N-NE2 3.28Å; G141-H175 VanDerWaalsContact N-NE2 3.19Å
142	S	96.8	Very high	97.2	Very high	12 Å²	12	25 Å²	25	8%	0.084	14%	0.142	C	C	.	.			trans	-113.9	83.6	173.1	-169.1	0	0	0	0	110.7	A137 T144 I145 L146	A137-S142 PolarHBondContact O-N 3.39Å; S142-T144 PolarHBondContact O-N 3.26Å; S142-I145 PolarHBondContact O-N 2.9Å; S142-I145 WeakPolarHBondContact OG-CB 3.43Å; S142-I145 WeakPolarHBondContact OG-CG1 3.42Å; S142-I145 PolarHBondContact OG-N 2.86Å; S142-L146 WeakPolarHBondContact O-CB 3.25Å; S142-L146 PolarHBondContact O-N 3.2Å
143	V	97.6	Very high	97.2	Very high	22 Å²	22	27.4 Å²	27.4	13%	0.133	17%	0.168	C	C	.	.	H	α-helix	trans	-56	-37	174.6	175.3	0	0	0	0	111.5	L146 K147 D177 I178 F181	V143-L146 PolarHBondContact O-N 3.23Å; V143-K147 HydrophobicContact CG1-CD 3.97Å; V143-K147 HydrophobicContact CG1-CG 4.26Å; V143-K147 WeakPolarHBondContact O-CB 3.47Å; V143-K147 VanDerWaalsContact O-CG 3.31Å; V143-K147 WeakPolarHBondContact O-CG 3.32Å; V143-K147 PolarHBondContact O-N 3.34Å; V143-D177 HydrophobicContact CG2-CB 3.85Å; V143-D177 WeakPolarHBondContact CG2-OD2 3.38Å; V143-I178 HydrophobicContact CG2-CB 4.35Å; V143-I178 HydrophobicContact CG2-CG1 3.42Å; V143-I178 VanDerWaalsContact CG2-CG1 3.42Å; V143-F181 HydrophobicContact CG1-CB 4.43Å
144	T	98.3	Very high	97.2	Very high	80 Å²	80	27.6 Å²	27.6	49%	0.491	17%	0.17	S	C	.	.	H	α-helix	trans	-61.4	-47.9	177.7	-53.7	0	0	0	0	111.8	I110 S142 K147 L148	I110-T144 HydrophobicContact CD1-CG2 4.06Å; S142-T144 PolarHBondContact O-N 3.26Å; T144-K147 PolarHBondContact O-N 2.82Å; T144-L148 WeakPolarHBondContact O-CG 3.42Å; T144-L148 PolarHBondContact O-N 2.69Å
145	I	98.5	Very high	97.1	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-68.3	-40.4	177.9	-69.4	175.9	0	0	0	110.4	V105 K108 I110 V113 A137 S142 K147 L148 L149	V105-I145 HydrophobicContact CB-CG2 4.33Å; V105-I145 HydrophobicContact CG1-CG2 3.88Å; V105-I145 HydrophobicContact CG2-CG2 3.83Å; K108-I145 HydrophobicContact CB-CD1 4.39Å; I110-I145 HydrophobicContact CG1-CD1 4.11Å; I110-I145 HydrophobicContact CG1-CG1 3.88Å; V113-I145 HydrophobicContact CG1-CG2 4.31Å; V113-I145 HydrophobicContact CG2-CD1 4.19Å; V113-I145 HydrophobicContact CG2-CG1 4.47Å; V113-I145 HydrophobicContact CG2-CG2 4.19Å; A137-I145 HydrophobicContact CB-CB 4.47Å; A137-I145 HydrophobicContact CB-CG2 4.01Å; S142-I145 PolarHBondContact O-N 2.9Å; S142-I145 WeakPolarHBondContact OG-CB 3.43Å; S142-I145 WeakPolarHBondContact OG-CG1 3.42Å; S142-I145 PolarHBondContact OG-N 2.86Å; I145-K147 VanDerWaalsContact C-N 3.32Å; I145-K147 PolarHBondContact O-N 3.11Å; I145-L148 WeakPolarHBondContact O-CB 3.45Å; I145-L148 PolarHBondContact O-N 3.13Å; I145-L148 VanDerWaalsContact O-N 3.15Å; I145-L149 HydrophobicContact CG2-CD1 3.9Å; I145-L149 HydrophobicContact CG2-CG 4.13Å; I145-L149 VanDerWaalsContact O-CG 3.3Å; I145-L149 WeakPolarHBondContact O-CG 3.37Å; I145-L149 PolarHBondContact O-N 3.17Å
146	L	98.3	Very high	97.1	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-55.8	-47.7	174.9	-179.9	57.6	0	0	0	111.3	I134 A137 S142 V143 L148 L149 V150 I178 F181	I134-L146 HydrophobicContact CD1-CD1 3.71Å; I134-L146 HydrophobicContact CG1-CD1 3.16Å; A137-L146 HydrophobicContact CB-CB 4.03Å; A137-L146 HydrophobicContact CB-CD1 4.43Å; S142-L146 WeakPolarHBondContact O-CB 3.25Å; S142-L146 PolarHBondContact O-N 3.2Å; V143-L146 PolarHBondContact O-N 3.23Å; L146-L148 PolarHBondContact O-N 3.27Å; L146-L149 PolarHBondContact O-N 3.46Å; L146-V150 HydrophobicContact CD1-CG2 4.42Å; L146-V150 WeakPolarHBondContact O-CG2 3.48Å; L146-V150 PolarHBondContact O-N 3.03Å; L146-I178 HydrophobicContact CD2-CB 4.27Å; L146-I178 HydrophobicContact CD2-CG1 4.01Å; L146-I178 HydrophobicContact CD2-CG2 3.5Å; L146-I178 VanDerWaalsContact CD2-CG2 3.5Å; L146-F181 HydrophobicContact CD2-CD1 3.78Å; L146-F181 HydrophobicContact CD2-CE1 4.16Å; L146-F181 HydrophobicContact CG-CD1 4.08Å; L146-F181 HydrophobicContact CG-CE1 3.96Å
147	K	98.3	Very high	97.1	Very high	77 Å²	77	34.1 Å²	34.1	34%	0.335	21%	0.21	S	C	.	.	H	α-helix	trans	-58.2	-46.4	174.2	-77.6	177.2	176.8	-171.9	0	112.1	V143 T144 I145 L149 V150 Q151 F181 D185	V143-K147 HydrophobicContact CG1-CD 3.97Å; V143-K147 HydrophobicContact CG1-CG 4.26Å; V143-K147 WeakPolarHBondContact O-CB 3.47Å; V143-K147 VanDerWaalsContact O-CG 3.31Å; V143-K147 WeakPolarHBondContact O-CG 3.32Å; V143-K147 PolarHBondContact O-N 3.34Å; T144-K147 PolarHBondContact O-N 2.82Å; I145-K147 VanDerWaalsContact C-N 3.32Å; I145-K147 PolarHBondContact O-N 3.11Å; K147-L149 VanDerWaalsContact C-N 3.35Å; K147-L149 PolarHBondContact O-N 3.07Å; K147-V150 PolarHBondContact O-N 2.8Å; K147-Q151 WeakPolarHBondContact O-CB 3.4Å; K147-Q151 WeakPolarHBondContact O-CG 3.41Å; K147-Q151 PolarHBondContact O-N 2.81Å; K147-F181 HydrophobicContact CB-CZ 4.47Å; K147-F181 HydrophobicContact CD-CD2 4.27Å; K147-F181 HydrophobicContact CD-CE2 4.04Å; K147-F181 HydrophobicContact CG-CD2 4Å; K147-F181 HydrophobicContact CG-CE1 4.15Å; K147-F181 HydrophobicContact CG-CE2 3.48Å; K147-F181 VanDerWaalsContact CG-CE2 3.48Å; K147-F181 HydrophobicContact CG-CZ 3.55Å; K147-D185 IonicContact NZ-OD1 2.6Å
148	L	98.3	Very high	96.9	Very high	35 Å²	35	35.5 Å²	35.5	18%	0.183	22%	0.219	C	C	.	.	H	α-helix	trans	-61.6	-41.4	177.5	-72.6	172.9	0	0	0	112.3	I110 Q114 L117 T144 I145 L146 G152	I110-L148 HydrophobicContact CG2-CD1 3.95Å; Q114-L148 HydrophobicContact CG-CD1 4.12Å; L117-L148 HydrophobicContact CD1-CB 3.95Å; T144-L148 WeakPolarHBondContact O-CG 3.42Å; T144-L148 PolarHBondContact O-N 2.69Å; I145-L148 WeakPolarHBondContact O-CB 3.45Å; I145-L148 PolarHBondContact O-N 3.13Å; I145-L148 VanDerWaalsContact O-N 3.15Å; L146-L148 PolarHBondContact O-N 3.27Å; L148-G152 PolarHBondContact O-N 3.12Å
149	L	98.4	Very high	96.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-65.9	-46.9	178.7	-70.4	173.4	0	0	0	111.3	L101 V105 V113 L123 A133 A137 I145 L146 K147 G152 G153 A154	L101-L149 HydrophobicContact CD1-CD2 4.23Å; L101-L149 HydrophobicContact CD2-CD2 4.33Å; V105-L149 HydrophobicContact CG2-CD1 4.16Å; V113-L149 HydrophobicContact CG1-CD2 4.38Å; L123-L149 HydrophobicContact CD2-CD2 4.1Å; A133-L149 HydrophobicContact CB-CD1 3.92Å; A133-L149 HydrophobicContact CB-CD2 4.16Å; A137-L149 HydrophobicContact CB-CD1 3.95Å; I145-L149 HydrophobicContact CG2-CD1 3.9Å; I145-L149 HydrophobicContact CG2-CG 4.13Å; I145-L149 VanDerWaalsContact O-CG 3.3Å; I145-L149 WeakPolarHBondContact O-CG 3.37Å; I145-L149 PolarHBondContact O-N 3.17Å; L146-L149 PolarHBondContact O-N 3.46Å; K147-L149 VanDerWaalsContact C-N 3.35Å; K147-L149 PolarHBondContact O-N 3.07Å; L149-G152 CarbonylContact O-C 3.59Å; L149-G152 WeakPolarHBondContact O-CA 3.41Å; L149-G152 PolarHBondContact O-N 2.96Å; L149-G152 VanDerWaalsContact O-N 3.1Å; L149-G153 PolarHBondContact O-N 3.26Å; L149-A154 HydrophobicContact CB-CB 3.92Å; L149-A154 WeakPolarHBondContact O-CB 3.37Å; L149-A154 PolarHBondContact O-N 2.87Å
150	V	97.9	Very high	96.7	Very high	35 Å²	35	39.3 Å²	39.3	21%	0.212	24%	0.237	C	C	.	.	H	α-helix	trans	-62.7	-45.2	177.5	174.4	0	0	0	0	111	I134 L146 K147 G152 G153 F181 L186	I134-V150 HydrophobicContact CD1-CG2 3.63Å; L146-V150 HydrophobicContact CD1-CG2 4.42Å; L146-V150 WeakPolarHBondContact O-CG2 3.48Å; L146-V150 PolarHBondContact O-N 3.03Å; K147-V150 PolarHBondContact O-N 2.8Å; V150-G152 PolarHBondContact O-N 2.89Å; V150-G153 PolarHBondContact O-N 3.21Å; V150-F181 HydrophobicContact CG2-CE1 4.47Å; V150-L186 HydrophobicContact CG1-CD2 3.82Å; V150-L186 HydrophobicContact CG2-CD1 4.43Å
151	Q	97.1	Very high	96.7	Very high	155 Å²	155	40.7 Å²	40.7	72%	0.724	26%	0.255	S	S	*	.	H	α-helix	trans	-61.6	-30.2	174.4	-72.6	172.4	-3.2	0	0	112.5	K147 G153	K147-Q151 WeakPolarHBondContact O-CB 3.4Å; K147-Q151 WeakPolarHBondContact O-CG 3.41Å; K147-Q151 PolarHBondContact O-N 2.81Å; Q151-G153 PolarHBondContact O-N 2.99Å
152	G	96.8	Very high	96.5	Very high	44 Å²	44	42.9 Å²	42.9	45%	0.454	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-5.2	173	0	0	0	0	0	114.9	L123 L148 L149 V150	L123-G152 VanDerWaalsContact CD1-C 3.47Å; L123-G152 VanDerWaalsContact CD1-O 3.28Å; L123-G152 WeakPolarHBondContact CD1-O 3.5Å; L148-G152 PolarHBondContact O-N 3.12Å; L149-G152 CarbonylContact O-C 3.59Å; L149-G152 WeakPolarHBondContact O-CA 3.41Å; L149-G152 PolarHBondContact O-N 2.96Å; L149-G152 VanDerWaalsContact O-N 3.1Å; V150-G152 PolarHBondContact O-N 2.89Å
153	G	96.8	Very high	96.4	Very high	55 Å²	55	42.6 Å²	42.6	57%	0.567	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.5	18.9	-179.7	0	0	0	0	0	114.9	L149 V150 Q151	L149-G153 PolarHBondContact O-N 3.26Å; V150-G153 PolarHBondContact O-N 3.21Å; Q151-G153 PolarHBondContact O-N 2.99Å
154	A	97.6	Very high	96.2	Very high	5 Å²	5	42 Å²	42	4%	0.041	26%	0.257	C	S	.	.			trans	-63.8	140.1	168	0	0	0	0	0	109.8	L123 I134 L149 P156	L123-A154 HydrophobicContact CB-CB 3.78Å; L123-A154 HydrophobicContact CD1-CB 4.04Å; I134-A154 HydrophobicContact CD1-CB 4.15Å; L149-A154 HydrophobicContact CB-CB 3.92Å; L149-A154 WeakPolarHBondContact O-CB 3.37Å; L149-A154 PolarHBondContact O-N 2.87Å; A154-P156 VanDerWaalsContact O-CD 3.26Å; A154-P156 WeakPolarHBondContact O-CD 3.35Å
155	D	96.9	Very high	96.2	Very high	63 Å²	63	38.1 Å²	38.1	34%	0.337	23%	0.234	S	C	.	.			trans	-83.9	113.7	179.2	180	2.6	0	0	0	109.8	N124 S157 V158	N124-D155 PolarHBondContact OD1-N 3.29Å; D155-S157 VanDerWaalsContact C-N 3.27Å; D155-S157 VanDerWaalsContact CG-OG 3.28Å; D155-S157 PolarHBondContact O-N 3Å; D155-S157 VanDerWaalsContact OD1-CB 3.32Å; D155-S157 WeakPolarHBondContact OD1-CB 3.38Å; D155-S157 PolarHBondContact OD1-N 3.45Å; D155-S157 PolarHBondContact OD1-OG 3.47Å; D155-S157 PolarHBondContact OD2-OG 3.44Å; D155-V158 HydrophobicContact CB-CG1 3.99Å; D155-V158 WeakPolarHBondContact O-CG2 3.47Å
156	P	96.3	Very high	96.1	Very high	20 Å²	20	38.1 Å²	38.1	13%	0.13	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-11.1	177.2	31.6	-35.7	0	0	0	114.2	I134 A154 V158 I166 L186 M188	I134-P156 HydrophobicContact CD1-CB 4.02Å; A154-P156 VanDerWaalsContact O-CD 3.26Å; A154-P156 WeakPolarHBondContact O-CD 3.35Å; P156-V158 VanDerWaalsContact C-N 3.33Å; P156-I166 HydrophobicContact CB-CD1 3.91Å; P156-L186 HydrophobicContact CB-CD1 4.27Å; P156-M188 HydrophobicContact CB-CE 4.37Å; P156-M188 HydrophobicContact CB-SD 3.86Å; P156-M188 HydrophobicContact CG-CE 3.87Å; P156-M188 HydrophobicContact CG-SD 3.35Å; P156-M188 WeakPolarHBondContact CG-SD 3.19Å
157	S	95.8	Very high	96.1	Very high	53 Å²	53	38.1 Å²	38.1	37%	0.371	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-5.1	-175.9	75.1	0	0	0	0	114.7	D155	D155-S157 VanDerWaalsContact C-N 3.27Å; D155-S157 VanDerWaalsContact CG-OG 3.28Å; D155-S157 PolarHBondContact O-N 3Å; D155-S157 VanDerWaalsContact OD1-CB 3.32Å; D155-S157 WeakPolarHBondContact OD1-CB 3.38Å; D155-S157 PolarHBondContact OD1-N 3.45Å; D155-S157 PolarHBondContact OD1-OG 3.47Å; D155-S157 PolarHBondContact OD2-OG 3.44Å
158	V	94.8	Very high	96	Very high	29 Å²	29	34.5 Å²	34.5	18%	0.176	22%	0.218	C	C	.	.			trans	-61.9	149.3	-178.3	-63.9	0	0	0	0	112.5	T132 I134 H135 D155 P156	T132-V158 HydrophobicContact CG2-CG2 4.46Å; I134-V158 HydrophobicContact CG2-CG2 3.76Å; H135-V158 WeakPolarHBondContact CE1-CG2 3.41Å; D155-V158 HydrophobicContact CB-CG1 3.99Å; D155-V158 WeakPolarHBondContact O-CG2 3.47Å; P156-V158 VanDerWaalsContact C-N 3.33Å
159	Q	94.8	Very high	95.8	Very high	80 Å²	80	32.8 Å²	32.8	37%	0.374	21%	0.209	S	C	.	.			trans	-120.4	143.6	169.9	-73.2	175.5	-72	0	0	109.4	G163 L164 T165	Q159-G163 WeakPolarHBondContact CG-O 3.05Å; Q159-G163 PolarHBondContact NE2-O 2.86Å; Q159-L164 WeakPolarHBondContact CA-O 3.47Å; Q159-T165 HydrophobicContact CG-CG2 3.87Å
160	N	93.8	Very high	95.7	Very high	12 Å²	12	32.8 Å²	32.8	6%	0.064	21%	0.209	C	C	.	.			trans	-77.4	-175.8	172.3	78.2	-1.8	0	0	0	111.7	G130 V131 H135 L162 G163 L164	G130-N160 WeakPolarHBondContact O-CA 2.88Å; G130-N160 WeakPolarHBondContact O-CB 3.34Å; V131-N160 HydrophobicContact CG2-CB 4.32Å; H135-N160 PolarHBondContact NE2-N 2.89Å; N160-L162 PolarHBondContact O-N 3.3Å; N160-L162 WeakPolarHBondContact OD1-CA 3.36Å; N160-L162 WeakPolarHBondContact OD1-CB 3.46Å; N160-L162 PolarHBondContact OD1-N 3.06Å; N160-G163 PolarHBondContact O-N 2.95Å; N160-G163 PolarHBondContact OD1-N 3.41Å; N160-L164 PolarHBondContact N-O 3.12Å; N160-L164 VanDerWaalsContact N-O 3.1Å; N160-L164 WeakPolarHBondContact OD1-CB 3.31Å; N160-L164 PolarHBondContact OD1-N 2.98Å
161	A	93	Very high	95.6	Very high	61 Å²	61	31.1 Å²	31.1	50%	0.504	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-9.8	-178.6	0	0	0	0	0	114.4	H129 L196	H129-A161 WeakPolarHBondContact O-CB 3.49Å; H129-A161 PolarHBondContact O-N 3.42Å; A161-L196 VanDerWaalsContact O-CD1 3.28Å; A161-L196 WeakPolarHBondContact O-CD1 3.5Å
162	L	90.4	Very high	95.5	Very high	63 Å²	63	24.5 Å²	24.5	33%	0.33	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	3.8	175.7	-61	172.1	0	0	0	112.4	A36 N160 L164 L196	A36-L162 HydrophobicContact CB-CD1 4.17Å; A36-L162 WeakPolarHBondContact O-CD1 3.35Å; N160-L162 PolarHBondContact O-N 3.3Å; N160-L162 WeakPolarHBondContact OD1-CA 3.36Å; N160-L162 WeakPolarHBondContact OD1-CB 3.46Å; N160-L162 PolarHBondContact OD1-N 3.06Å; L162-L164 HydrophobicContact CB-CD1 4.48Å; L162-L164 HydrophobicContact CB-CG 4.09Å; L162-L164 HydrophobicContact CD1-CD1 4.45Å; L162-L164 PolarHBondContact O-N 3.15Å; L162-L196 WeakPolarHBondContact O-CB 3.48Å; L162-L196 WeakPolarHBondContact O-CG 3.33Å; L162-L196 PolarHBondContact O-N 3.03Å
163	G	93.9	Very high	95.2	Very high	6 Å²	6	24.9 Å²	24.9	6%	0.062	16%	0.16	C	C	.	.			trans	79.4	2.3	-175.6	0	0	0	0	0	114	Q159 N160 T165	Q159-G163 WeakPolarHBondContact CG-O 3.05Å; Q159-G163 PolarHBondContact NE2-O 2.86Å; N160-G163 PolarHBondContact O-N 2.95Å; N160-G163 PolarHBondContact OD1-N 3.41Å; G163-T165 PolarHBondContact O-N 3.16Å
164	L	95.2	Very high	95.1	Very high	8 Å²	8	24.2 Å²	24.2	4%	0.042	14%	0.143	C	C	.	.			trans	-68.5	130.5	-179.3	-57.3	178.8	0	0	0	110.2	F40 H135 Q159 N160 L162 H168 I172 D195	F40-L164 HydrophobicContact CE2-CD1 4.41Å; H135-L164 PolarHBondContact NE2-O 3.4Å; H135-L164 VanDerWaalsContact NE2-O 3.11Å; Q159-L164 WeakPolarHBondContact CA-O 3.47Å; N160-L164 PolarHBondContact N-O 3.12Å; N160-L164 VanDerWaalsContact N-O 3.1Å; N160-L164 WeakPolarHBondContact OD1-CB 3.31Å; N160-L164 PolarHBondContact OD1-N 2.98Å; L162-L164 HydrophobicContact CB-CD1 4.48Å; L162-L164 HydrophobicContact CB-CG 4.09Å; L162-L164 HydrophobicContact CD1-CD1 4.45Å; L162-L164 PolarHBondContact O-N 3.15Å; L164-H168 HydrophobicContact CB-CB 4.13Å; L164-H168 HydrophobicContact CD2-CB 3.89Å; L164-I172 HydrophobicContact CD1-CD1 4.29Å; L164-D195 HydrophobicContact CD2-CB 3.85Å
165	T	96.9	Very high	95.1	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.151	C	C	.	.			trans	-89	171.3	168.2	68.9	0	0	0	0	110.5	Q159 G163 M167 H168 C169 L191 K193	Q159-T165 HydrophobicContact CG-CG2 3.87Å; G163-T165 PolarHBondContact O-N 3.16Å; T165-M167 PolarHBondContact O-N 3.42Å; T165-M167 PolarHBondContact OG1-N 3.32Å; T165-H168 PolarHBondContact N-ND1 2.89Å; T165-H168 PolarHBondContact O-N 3.38Å; T165-H168 VanDerWaalsContact O-N 3.15Å; T165-H168 PolarHBondContact OG1-N 3.16Å; T165-H168 PolarHBondContact OG1-ND1 3.45Å; T165-C169 PolarHBondContact O-N 3.29Å; T165-C169 VanDerWaalsContact O-N 3.14Å; T165-C169 PolarHBondContact O-SG 3.02Å; T165-L191 PolarHBondContact OG1-O 3.08Å; T165-K193 HydrophobicContact CG2-CD 4.45Å; T165-K193 VanDerWaalsContact CG2-CE 3.42Å; T165-K193 HydrophobicContact CG2-CG 4.18Å
166	I	96.9	Very high	95.2	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-57.8	-28.4	170.5	57.3	171.4	0	0	0	113.2	I134 A138 P156 C169 A170 I182 L191	I134-I166 HydrophobicContact CB-CG2 4.29Å; I134-I166 HydrophobicContact CG1-CG2 4.11Å; I134-I166 HydrophobicContact CG2-CG2 3.67Å; A138-I166 HydrophobicContact CB-CB 3.84Å; A138-I166 HydrophobicContact CB-CG2 4.22Å; A138-I166 WeakPolarHBondContact CB-O 3.49Å; P156-I166 HydrophobicContact CB-CD1 3.91Å; I166-C169 PolarHBondContact O-N 3.19Å; I166-A170 WeakPolarHBondContact O-CB 3.41Å; I166-A170 PolarHBondContact O-N 3.35Å; I166-I182 HydrophobicContact CB-CD1 4.47Å; I166-I182 HydrophobicContact CD1-CD1 3.8Å; I166-I182 HydrophobicContact CD1-CG1 3.88Å; I166-I182 HydrophobicContact CG1-CD1 3.76Å; I166-I182 HydrophobicContact CG1-CG1 4.38Å; I166-L191 HydrophobicContact CD1-CD1 4.13Å; I166-L191 HydrophobicContact CG1-CD1 3.96Å
167	M	97.6	Very high	95.2	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-70.9	-39.4	178.1	-162.6	-179.2	-81.8	0	0	111.2	T165 A170 A171 V179 I182 I183 L191 D192 V201 M224	T165-M167 PolarHBondContact O-N 3.42Å; T165-M167 PolarHBondContact OG1-N 3.32Å; M167-A170 PolarHBondContact O-N 3.25Å; M167-A171 WeakPolarHBondContact O-CB 3.46Å; M167-A171 PolarHBondContact O-N 3.21Å; M167-V179 HydrophobicContact CG-CG2 4.14Å; M167-I182 HydrophobicContact CB-CD1 4.09Å; M167-I182 HydrophobicContact CE-CB 4.14Å; M167-I182 HydrophobicContact CE-CG2 3.4Å; M167-I182 VanDerWaalsContact CE-CG2 3.4Å; M167-I182 HydrophobicContact CG-CD1 4.37Å; M167-I183 HydrophobicContact CE-CD1 4.23Å; M167-I183 HydrophobicContact CE-CG1 3.95Å; M167-L191 HydrophobicContact CB-CB 4.38Å; M167-L191 HydrophobicContact CE-CB 4.22Å; M167-D192 HydrophobicContact SD-CB 4.16Å; M167-V201 HydrophobicContact CB-CG2 4.02Å; M167-V201 HydrophobicContact CG-CB 4.46Å; M167-V201 HydrophobicContact CG-CG1 3.91Å; M167-V201 HydrophobicContact CG-CG2 3.73Å; M167-V201 HydrophobicContact SD-CG1 4.35Å; M167-V201 HydrophobicContact SD-CG2 3.77Å; M167-M224 HydrophobicContact CE-CE 4.32Å; M167-M224 HydrophobicContact SD-CE 3.36Å; M167-M224 WeakPolarHBondContact SD-CE 3.24Å
168	H	96.1	Very high	95.3	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.8	-47.7	171.5	-65	83.8	0	0	0	111.3	L164 T165 A170 A171 I172 K193 H199	L164-H168 HydrophobicContact CB-CB 4.13Å; L164-H168 HydrophobicContact CD2-CB 3.89Å; T165-H168 PolarHBondContact N-ND1 2.89Å; T165-H168 PolarHBondContact O-N 3.38Å; T165-H168 VanDerWaalsContact O-N 3.15Å; T165-H168 PolarHBondContact OG1-N 3.16Å; T165-H168 PolarHBondContact OG1-ND1 3.45Å; H168-A170 VanDerWaalsContact C-N 3.26Å; H168-A170 PolarHBondContact O-N 3.4Å; H168-A171 PolarHBondContact O-N 3.36Å; H168-A171 VanDerWaalsContact O-N 3.12Å; H168-I172 WeakPolarHBondContact O-CB 3.47Å; H168-I172 VanDerWaalsContact O-CG1 3.24Å; H168-I172 WeakPolarHBondContact O-CG1 3.47Å; H168-I172 PolarHBondContact O-N 3.23Å; H168-K193 PolarHBondContact CE1-O 3.24Å; H168-K193 PolarHBondContact NE2-O 3.46Å; H168-K193 VanDerWaalsContact NE2-O 3.12Å; H168-H199 PolarHBondContact NE2-O 3.37Å
169	C	95.4	Very high	95.5	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-58.1	-40	179.4	-64.4	0	0	0	0	112.5	A138 W139 T165 I166 N173	A138-C169 HydrophobicContact CB-CB 3.99Å; W139-C169 HydrophobicContact CB-CB 4.21Å; W139-C169 HydrophobicContact CE3-CB 4.06Å; T165-C169 PolarHBondContact O-N 3.29Å; T165-C169 VanDerWaalsContact O-N 3.14Å; T165-C169 PolarHBondContact O-SG 3.02Å; I166-C169 PolarHBondContact O-N 3.19Å; C169-N173 PolarHBondContact O-ND2 3.22Å; C169-N173 VanDerWaalsContact O-ND2 3.08Å
170	A	96.8	Very high	95.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-67.7	-43.1	175.4	0	0	0	0	0	111.9	I166 M167 H168 N173 N174 H175 I178 V179	I166-A170 WeakPolarHBondContact O-CB 3.41Å; I166-A170 PolarHBondContact O-N 3.35Å; M167-A170 PolarHBondContact O-N 3.25Å; H168-A170 VanDerWaalsContact C-N 3.26Å; H168-A170 PolarHBondContact O-N 3.4Å; A170-N173 CarbonylContact O-C 3.59Å; A170-N173 PolarHBondContact O-N 3.19Å; A170-N174 PolarHBondContact O-N 3.3Å; A170-H175 HydrophobicContact CB-CB 4.25Å; A170-H175 PolarHBondContact O-N 3.13Å; A170-I178 HydrophobicContact CB-CB 3.82Å; A170-I178 HydrophobicContact CB-CD1 4.35Å; A170-I178 HydrophobicContact CB-CG2 3.62Å; A170-V179 HydrophobicContact CB-CG2 3.95Å
171	A	95.9	Very high	95.9	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-66	-41.3	179.2	0	0	0	0	0	113.8	M167 H168 N173 N174 V201 A205 S210 M213	M167-A171 WeakPolarHBondContact O-CB 3.46Å; M167-A171 PolarHBondContact O-N 3.21Å; H168-A171 PolarHBondContact O-N 3.36Å; H168-A171 VanDerWaalsContact O-N 3.12Å; A171-N173 PolarHBondContact O-N 2.65Å; A171-N174 PolarHBondContact O-N 3.21Å; A171-V201 HydrophobicContact CB-CG1 3.36Å; A171-A205 HydrophobicContact CB-CB 4.38Å; A171-S210 VanDerWaalsContact O-CB 3.27Å; A171-S210 WeakPolarHBondContact O-CB 3.37Å; A171-S210 PolarHBondContact O-OG 3.26Å; A171-M213 HydrophobicContact CB-CE 4.46Å; A171-M213 HydrophobicContact CB-CG 3.85Å; A171-M213 HydrophobicContact CB-SD 4.3Å
172	I	93.6	Very high	96.1	Very high	15 Å²	15	19.4 Å²	19.4	8%	0.077	11%	0.106	C	C	.	.	H	α-helix	trans	-58.5	-35.7	176.9	-71.1	165.7	0	0	0	111.9	W139 L164 H168 H208 S210	W139-I172 HydrophobicContact CH2-CB 4.43Å; W139-I172 HydrophobicContact CH2-CG2 3.48Å; W139-I172 VanDerWaalsContact CH2-CG2 3.48Å; W139-I172 HydrophobicContact CZ2-CG2 4.42Å; W139-I172 HydrophobicContact CZ3-CB 4.17Å; W139-I172 HydrophobicContact CZ3-CD1 4.07Å; W139-I172 HydrophobicContact CZ3-CG2 3.7Å; L164-I172 HydrophobicContact CD1-CD1 4.29Å; H168-I172 WeakPolarHBondContact O-CB 3.47Å; H168-I172 VanDerWaalsContact O-CG1 3.24Å; H168-I172 WeakPolarHBondContact O-CG1 3.47Å; H168-I172 PolarHBondContact O-N 3.23Å; I172-H208 HydrophobicContact CG2-CB 4.44Å; I172-S210 PolarHBondContact O-OG 2.96Å
173	N	91.2	Very high	96.4	Very high	53 Å²	53	17.2 Å²	17.2	28%	0.283	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	16.9	-177.6	-62.8	-86	0	0	0	113	W139 C169 A170 A171 H175	W139-N173 VanDerWaalsContact CE3-ND2 3.31Å; W139-N173 WeakPolarHBondContact CH2-ND2 3.2Å; W139-N173 WeakPolarHBondContact CZ2-ND2 3.45Å; W139-N173 WeakPolarHBondContact CZ3-ND2 3.49Å; W139-N173 PolarHBondContact O-ND2 3.36Å; C169-N173 PolarHBondContact O-ND2 3.22Å; C169-N173 VanDerWaalsContact O-ND2 3.08Å; A170-N173 CarbonylContact O-C 3.59Å; A170-N173 PolarHBondContact O-N 3.19Å; A171-N173 PolarHBondContact O-N 2.65Å; N173-H175 VanDerWaalsContact C-N 3.31Å; N173-H175 WeakPolarHBondContact CB-NE2 3.25Å; N173-H175 PolarHBondContact O-CE1 3.06Å; N173-H175 PolarHBondContact O-N 2.65Å; N173-H175 PolarHBondContact O-ND1 2.92Å
174	N	95.1	Very high	96.5	Very high	41 Å²	41	22 Å²	22	22%	0.219	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	36.1	175.4	-161	41.8	0	0	0	115	A170 A171 T176 E212 M213	A170-N174 PolarHBondContact O-N 3.3Å; A171-N174 PolarHBondContact O-N 3.21Å; N174-T176 PolarHBondContact O-N 3.06Å; N174-E212 PolarHBondContact ND2-OE2 2.92Å; N174-M213 WeakPolarHBondContact OD1-CB 3.49Å; N174-M213 PolarHBondContact OD1-N 3.13Å
175	H	97.1	Very high	96.6	Very high	46 Å²	46	26.2 Å²	26.2	21%	0.213	13%	0.133	C	C	.	.			trans	-91.9	77.5	178.2	-60.9	-43.5	0	0	0	111.8	A138 W139 F140 G141 A170 N173 D177 I178 V179	A138-H175 PolarHBondContact O-CD2 3.48Å; A138-H175 VanDerWaalsContact O-CD2 3.25Å; W139-H175 PolarHBondContact O-CD2 3Å; W139-H175 PolarHBondContact O-NE2 3.4Å; F140-H175 VanDerWaalsContact C-NE2 3.34Å; G141-H175 WeakPolarHBondContact CA-CD2 3.32Å; G141-H175 VanDerWaalsContact CA-CG 3.43Å; G141-H175 VanDerWaalsContact CA-NE2 3.33Å; G141-H175 WeakPolarHBondContact CA-NE2 3.31Å; G141-H175 PolarHBondContact N-CD2 2.84Å; G141-H175 PolarHBondContact N-NE2 3.28Å; G141-H175 VanDerWaalsContact N-NE2 3.19Å; A170-H175 HydrophobicContact CB-CB 4.25Å; A170-H175 PolarHBondContact O-N 3.13Å; N173-H175 VanDerWaalsContact C-N 3.31Å; N173-H175 WeakPolarHBondContact CB-NE2 3.25Å; N173-H175 PolarHBondContact O-CE1 3.06Å; N173-H175 PolarHBondContact O-N 2.65Å; N173-H175 PolarHBondContact O-ND1 2.92Å; H175-D177 VanDerWaalsContact C-N 3.29Å; H175-D177 PolarHBondContact O-N 2.72Å; H175-I178 HydrophobicContact CB-CB 4.42Å; H175-I178 HydrophobicContact CB-CD1 3.68Å; H175-I178 HydrophobicContact CB-CG1 4.29Å; H175-I178 PolarHBondContact O-N 3.14Å; H175-V179 PolarHBondContact O-N 3.02Å
176	T	97.9	Very high	96.6	Very high	39 Å²	39	28 Å²	28	24%	0.239	14%	0.143	C	C	.	.	H	α-helix	trans	-59.4	-34.3	-178.1	47.9	0	0	0	0	113.9	N174 I178 V179 T180 E212 M213 M216	N174-T176 PolarHBondContact O-N 3.06Å; T176-I178 VanDerWaalsContact C-N 3.35Å; T176-I178 PolarHBondContact O-N 3.01Å; T176-V179 PolarHBondContact O-N 3.01Å; T176-T180 WeakPolarHBondContact O-CB 3.43Å; T176-T180 PolarHBondContact O-N 3Å; T176-T180 PolarHBondContact O-OG1 2.97Å; T176-E212 HydrophobicContact CG2-CB 4.45Å; T176-M213 HydrophobicContact CG2-CE 3.9Å; T176-M213 HydrophobicContact CG2-SD 4.44Å; T176-M216 HydrophobicContact CG2-CB 4.43Å; T176-M216 HydrophobicContact CG2-CE 3.9Å; T176-M216 HydrophobicContact CG2-SD 3.89Å
177	D	98	Very high	96.5	Very high	79 Å²	79	34 Å²	34	42%	0.422	17%	0.172	S	C	.	.	H	α-helix	trans	-65.1	-33.7	177.1	61.9	-18.3	0	0	0	113.5	V143 H175 F181	V143-D177 HydrophobicContact CG2-CB 3.85Å; V143-D177 WeakPolarHBondContact CG2-OD2 3.38Å; H175-D177 VanDerWaalsContact C-N 3.29Å; H175-D177 PolarHBondContact O-N 2.72Å; D177-F181 WeakPolarHBondContact O-CB 3.45Å; D177-F181 PolarHBondContact O-N 3.33Å
178	I	98	Very high	96.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-70	-44.4	172.8	-69.3	164.4	0	0	0	111	A138 V143 L146 A170 H175 T176 T180 F181 I182	A138-I178 HydrophobicContact CB-CD1 4.35Å; A138-I178 HydrophobicContact CB-CG2 4.32Å; A138-I178 WeakPolarHBondContact O-CD1 2.94Å; V143-I178 HydrophobicContact CG2-CB 4.35Å; V143-I178 HydrophobicContact CG2-CG1 3.42Å; V143-I178 VanDerWaalsContact CG2-CG1 3.42Å; L146-I178 HydrophobicContact CD2-CB 4.27Å; L146-I178 HydrophobicContact CD2-CG1 4.01Å; L146-I178 HydrophobicContact CD2-CG2 3.5Å; L146-I178 VanDerWaalsContact CD2-CG2 3.5Å; A170-I178 HydrophobicContact CB-CB 3.82Å; A170-I178 HydrophobicContact CB-CD1 4.35Å; A170-I178 HydrophobicContact CB-CG2 3.62Å; H175-I178 HydrophobicContact CB-CB 4.42Å; H175-I178 HydrophobicContact CB-CD1 3.68Å; H175-I178 HydrophobicContact CB-CG1 4.29Å; H175-I178 PolarHBondContact O-N 3.14Å; T176-I178 VanDerWaalsContact C-N 3.35Å; T176-I178 PolarHBondContact O-N 3.01Å; I178-T180 VanDerWaalsContact C-N 3.25Å; I178-T180 PolarHBondContact O-N 2.95Å; I178-F181 WeakPolarHBondContact O-CB 3.26Å; I178-F181 PolarHBondContact O-N 2.83Å; I178-F181 VanDerWaalsContact O-N 3.16Å; I178-I182 HydrophobicContact CG2-CD1 3.63Å; I178-I182 HydrophobicContact CG2-CG1 4.21Å; I178-I182 VanDerWaalsContact O-CG1 3.25Å; I178-I182 WeakPolarHBondContact O-CG1 3.1Å; I178-I182 PolarHBondContact O-N 3.44Å
179	V	98	Very high	96.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.7	-39.1	177.6	174.5	0	0	0	0	110.5	M167 A170 H175 T176 I182 I183 M213 M216 L217 Y222	M167-V179 HydrophobicContact CG-CG2 4.14Å; A170-V179 HydrophobicContact CB-CG2 3.95Å; H175-V179 PolarHBondContact O-N 3.02Å; T176-V179 PolarHBondContact O-N 3.01Å; V179-I182 PolarHBondContact O-N 3.16Å; V179-I183 HydrophobicContact CG1-CD1 3.75Å; V179-I183 WeakPolarHBondContact O-CG1 3.13Å; V179-I183 PolarHBondContact O-N 3.25Å; V179-M213 HydrophobicContact CB-CE 4.19Å; V179-M213 HydrophobicContact CB-SD 4.29Å; V179-M213 HydrophobicContact CG2-CE 3.48Å; V179-M213 VanDerWaalsContact CG2-CE 3.48Å; V179-M213 HydrophobicContact CG2-SD 3.76Å; V179-M216 HydrophobicContact CB-SD 4.28Å; V179-M216 HydrophobicContact CG1-SD 4.29Å; V179-L217 HydrophobicContact CG1-CD2 4.32Å; V179-Y222 HydrophobicContact CG1-CD1 4.43Å; V179-Y222 HydrophobicContact CG1-CE1 4.35Å
180	T	98	Very high	96.3	Very high	45 Å²	45	45.3 Å²	45.3	28%	0.276	22%	0.224	S	C	.	.	H	α-helix	trans	-58.4	-49.9	172.4	-56.7	0	0	0	0	110.5	T176 I178 I182 I183 Y184 Y222	T176-T180 WeakPolarHBondContact O-CB 3.43Å; T176-T180 PolarHBondContact O-N 3Å; T176-T180 PolarHBondContact O-OG1 2.97Å; I178-T180 VanDerWaalsContact C-N 3.25Å; I178-T180 PolarHBondContact O-N 2.95Å; T180-I182 PolarHBondContact O-N 3.4Å; T180-I183 PolarHBondContact O-N 2.9Å; T180-Y184 HydrophobicContact CG2-CD2 3.72Å; T180-Y184 HydrophobicContact CG2-CE2 4.24Å; T180-Y184 WeakPolarHBondContact O-CB 3.36Å; T180-Y184 WeakPolarHBondContact O-CD2 3.45Å; T180-Y184 PolarHBondContact O-N 3.28Å; T180-Y222 PolarHBondContact OG1-OH 2.94Å
181	F	98.1	Very high	96.1	Very high	13 Å²	13	45.6 Å²	45.6	6%	0.057	23%	0.226	C	C	.	.	I	π-helix	trans	-59.6	-44	177.4	174	-109.2	0	0	0	112.8	V143 L146 K147 V150 D177 I178 I183 D185 L186	V143-F181 HydrophobicContact CG1-CB 4.43Å; L146-F181 HydrophobicContact CD2-CD1 3.78Å; L146-F181 HydrophobicContact CD2-CE1 4.16Å; L146-F181 HydrophobicContact CG-CD1 4.08Å; L146-F181 HydrophobicContact CG-CE1 3.96Å; K147-F181 HydrophobicContact CB-CZ 4.47Å; K147-F181 HydrophobicContact CD-CD2 4.27Å; K147-F181 HydrophobicContact CD-CE2 4.04Å; K147-F181 HydrophobicContact CG-CD2 4Å; K147-F181 HydrophobicContact CG-CE1 4.15Å; K147-F181 HydrophobicContact CG-CE2 3.48Å; K147-F181 VanDerWaalsContact CG-CE2 3.48Å; K147-F181 HydrophobicContact CG-CZ 3.55Å; V150-F181 HydrophobicContact CG2-CE1 4.47Å; D177-F181 WeakPolarHBondContact O-CB 3.45Å; D177-F181 PolarHBondContact O-N 3.33Å; I178-F181 WeakPolarHBondContact O-CB 3.26Å; I178-F181 PolarHBondContact O-N 2.83Å; I178-F181 VanDerWaalsContact O-N 3.16Å; F181-I183 VanDerWaalsContact C-N 3.32Å; F181-I183 PolarHBondContact O-N 3.01Å; F181-D185 HydrophobicContact CD2-CB 3.34Å; F181-D185 HydrophobicContact CE2-CB 3.38Å; F181-D185 HydrophobicContact CG-CB 4.32Å; F181-D185 HydrophobicContact CZ-CB 4.42Å; F181-D185 WeakPolarHBondContact O-CA 3.48Å; F181-D185 WeakPolarHBondContact O-CB 3.18Å; F181-D185 PolarHBondContact O-N 3.23Å; F181-L186 HydrophobicContact CD1-CD1 4.11Å; F181-L186 HydrophobicContact CD1-CG 4.22Å; F181-L186 HydrophobicContact CE1-CD1 3.64Å; F181-L186 HydrophobicContact CE1-CD2 3.86Å; F181-L186 HydrophobicContact CE1-CG 3.72Å; F181-L186 HydrophobicContact CE2-CD2 4.27Å; F181-L186 HydrophobicContact CE2-CG 4.47Å; F181-L186 HydrophobicContact CZ-CD1 4.25Å; F181-L186 HydrophobicContact CZ-CD2 3.56Å; F181-L186 HydrophobicContact CZ-CG 3.87Å; F181-L186 PolarHBondContact O-N 2.93Å
182	I	97.4	Very high	96	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.232	C	C	.	.	I	π-helix	trans	-61.8	-42.5	178.7	-66.8	163	0	0	0	110.9	I166 M167 I178 V179 T180 L186 M187 M188 L191	I166-I182 HydrophobicContact CB-CD1 4.47Å; I166-I182 HydrophobicContact CD1-CD1 3.8Å; I166-I182 HydrophobicContact CD1-CG1 3.88Å; I166-I182 HydrophobicContact CG1-CD1 3.76Å; I166-I182 HydrophobicContact CG1-CG1 4.38Å; M167-I182 HydrophobicContact CB-CD1 4.09Å; M167-I182 HydrophobicContact CE-CB 4.14Å; M167-I182 HydrophobicContact CE-CG2 3.4Å; M167-I182 VanDerWaalsContact CE-CG2 3.4Å; M167-I182 HydrophobicContact CG-CD1 4.37Å; I178-I182 HydrophobicContact CG2-CD1 3.63Å; I178-I182 HydrophobicContact CG2-CG1 4.21Å; I178-I182 VanDerWaalsContact O-CG1 3.25Å; I178-I182 WeakPolarHBondContact O-CG1 3.1Å; I178-I182 PolarHBondContact O-N 3.44Å; V179-I182 PolarHBondContact O-N 3.16Å; T180-I182 PolarHBondContact O-N 3.4Å; I182-L186 HydrophobicContact CG1-CD1 4.34Å; I182-L186 WeakPolarHBondContact O-CB 2.81Å; I182-M187 PolarHBondContact O-N 3.29Å; I182-M188 HydrophobicContact CG2-CB 4.1Å; I182-M188 PolarHBondContact O-N 3.46Å; I182-L191 HydrophobicContact CG2-CD1 3.89Å
183	I	96.9	Very high	96	Very high	16 Å²	16	49.4 Å²	49.4	8%	0.082	24%	0.243	C	C	.	.	I	π-helix	trans	-79.7	-43.8	-174.6	-70.7	169.3	0	0	0	111.8	M167 V179 T180 F181 M187 Y222 M224	M167-I183 HydrophobicContact CE-CD1 4.23Å; M167-I183 HydrophobicContact CE-CG1 3.95Å; V179-I183 HydrophobicContact CG1-CD1 3.75Å; V179-I183 WeakPolarHBondContact O-CG1 3.13Å; V179-I183 PolarHBondContact O-N 3.25Å; T180-I183 PolarHBondContact O-N 2.9Å; F181-I183 VanDerWaalsContact C-N 3.32Å; F181-I183 PolarHBondContact O-N 3.01Å; I183-M187 WeakPolarHBondContact O-CA 3.33Å; I183-M187 WeakPolarHBondContact O-CE 3.35Å; I183-M187 PolarHBondContact O-N 3.44Å; I183-Y222 HydrophobicContact CD1-CD1 3.44Å; I183-Y222 VanDerWaalsContact CD1-CD1 3.44Å; I183-Y222 HydrophobicContact CD1-CE1 3.92Å; I183-M224 HydrophobicContact CD1-SD 3.6Å
184	Y	96.9	Very high	96.1	Very high	107 Å²	107	51.7 Å²	51.7	42%	0.42	25%	0.252	S	S	.	.	I	π-helix	trans	-97.4	-34.6	-171.3	-66.4	-71.6	0	0	0	114.7	T180 M187 A221 Y222	T180-Y184 HydrophobicContact CG2-CD2 3.72Å; T180-Y184 HydrophobicContact CG2-CE2 4.24Å; T180-Y184 WeakPolarHBondContact O-CB 3.36Å; T180-Y184 WeakPolarHBondContact O-CD2 3.45Å; T180-Y184 PolarHBondContact O-N 3.28Å; Y184-M187 VanDerWaalsContact C-CE 3.47Å; Y184-M187 VanDerWaalsContact CA-CE 3.45Å; Y184-M187 WeakPolarHBondContact O-CE 3.24Å; Y184-A221 WeakPolarHBondContact OH-CB 3.39Å; Y184-Y222 AromaticContact CE2-CE1 3.96Å; Y184-Y222 HydrophobicContact CE2-CE1 3.96Å; Y184-Y222 AromaticContact CE2-CZ 3.87Å
185	D	96.4	Very high	96	Very high	96 Å²	96	50.4 Å²	50.4	51%	0.513	25%	0.245	S	C	.	.	I	π-helix	trans	-92.6	-41.6	179.7	-60.6	-125.9	0	0	0	111.1	K147 F181	K147-D185 IonicContact NZ-OD1 2.6Å; F181-D185 HydrophobicContact CD2-CB 3.34Å; F181-D185 HydrophobicContact CE2-CB 3.38Å; F181-D185 HydrophobicContact CG-CB 4.32Å; F181-D185 HydrophobicContact CZ-CB 4.42Å; F181-D185 WeakPolarHBondContact O-CA 3.48Å; F181-D185 WeakPolarHBondContact O-CB 3.18Å; F181-D185 PolarHBondContact O-N 3.23Å
186	L	96.4	Very high	95.7	Very high	37 Å²	37	53.5 Å²	53.5	19%	0.194	26%	0.263	C	S	.	.	S	Bend	trans	-86.7	-19.6	179	-53.9	-178.8	0	0	0	113.1	V150 P156 F181 I182 M188	V150-L186 HydrophobicContact CG1-CD2 3.82Å; V150-L186 HydrophobicContact CG2-CD1 4.43Å; P156-L186 HydrophobicContact CB-CD1 4.27Å; F181-L186 HydrophobicContact CD1-CD1 4.11Å; F181-L186 HydrophobicContact CD1-CG 4.22Å; F181-L186 HydrophobicContact CE1-CD1 3.64Å; F181-L186 HydrophobicContact CE1-CD2 3.86Å; F181-L186 HydrophobicContact CE1-CG 3.72Å; F181-L186 HydrophobicContact CE2-CD2 4.27Å; F181-L186 HydrophobicContact CE2-CG 4.47Å; F181-L186 HydrophobicContact CZ-CD1 4.25Å; F181-L186 HydrophobicContact CZ-CD2 3.56Å; F181-L186 HydrophobicContact CZ-CG 3.87Å; F181-L186 PolarHBondContact O-N 2.93Å; I182-L186 HydrophobicContact CG1-CD1 4.34Å; I182-L186 WeakPolarHBondContact O-CB 2.81Å; L186-M188 HydrophobicContact CB-CB 4.27Å; L186-M188 HydrophobicContact CB-CG 3.84Å; L186-M188 HydrophobicContact CB-SD 4.09Å; L186-M188 HydrophobicContact CD1-SD 4.42Å; L186-M188 WeakPolarHBondContact O-CG 3.41Å; L186-M188 PolarHBondContact O-N 2.84Å
187	M	96.6	Very high	95.2	Very high	126 Å²	126	54.1 Å²	54.1	62%	0.621	27%	0.268	S	S	*	.			trans	58.5	32.9	-174.8	-52.2	-87.2	78	0	0	112.9	I182 I183 Y184	I182-M187 PolarHBondContact O-N 3.29Å; I183-M187 WeakPolarHBondContact O-CA 3.33Å; I183-M187 WeakPolarHBondContact O-CE 3.35Å; I183-M187 PolarHBondContact O-N 3.44Å; Y184-M187 VanDerWaalsContact C-CE 3.47Å; Y184-M187 VanDerWaalsContact CA-CE 3.45Å; Y184-M187 WeakPolarHBondContact O-CE 3.24Å
188	M	95.6	Very high	94.9	Very high	27 Å²	27	50.7 Å²	50.7	13%	0.133	25%	0.252	C	S	.	.			trans	-110.1	58.4	-171.6	-65.4	-173.9	76.8	0	0	113	P156 I182 L186 E190 L191	P156-M188 HydrophobicContact CB-CE 4.37Å; P156-M188 HydrophobicContact CB-SD 3.86Å; P156-M188 HydrophobicContact CG-CE 3.87Å; P156-M188 HydrophobicContact CG-SD 3.35Å; P156-M188 WeakPolarHBondContact CG-SD 3.19Å; I182-M188 HydrophobicContact CG2-CB 4.1Å; I182-M188 PolarHBondContact O-N 3.46Å; L186-M188 HydrophobicContact CB-CB 4.27Å; L186-M188 HydrophobicContact CB-CG 3.84Å; L186-M188 HydrophobicContact CB-SD 4.09Å; L186-M188 HydrophobicContact CD1-SD 4.42Å; L186-M188 WeakPolarHBondContact O-CG 3.41Å; L186-M188 PolarHBondContact O-N 2.84Å; M188-E190 VanDerWaalsContact C-OE2 3.27Å; M188-E190 VanDerWaalsContact CA-OE2 3.29Å; M188-E190 WeakPolarHBondContact CA-OE2 3.22Å; M188-E190 PolarHBondContact O-N 3.11Å; M188-L191 HydrophobicContact CB-CD1 4.01Å; M188-L191 HydrophobicContact CB-CG 4.04Å; M188-L191 HydrophobicContact CE-CD1 4Å; M188-L191 HydrophobicContact CE-CD2 3.94Å; M188-L191 HydrophobicContact CE-CG 4.05Å; M188-L191 PolarHBondContact O-N 3.24Å; M188-L191 HydrophobicContact SD-CD1 4.28Å
189	K	93.6	Very high	94.6	Very high	90 Å²	90	51.3 Å²	51.3	39%	0.391	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-64.9	-25.9	177.5	-171.7	174.5	175.5	177	0	111.9	L191 D192 Y222 N223	K189-L191 PolarHBondContact O-N 3.18Å; K189-D192 WeakPolarHBondContact O-CB 3.27Å; K189-D192 PolarHBondContact O-N 3.43Å; K189-D192 VanDerWaalsContact O-N 3.07Å; K189-Y222 WeakPolarHBondContact CE-O 3.27Å; K189-Y222 PolarHBondContact NZ-O 3.32Å; K189-N223 PolarHBondContact NZ-O 3.39Å
190	E	93.9	Very high	94.5	Very high	122 Å²	122	54.4 Å²	54.4	57%	0.57	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-62.5	-7.6	176.8	68.8	-82.3	-172.2	0	0	114.9	M188 D192	M188-E190 VanDerWaalsContact C-OE2 3.27Å; M188-E190 VanDerWaalsContact CA-OE2 3.29Å; M188-E190 WeakPolarHBondContact CA-OE2 3.22Å; M188-E190 PolarHBondContact O-N 3.11Å; E190-D192 PolarHBondContact O-N 3.41Å
191	L	93.3	Very high	94.4	Very high	5 Å²	5	52.3 Å²	52.3	3%	0.026	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-74	-8.4	170.8	-62.6	-175.8	0	0	0	113.5	T165 I166 M167 I182 M188 K189 K193	T165-L191 PolarHBondContact OG1-O 3.08Å; I166-L191 HydrophobicContact CD1-CD1 4.13Å; I166-L191 HydrophobicContact CG1-CD1 3.96Å; M167-L191 HydrophobicContact CB-CB 4.38Å; M167-L191 HydrophobicContact CE-CB 4.22Å; I182-L191 HydrophobicContact CG2-CD1 3.89Å; M188-L191 HydrophobicContact CB-CD1 4.01Å; M188-L191 HydrophobicContact CB-CG 4.04Å; M188-L191 HydrophobicContact CE-CD1 4Å; M188-L191 HydrophobicContact CE-CD2 3.94Å; M188-L191 HydrophobicContact CE-CG 4.05Å; M188-L191 PolarHBondContact O-N 3.24Å; M188-L191 HydrophobicContact SD-CD1 4.28Å; K189-L191 PolarHBondContact O-N 3.18Å; L191-K193 PolarHBondContact O-N 3.32Å
192	D	94.4	Very high	94.4	Very high	27 Å²	27	51.7 Å²	51.7	14%	0.144	25%	0.251	C	S	.	.			trans	-78.9	83.2	165.5	-173.5	29.2	0	0	0	111.1	M167 K189 E190 R200 V201 M224	M167-D192 HydrophobicContact SD-CB 4.16Å; K189-D192 WeakPolarHBondContact O-CB 3.27Å; K189-D192 PolarHBondContact O-N 3.43Å; K189-D192 VanDerWaalsContact O-N 3.07Å; E190-D192 PolarHBondContact O-N 3.41Å; D192-R200 PolarHBondContact O-NH1 3.36Å; D192-V201 HydrophobicContact CB-CG2 4.46Å; D192-V201 WeakPolarHBondContact OD1-CG2 3.36Å; D192-V201 PolarHBondContact OD1-N 3.38Å; D192-M224 HydrophobicContact CB-CE 3.54Å
193	K	92.2	Very high	94.3	Very high	69 Å²	69	52.1 Å²	52.1	30%	0.3	25%	0.254	S	S	.	.			trans	-133.4	162.2	177.8	55.9	177	166.6	174	0	109.2	T165 H168 L191	T165-K193 HydrophobicContact CG2-CD 4.45Å; T165-K193 VanDerWaalsContact CG2-CE 3.42Å; T165-K193 HydrophobicContact CG2-CG 4.18Å; H168-K193 PolarHBondContact CE1-O 3.24Å; H168-K193 PolarHBondContact NE2-O 3.46Å; H168-K193 VanDerWaalsContact NE2-O 3.12Å; L191-K193 PolarHBondContact O-N 3.32Å
194	E	94.2	Very high	94.3	Very high	100 Å²	100	51.4 Å²	51.4	47%	0.467	25%	0.251	S	S	.	.			trans	-65	138.2	176.9	-68.7	167.3	-150.6	0	0	111.7	H199 R200	E194-H199 CarbonylContact C-O 3.53Å; E194-H199 WeakPolarHBondContact CA-O 3.46Å; E194-R200 HydrophobicContact CG-CG 3.99Å
195	D	92.8	Very high	94.3	Very high	15 Å²	15	46.3 Å²	46.3	8%	0.08	23%	0.231	C	C	.	.			trans	-75.5	-173.7	163.8	84.4	-15.8	0	0	0	111.3	L164 S197 G198 H199	L164-D195 HydrophobicContact CD2-CB 3.85Å; D195-S197 PolarHBondContact O-N 3.28Å; D195-S197 VanDerWaalsContact OD1-CA 3.31Å; D195-S197 WeakPolarHBondContact OD1-CA 3.49Å; D195-S197 WeakPolarHBondContact OD1-CB 3.27Å; D195-S197 PolarHBondContact OD1-N 3.38Å; D195-G198 PolarHBondContact O-N 2.82Å; D195-G198 VanDerWaalsContact O-N 3.14Å; D195-G198 PolarHBondContact OD1-N 3.46Å; D195-H199 PolarHBondContact N-O 3.25Å; D195-H199 WeakPolarHBondContact OD1-CB 3.5Å; D195-H199 IonicContact OD1-CG 3.41Å; D195-H199 PolarHBondContact OD1-N 3.23Å
196	L	91.3	Very high	94.4	Very high	110 Å²	110	41.7 Å²	41.7	58%	0.576	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-13.7	179.3	-68.8	-175.2	0	0	0	114.4	A161 L162 Q231	A161-L196 VanDerWaalsContact O-CD1 3.28Å; A161-L196 WeakPolarHBondContact O-CD1 3.5Å; L162-L196 WeakPolarHBondContact O-CB 3.48Å; L162-L196 WeakPolarHBondContact O-CG 3.33Å; L162-L196 PolarHBondContact O-N 3.03Å; L196-Q231 PolarHBondContact O-NE2 3.03Å; L196-Q231 PolarHBondContact O-OE1 3.18Å
197	S	87.2	Confident	94.4	Very high	52 Å²	52	41.7 Å²	41.7	36%	0.364	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-7.5	174.1	-46.4	0	0	0	0	112.2	D195 Q231	D195-S197 PolarHBondContact O-N 3.28Å; D195-S197 VanDerWaalsContact OD1-CA 3.31Å; D195-S197 WeakPolarHBondContact OD1-CA 3.49Å; D195-S197 WeakPolarHBondContact OD1-CB 3.27Å; D195-S197 PolarHBondContact OD1-N 3.38Å; S197-Q231 WeakPolarHBondContact O-CB 3.4Å; S197-Q231 WeakPolarHBondContact O-CG 3.41Å; S197-Q231 PolarHBondContact O-N 3.46Å; S197-Q231 VanDerWaalsContact O-N 3.13Å
198	G	91.5	Very high	94.3	Very high	8 Å²	8	38.3 Å²	38.3	8%	0.082	19%	0.188	C	C	.	.	S	Bend	trans	86.5	10.6	-172.2	0	0	0	0	0	113.2	D195	D195-G198 PolarHBondContact O-N 2.82Å; D195-G198 VanDerWaalsContact O-N 3.14Å; D195-G198 PolarHBondContact OD1-N 3.46Å
199	H	92	Very high	94.3	Very high	12 Å²	12	38 Å²	38	6%	0.056	19%	0.192	C	C	.	.			trans	-83	126.8	178.8	-60.7	150.9	0	0	0	110.4	H168 E194 D195 A203 E207 D230	H168-H199 PolarHBondContact NE2-O 3.37Å; E194-H199 CarbonylContact C-O 3.53Å; E194-H199 WeakPolarHBondContact CA-O 3.46Å; D195-H199 PolarHBondContact N-O 3.25Å; D195-H199 WeakPolarHBondContact OD1-CB 3.5Å; D195-H199 IonicContact OD1-CG 3.41Å; D195-H199 PolarHBondContact OD1-N 3.23Å; H199-A203 HydrophobicContact CB-CB 4.24Å; H199-E207 IonicContact CE1-OE2 3.08Å; H199-E207 IonicContact ND1-OE2 3.64Å; H199-D230 VanDerWaalsContact CD2-CB 3.46Å; H199-D230 WeakPolarHBondContact CD2-CB 3.31Å; H199-D230 IonicContact CD2-OD2 2.93Å; H199-D230 IonicContact CE1-OD2 3.87Å; H199-D230 IonicContact NE2-OD2 3.89Å; H199-D230 PolarHBondContact NE2-OD2 3.26Å
200	R	95.1	Very high	94.4	Very high	66 Å²	66	34 Å²	34	25%	0.249	18%	0.175	C	C	.	.			trans	-83.3	170.7	159.4	-68.8	173	177.9	-80.2	-6.8	110.1	D192 E194 F202 A203 S204 E228	D192-R200 PolarHBondContact O-NH1 3.36Å; E194-R200 HydrophobicContact CG-CG 3.99Å; R200-F202 PolarHBondContact O-N 3.24Å; R200-F202 VanDerWaalsContact O-N 3.16Å; R200-A203 WeakPolarHBondContact O-CB 3.32Å; R200-A203 PolarHBondContact O-N 2.88Å; R200-S204 PolarHBondContact O-N 2.99Å; R200-S204 PolarHBondContact O-OG 3.4Å; R200-E228 IonicContact CZ-OE2 3.23Å; R200-E228 IonicContact NE-OE2 2.89Å; R200-E228 PolarHBondContact NE-OE2 3.46Å; R200-E228 IonicContact NH2-OE2 3.45Å
201	V	96.1	Very high	94.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-54.8	-39.7	-177.1	-179.5	0	0	0	0	112.4	M167 A171 D192 S204 A205 L217 M224	M167-V201 HydrophobicContact CB-CG2 4.02Å; M167-V201 HydrophobicContact CG-CB 4.46Å; M167-V201 HydrophobicContact CG-CG1 3.91Å; M167-V201 HydrophobicContact CG-CG2 3.73Å; M167-V201 HydrophobicContact SD-CG1 4.35Å; M167-V201 HydrophobicContact SD-CG2 3.77Å; A171-V201 HydrophobicContact CB-CG1 3.36Å; D192-V201 HydrophobicContact CB-CG2 4.46Å; D192-V201 WeakPolarHBondContact OD1-CG2 3.36Å; D192-V201 PolarHBondContact OD1-N 3.38Å; V201-S204 PolarHBondContact O-N 3.18Å; V201-A205 PolarHBondContact O-N 3.09Å; V201-L217 HydrophobicContact CG1-CD1 3.99Å; V201-L217 HydrophobicContact CG1-CD2 4.46Å; V201-M224 HydrophobicContact CB-CE 4.45Å
202	F	97.9	Very high	94.8	Very high	1 Å²	1	35.2 Å²	35.2	0%	0.004	18%	0.183	C	C	.	.	H	α-helix	trans	-65.7	-41.7	177.8	-172.6	-98.4	0	0	0	113.1	R200 A205 A206 L214 L217 M218 A225 T226 M227 P236 L252 F256	R200-F202 PolarHBondContact O-N 3.24Å; R200-F202 VanDerWaalsContact O-N 3.16Å; F202-A205 PolarHBondContact O-N 2.88Å; F202-A206 PolarHBondContact O-N 3.26Å; F202-A206 VanDerWaalsContact O-N 3.11Å; F202-L214 HydrophobicContact CD1-CD2 4.36Å; F202-L214 HydrophobicContact CD2-CD2 3.67Å; F202-L214 HydrophobicContact CE1-CD2 4.2Å; F202-L214 HydrophobicContact CE2-CB 4.41Å; F202-L214 HydrophobicContact CE2-CD2 3.46Å; F202-L214 VanDerWaalsContact CE2-CD2 3.46Å; F202-L214 HydrophobicContact CG-CD2 4.13Å; F202-L214 HydrophobicContact CZ-CD2 3.76Å; F202-L214 WeakPolarHBondContact O-CD2 3.14Å; F202-L217 HydrophobicContact CB-CD1 4.2Å; F202-L217 HydrophobicContact CD2-CB 3.83Å; F202-L217 HydrophobicContact CD2-CD1 4.03Å; F202-L217 HydrophobicContact CE2-CB 4.43Å; F202-M218 HydrophobicContact CE2-CE 3.67Å; F202-M218 HydrophobicContact CE2-CG 3.93Å; F202-M218 HydrophobicContact CZ-CE 3.54Å; F202-M218 HydrophobicContact CZ-CG 4.37Å; F202-A225 HydrophobicContact CD2-CB 3.86Å; F202-A225 HydrophobicContact CE1-CB 4.43Å; F202-A225 HydrophobicContact CE2-CB 3.49Å; F202-A225 VanDerWaalsContact CE2-CB 3.49Å; F202-A225 HydrophobicContact CG-CB 4.46Å; F202-A225 HydrophobicContact CZ-CB 3.8Å; F202-T226 HydrophobicContact CB-CG2 4.25Å; F202-T226 HydrophobicContact CD1-CG2 4.44Å; F202-T226 WeakPolarHBondContact CD1-O 3.01Å; F202-T226 WeakPolarHBondContact CE1-O 3.37Å; F202-M227 HydrophobicContact CE1-CE 4.45Å; F202-P236 HydrophobicContact CD1-CB 4.23Å; F202-P236 HydrophobicContact CD1-CG 3.89Å; F202-P236 HydrophobicContact CE1-CB 4.13Å; F202-P236 HydrophobicContact CE1-CG 4.08Å; F202-L252 HydrophobicContact CE1-CD2 3.81Å; F202-L252 HydrophobicContact CZ-CD2 3.64Å; F202-F256 HydrophobicContact CZ-CE2 4.02Å; F202-F256 HydrophobicContact CZ-CZ 4.2Å
203	A	96.8	Very high	95	Very high	8 Å²	8	33.9 Å²	33.9	7%	0.066	18%	0.176	C	C	.	.	H	α-helix	trans	-66	-42.1	175.5	0	0	0	0	0	111.4	H199 R200 A205 A206 E207 P236 L239	H199-A203 HydrophobicContact CB-CB 4.24Å; R200-A203 WeakPolarHBondContact O-CB 3.32Å; R200-A203 PolarHBondContact O-N 2.88Å; A203-A205 VanDerWaalsContact C-N 3.31Å; A203-A205 PolarHBondContact O-N 2.86Å; A203-A206 WeakPolarHBondContact O-CB 3.13Å; A203-A206 PolarHBondContact O-N 3.06Å; A203-A206 VanDerWaalsContact O-N 3.13Å; A203-E207 PolarHBondContact O-N 2.97Å; A203-P236 HydrophobicContact CB-CG 4.15Å; A203-L239 HydrophobicContact CB-CD1 4.05Å
204	S	95.3	Very high	95.3	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.007	16%	0.161	C	C	.	.	H	α-helix	trans	-62.5	-37	175.4	-57.1	0	0	0	0	112.7	R200 V201 A206 H208	R200-S204 PolarHBondContact O-N 2.99Å; R200-S204 PolarHBondContact O-OG 3.4Å; V201-S204 PolarHBondContact O-N 3.18Å; S204-A206 VanDerWaalsContact C-N 3.35Å; S204-H208 PolarHBondContact O-N 3.21Å; S204-H208 PolarHBondContact O-ND1 3.01Å
205	A	97.9	Very high	95.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.3	-39.7	173.9	0	0	0	0	0	111.8	A171 V201 F202 A203 G209 S210 M213 L214	A171-A205 HydrophobicContact CB-CB 4.38Å; V201-A205 PolarHBondContact O-N 3.09Å; F202-A205 PolarHBondContact O-N 2.88Å; A203-A205 VanDerWaalsContact C-N 3.31Å; A203-A205 PolarHBondContact O-N 2.86Å; A205-G209 PolarHBondContact O-N 2.85Å; A205-S210 PolarHBondContact O-N 2.89Å; A205-M213 HydrophobicContact CB-CB 4.19Å; A205-M213 HydrophobicContact CB-CG 3.86Å; A205-L214 HydrophobicContact CB-CD2 3.8Å; A205-L214 HydrophobicContact CB-CG 4Å
206	A	97.7	Very high	95.8	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-67.6	-45.1	176	0	0	0	0	0	112.6	F202 A203 S204 H208 G209 L214 P236 A240 L252	F202-A206 PolarHBondContact O-N 3.26Å; F202-A206 VanDerWaalsContact O-N 3.11Å; A203-A206 WeakPolarHBondContact O-CB 3.13Å; A203-A206 PolarHBondContact O-N 3.06Å; A203-A206 VanDerWaalsContact O-N 3.13Å; S204-A206 VanDerWaalsContact C-N 3.35Å; A206-H208 PolarHBondContact O-N 2.83Å; A206-G209 PolarHBondContact O-N 3.02Å; A206-G209 VanDerWaalsContact O-N 3.15Å; A206-L214 HydrophobicContact CB-CD1 4.37Å; A206-L214 HydrophobicContact CB-CD2 4.16Å; A206-P236 HydrophobicContact CB-CB 3.69Å; A206-P236 WeakPolarHBondContact CB-O 3.47Å; A206-A240 HydrophobicContact CB-CB 4.3Å; A206-A240 WeakPolarHBondContact O-CA 3.36Å; A206-L252 HydrophobicContact CB-CD1 4.08Å
207	E	96.2	Very high	96.1	Very high	37 Å²	37	25.7 Å²	25.7	17%	0.173	14%	0.135	C	C	.	.	H	α-helix	trans	-56.3	-32.6	177.2	-170.5	-169.7	-176.1	0	0	112.6	H199 A203 L239 H245	H199-E207 IonicContact CE1-OE2 3.08Å; H199-E207 IonicContact ND1-OE2 3.64Å; A203-E207 PolarHBondContact O-N 2.97Å; E207-L239 HydrophobicContact CB-CB 3.95Å; E207-L239 HydrophobicContact CB-CD1 4.29Å; E207-L239 HydrophobicContact CG-CB 4.3Å; E207-H245 PolarHBondContact O-CD2 3Å; E207-H245 PolarHBondContact O-NE2 3.26Å
208	H	94.4	Very high	96.6	Very high	54 Å²	54	25.3 Å²	25.3	25%	0.25	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106	6.7	-177.7	-63.1	80.2	0	0	0	113.7	I172 S204 A206 S210 H245	I172-H208 HydrophobicContact CG2-CB 4.44Å; S204-H208 PolarHBondContact O-N 3.21Å; S204-H208 PolarHBondContact O-ND1 3.01Å; A206-H208 PolarHBondContact O-N 2.83Å; H208-S210 VanDerWaalsContact C-N 3.29Å; H208-S210 PolarHBondContact O-N 3.45Å; H208-H245 VanDerWaalsContact C-NE2 3.32Å
209	G	95.8	Very high	96.9	Very high	21 Å²	21	29.9 Å²	29.9	22%	0.216	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	27.8	176.7	0	0	0	0	0	114.6	A205 A206 V211 H245	A205-G209 PolarHBondContact O-N 2.85Å; A206-G209 PolarHBondContact O-N 3.02Å; A206-G209 VanDerWaalsContact O-N 3.15Å; G209-V211 VanDerWaalsContact C-N 3.3Å; G209-V211 PolarHBondContact O-N 2.88Å; G209-H245 PolarHBondContact N-CD2 3.13Å; G209-H245 PolarHBondContact N-NE2 2.85Å
210	S	96.9	Very high	97	Very high	7 Å²	7	37.6 Å²	37.6	5%	0.049	18%	0.183	C	C	.	.			trans	-79.1	76.2	179.1	-67.8	0	0	0	0	110.8	A171 I172 A205 H208 E212 M213 L214	A171-S210 VanDerWaalsContact O-CB 3.27Å; A171-S210 WeakPolarHBondContact O-CB 3.37Å; A171-S210 PolarHBondContact O-OG 3.26Å; I172-S210 PolarHBondContact O-OG 2.96Å; A205-S210 PolarHBondContact O-N 2.89Å; H208-S210 VanDerWaalsContact C-N 3.29Å; H208-S210 PolarHBondContact O-N 3.45Å; S210-E212 PolarHBondContact O-N 2.93Å; S210-M213 WeakPolarHBondContact O-CB 3.25Å; S210-M213 PolarHBondContact O-N 3.08Å; S210-L214 PolarHBondContact O-N 2.97Å
211	V	97.6	Very high	96.9	Very high	31 Å²	31	37.3 Å²	37.3	19%	0.188	20%	0.195	C	C	.	.	H	α-helix	trans	-61.5	-42.9	-171.7	-177.9	0	0	0	0	112.9	G209 M213 L214 Q215 D247 A248 L251	G209-V211 VanDerWaalsContact C-N 3.3Å; G209-V211 PolarHBondContact O-N 2.88Å; V211-M213 VanDerWaalsContact C-N 3.31Å; V211-M213 PolarHBondContact O-N 3.4Å; V211-L214 WeakPolarHBondContact O-CB 3.49Å; V211-L214 PolarHBondContact O-N 3.11Å; V211-Q215 WeakPolarHBondContact O-CG 2.96Å; V211-Q215 PolarHBondContact O-N 3.18Å; V211-D247 HydrophobicContact CG2-CB 3.59Å; V211-A248 HydrophobicContact CG2-CB 4.36Å; V211-L251 HydrophobicContact CG1-CD2 4.08Å
212	E	98.3	Very high	96.9	Very high	120 Å²	120	38.1 Å²	38.1	56%	0.561	20%	0.199	S	C	*	.	H	α-helix	trans	-65.5	-38.8	-179.8	-60.3	165.2	172.9	0	0	110.6	N174 T176 S210 Q215 M216	N174-E212 PolarHBondContact ND2-OE2 2.92Å; T176-E212 HydrophobicContact CG2-CB 4.45Å; S210-E212 PolarHBondContact O-N 2.93Å; E212-Q215 PolarHBondContact O-N 3.31Å; E212-M216 WeakPolarHBondContact O-CB 3.45Å; E212-M216 PolarHBondContact O-N 2.91Å
213	M	98.4	Very high	96.8	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61.9	-46.1	171.2	-175.7	61.6	65.3	0	0	111.7	A171 N174 T176 V179 A205 S210 V211 Q215 M216 L217	A171-M213 HydrophobicContact CB-CE 4.46Å; A171-M213 HydrophobicContact CB-CG 3.85Å; A171-M213 HydrophobicContact CB-SD 4.3Å; N174-M213 WeakPolarHBondContact OD1-CB 3.49Å; N174-M213 PolarHBondContact OD1-N 3.13Å; T176-M213 HydrophobicContact CG2-CE 3.9Å; T176-M213 HydrophobicContact CG2-SD 4.44Å; V179-M213 HydrophobicContact CB-CE 4.19Å; V179-M213 HydrophobicContact CB-SD 4.29Å; V179-M213 HydrophobicContact CG2-CE 3.48Å; V179-M213 VanDerWaalsContact CG2-CE 3.48Å; V179-M213 HydrophobicContact CG2-SD 3.76Å; A205-M213 HydrophobicContact CB-CB 4.19Å; A205-M213 HydrophobicContact CB-CG 3.86Å; S210-M213 WeakPolarHBondContact O-CB 3.25Å; S210-M213 PolarHBondContact O-N 3.08Å; V211-M213 VanDerWaalsContact C-N 3.31Å; V211-M213 PolarHBondContact O-N 3.4Å; M213-Q215 VanDerWaalsContact C-N 3.32Å; M213-Q215 PolarHBondContact O-N 3.11Å; M213-M216 PolarHBondContact O-N 3.37Å; M213-M216 HydrophobicContact SD-SD 4.39Å; M213-L217 HydrophobicContact CG-CD1 3.82Å; M213-L217 HydrophobicContact CG-CG 4.24Å; M213-L217 WeakPolarHBondContact O-CB 3.49Å; M213-L217 WeakPolarHBondContact O-CG 3.47Å; M213-L217 PolarHBondContact O-N 3.37Å; M213-L217 HydrophobicContact SD-CD1 4.12Å; M213-L217 HydrophobicContact SD-CD2 4.34Å; M213-L217 HydrophobicContact SD-CG 4.04Å
214	L	98.5	Very high	96.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-57.6	-45.5	176.3	-74	174.9	0	0	0	111.7	F202 A205 A206 S210 V211 L217 M218 A248 L251	F202-L214 HydrophobicContact CD1-CD2 4.36Å; F202-L214 HydrophobicContact CD2-CD2 3.67Å; F202-L214 HydrophobicContact CE1-CD2 4.2Å; F202-L214 HydrophobicContact CE2-CB 4.41Å; F202-L214 HydrophobicContact CE2-CD2 3.46Å; F202-L214 VanDerWaalsContact CE2-CD2 3.46Å; F202-L214 HydrophobicContact CG-CD2 4.13Å; F202-L214 HydrophobicContact CZ-CD2 3.76Å; F202-L214 WeakPolarHBondContact O-CD2 3.14Å; A205-L214 HydrophobicContact CB-CD2 3.8Å; A205-L214 HydrophobicContact CB-CG 4Å; A206-L214 HydrophobicContact CB-CD1 4.37Å; A206-L214 HydrophobicContact CB-CD2 4.16Å; S210-L214 PolarHBondContact O-N 2.97Å; V211-L214 WeakPolarHBondContact O-CB 3.49Å; V211-L214 PolarHBondContact O-N 3.11Å; L214-L217 PolarHBondContact O-N 3.4Å; L214-M218 HydrophobicContact CB-CE 4.1Å; L214-M218 VanDerWaalsContact O-CG 3.23Å; L214-M218 WeakPolarHBondContact O-CG 3.37Å; L214-M218 PolarHBondContact O-N 3.27Å; L214-M218 VanDerWaalsContact O-N 3.11Å; L214-A248 HydrophobicContact CD1-CB 3.79Å; L214-L251 HydrophobicContact CB-CD2 3.65Å; L214-L251 HydrophobicContact CD1-CD2 4.3Å
215	Q	98.4	Very high	96.8	Very high	99 Å²	99	44.6 Å²	44.6	46%	0.463	24%	0.236	S	C	.	.	H	α-helix	trans	-61	-48.3	176.7	-70.8	176.3	-7	0	0	111.5	V211 E212 M213 L217 M218 E219 L251	V211-Q215 WeakPolarHBondContact O-CG 2.96Å; V211-Q215 PolarHBondContact O-N 3.18Å; E212-Q215 PolarHBondContact O-N 3.31Å; M213-Q215 VanDerWaalsContact C-N 3.32Å; M213-Q215 PolarHBondContact O-N 3.11Å; Q215-L217 VanDerWaalsContact C-N 3.34Å; Q215-L217 PolarHBondContact O-N 3.4Å; Q215-M218 WeakPolarHBondContact O-CB 3.41Å; Q215-M218 PolarHBondContact O-N 3.15Å; Q215-E219 PolarHBondContact O-N 3.11Å; Q215-L251 HydrophobicContact CG-CD1 4.05Å; Q215-L251 HydrophobicContact CG-CD2 3.66Å
216	M	98.3	Very high	96.6	Very high	23 Å²	23	45.9 Å²	45.9	11%	0.113	24%	0.244	C	C	.	.	H	α-helix	trans	-55.2	-48.1	175.9	168.4	175.8	-78.3	0	0	111.7	T176 V179 E212 M213 M218 E219 Y222	T176-M216 HydrophobicContact CG2-CB 4.43Å; T176-M216 HydrophobicContact CG2-CE 3.9Å; T176-M216 HydrophobicContact CG2-SD 3.89Å; V179-M216 HydrophobicContact CB-SD 4.28Å; V179-M216 HydrophobicContact CG1-SD 4.29Å; E212-M216 WeakPolarHBondContact O-CB 3.45Å; E212-M216 PolarHBondContact O-N 2.91Å; M213-M216 PolarHBondContact O-N 3.37Å; M213-M216 HydrophobicContact SD-SD 4.39Å; M216-M218 PolarHBondContact O-N 2.83Å; M216-E219 WeakPolarHBondContact O-CB 3.41Å; M216-E219 PolarHBondContact O-N 3.35Å; M216-E219 VanDerWaalsContact O-N 3.12Å; M216-Y222 HydrophobicContact CE-CE2 4.41Å; M216-Y222 WeakPolarHBondContact CE-OH 3.35Å; M216-Y222 HydrophobicContact CG-CD1 4.14Å; M216-Y222 HydrophobicContact CG-CD2 3.86Å; M216-Y222 HydrophobicContact CG-CE1 3.91Å; M216-Y222 HydrophobicContact CG-CE2 3.58Å; M216-Y222 HydrophobicContact CG-CG 4.13Å; M216-Y222 WeakPolarHBondContact O-CD2 3.34Å; M216-Y222 HydrophobicContact SD-CE1 3.94Å; M216-Y222 HydrophobicContact SD-CE2 4.38Å
217	L	97.9	Very high	96.5	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-68.1	-23.4	-177.4	-66	173.3	0	0	0	113.2	V179 V201 F202 M213 L214 Q215 M224 A225	V179-L217 HydrophobicContact CG1-CD2 4.32Å; V201-L217 HydrophobicContact CG1-CD1 3.99Å; V201-L217 HydrophobicContact CG1-CD2 4.46Å; F202-L217 HydrophobicContact CB-CD1 4.2Å; F202-L217 HydrophobicContact CD2-CB 3.83Å; F202-L217 HydrophobicContact CD2-CD1 4.03Å; F202-L217 HydrophobicContact CE2-CB 4.43Å; M213-L217 HydrophobicContact CG-CD1 3.82Å; M213-L217 HydrophobicContact CG-CG 4.24Å; M213-L217 WeakPolarHBondContact O-CB 3.49Å; M213-L217 WeakPolarHBondContact O-CG 3.47Å; M213-L217 PolarHBondContact O-N 3.37Å; M213-L217 HydrophobicContact SD-CD1 4.12Å; M213-L217 HydrophobicContact SD-CD2 4.34Å; M213-L217 HydrophobicContact SD-CG 4.04Å; L214-L217 PolarHBondContact O-N 3.4Å; Q215-L217 VanDerWaalsContact C-N 3.34Å; Q215-L217 PolarHBondContact O-N 3.4Å; L217-M224 HydrophobicContact CB-CB 4.23Å; L217-M224 HydrophobicContact CD2-CB 3.87Å; L217-M224 HydrophobicContact CD2-CE 3.78Å; L217-M224 HydrophobicContact CD2-CG 4.43Å; L217-M224 HydrophobicContact CD2-SD 3.72Å; L217-M224 PolarHBondContact O-N 2.84Å; L217-A225 PolarHBondContact O-N 3.05Å
218	M	97.7	Very high	96.4	Very high	43 Å²	43	50.8 Å²	50.8	21%	0.212	27%	0.267	C	S	.	.	H	α-helix	trans	-78	-20.5	172.9	-69.1	170.5	-159.1	0	0	113.5	F202 L214 Q215 M216 A225 L251 L252 S255 F256	F202-M218 HydrophobicContact CE2-CE 3.67Å; F202-M218 HydrophobicContact CE2-CG 3.93Å; F202-M218 HydrophobicContact CZ-CE 3.54Å; F202-M218 HydrophobicContact CZ-CG 4.37Å; L214-M218 HydrophobicContact CB-CE 4.1Å; L214-M218 VanDerWaalsContact O-CG 3.23Å; L214-M218 WeakPolarHBondContact O-CG 3.37Å; L214-M218 PolarHBondContact O-N 3.27Å; L214-M218 VanDerWaalsContact O-N 3.11Å; Q215-M218 WeakPolarHBondContact O-CB 3.41Å; Q215-M218 PolarHBondContact O-N 3.15Å; M216-M218 PolarHBondContact O-N 2.83Å; M218-A225 HydrophobicContact CB-CB 4.26Å; M218-A225 HydrophobicContact CG-CB 3.65Å; M218-L251 HydrophobicContact CE-CD2 3.74Å; M218-L251 HydrophobicContact CE-CG 3.87Å; M218-L251 HydrophobicContact SD-CD1 4.46Å; M218-L251 HydrophobicContact SD-CD2 4.34Å; M218-L251 HydrophobicContact SD-CG 4.33Å; M218-L252 HydrophobicContact CE-CD2 4.04Å; M218-S255 PolarHBondContact SD-OG 3.48Å; M218-F256 HydrophobicContact CE-CE2 4.03Å
219	E	97.4	Very high	96.4	Very high	104 Å²	104	53.4 Å²	53.4	49%	0.486	28%	0.28	S	S	.	.	S	Bend	trans	-64	141.4	179.4	-66.4	173.3	-175.1	0	0	110.9	Q215 M216 A221 Y222 N223	Q215-E219 PolarHBondContact O-N 3.11Å; M216-E219 WeakPolarHBondContact O-CB 3.41Å; M216-E219 PolarHBondContact O-N 3.35Å; M216-E219 VanDerWaalsContact O-N 3.12Å; E219-A221 PolarHBondContact O-N 3.18Å; E219-Y222 HydrophobicContact CB-CD2 4.05Å; E219-Y222 PolarHBondContact O-N 3.44Å; E219-N223 PolarHBondContact O-N 3.27Å
220	E	94.2	Very high	96.2	Very high	174 Å²	174	53 Å²	53	81%	0.813	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-30.7	178.7	-69.5	-66.1	151.6	0	0	113.5	Y222	E220-Y222 VanDerWaalsContact C-N 3.26Å; E220-Y222 PolarHBondContact O-N 3.15Å
221	A	93.3	Very high	96	Very high	61 Å²	61	57.7 Å²	57.7	50%	0.504	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-30.1	179.3	0	0	0	0	0	112.5	Y184 E219	Y184-A221 WeakPolarHBondContact OH-CB 3.39Å; E219-A221 PolarHBondContact O-N 3.18Å
222	Y	95.8	Very high	95.7	Very high	17 Å²	17	60.6 Å²	60.6	7%	0.067	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-50.2	177.8	-62.7	-92.9	0	0	0	110.5	V179 T180 I183 Y184 K189 M216 E219 E220 M224	V179-Y222 HydrophobicContact CG1-CD1 4.43Å; V179-Y222 HydrophobicContact CG1-CE1 4.35Å; T180-Y222 PolarHBondContact OG1-OH 2.94Å; I183-Y222 HydrophobicContact CD1-CD1 3.44Å; I183-Y222 VanDerWaalsContact CD1-CD1 3.44Å; I183-Y222 HydrophobicContact CD1-CE1 3.92Å; Y184-Y222 AromaticContact CE2-CE1 3.96Å; Y184-Y222 HydrophobicContact CE2-CE1 3.96Å; Y184-Y222 AromaticContact CE2-CZ 3.87Å; K189-Y222 WeakPolarHBondContact CE-O 3.27Å; K189-Y222 PolarHBondContact NZ-O 3.32Å; M216-Y222 HydrophobicContact CE-CE2 4.41Å; M216-Y222 WeakPolarHBondContact CE-OH 3.35Å; M216-Y222 HydrophobicContact CG-CD1 4.14Å; M216-Y222 HydrophobicContact CG-CD2 3.86Å; M216-Y222 HydrophobicContact CG-CE1 3.91Å; M216-Y222 HydrophobicContact CG-CE2 3.58Å; M216-Y222 HydrophobicContact CG-CG 4.13Å; M216-Y222 WeakPolarHBondContact O-CD2 3.34Å; M216-Y222 HydrophobicContact SD-CE1 3.94Å; M216-Y222 HydrophobicContact SD-CE2 4.38Å; E219-Y222 HydrophobicContact CB-CD2 4.05Å; E219-Y222 PolarHBondContact O-N 3.44Å; E220-Y222 VanDerWaalsContact C-N 3.26Å; E220-Y222 PolarHBondContact O-N 3.15Å; Y222-M224 WeakPolarHBondContact O-CG 3.19Å
223	N	95.3	Very high	95.6	Very high	107 Å²	107	54.9 Å²	54.9	57%	0.572	28%	0.281	S	S	*	.			trans	47.2	65.3	-178.5	-173.7	18.9	0	0	0	111.7	K189 E219	K189-N223 PolarHBondContact NZ-O 3.39Å; E219-N223 PolarHBondContact O-N 3.27Å
224	M	95.9	Very high	95.5	Very high	8 Å²	8	56 Å²	56	4%	0.039	29%	0.287	C	S	.	.			trans	-130.9	3.1	-176.7	-70.1	170.9	68.6	0	0	112.7	M167 I183 D192 V201 L217 Y222	M167-M224 HydrophobicContact CE-CE 4.32Å; M167-M224 HydrophobicContact SD-CE 3.36Å; M167-M224 WeakPolarHBondContact SD-CE 3.24Å; I183-M224 HydrophobicContact CD1-SD 3.6Å; D192-M224 HydrophobicContact CB-CE 3.54Å; V201-M224 HydrophobicContact CB-CE 4.45Å; L217-M224 HydrophobicContact CB-CB 4.23Å; L217-M224 HydrophobicContact CD2-CB 3.87Å; L217-M224 HydrophobicContact CD2-CE 3.78Å; L217-M224 HydrophobicContact CD2-CG 4.43Å; L217-M224 HydrophobicContact CD2-SD 3.72Å; L217-M224 PolarHBondContact O-N 2.84Å; Y222-M224 WeakPolarHBondContact O-CG 3.19Å
225	A	96.4	Very high	95.5	Very high	30 Å²	30	56.2 Å²	56.2	25%	0.248	29%	0.289	C	S	.	.			trans	-74.5	133.5	176.5	0	0	0	0	0	110.9	F202 L217 M218 F256	F202-A225 HydrophobicContact CD2-CB 3.86Å; F202-A225 HydrophobicContact CE1-CB 4.43Å; F202-A225 HydrophobicContact CE2-CB 3.49Å; F202-A225 VanDerWaalsContact CE2-CB 3.49Å; F202-A225 HydrophobicContact CG-CB 4.46Å; F202-A225 HydrophobicContact CZ-CB 3.8Å; L217-A225 PolarHBondContact O-N 3.05Å; M218-A225 HydrophobicContact CB-CB 4.26Å; M218-A225 HydrophobicContact CG-CB 3.65Å; A225-F256 HydrophobicContact CB-CZ 3.94Å
226	T	94.6	Very high	95.4	Very high	28 Å²	28	51.6 Å²	51.6	17%	0.172	27%	0.267	C	S	.	.			trans	-149.7	146.7	-176.8	177	0	0	0	0	109.8	F202 E228 P236	F202-T226 HydrophobicContact CB-CG2 4.25Å; F202-T226 HydrophobicContact CD1-CG2 4.44Å; F202-T226 WeakPolarHBondContact CD1-O 3.01Å; F202-T226 WeakPolarHBondContact CE1-O 3.37Å; T226-E228 WeakPolarHBondContact OG1-CB 3.5Å; T226-E228 VanDerWaalsContact OG1-CG 3.24Å; T226-E228 WeakPolarHBondContact OG1-CG 3.41Å; T226-E228 PolarHBondContact OG1-N 3.2Å; T226-E228 VanDerWaalsContact OG1-N 3.13Å; T226-P236 WeakPolarHBondContact O-CG 3.44Å
227	M	95.6	Very high	95.5	Very high	33 Å²	33	50.7 Å²	50.7	16%	0.163	26%	0.263	C	S	.	.			trans	-107.8	17.2	172.1	-74.9	-67.2	175.1	0	0	112.1	F202 P236 L252 F256 T258	F202-M227 HydrophobicContact CE1-CE 4.45Å; M227-P236 HydrophobicContact SD-CB 4.14Å; M227-P236 HydrophobicContact SD-CG 4.04Å; M227-L252 HydrophobicContact CE-CB 3.94Å; M227-L252 HydrophobicContact CE-CD2 3.44Å; M227-L252 VanDerWaalsContact CE-CD2 3.44Å; M227-L252 HydrophobicContact CE-CG 4.14Å; M227-F256 HydrophobicContact CE-CB 3.82Å; M227-F256 HydrophobicContact CE-CD1 4.03Å; M227-F256 HydrophobicContact CE-CD2 3.12Å; M227-F256 HydrophobicContact CE-CE1 4.42Å; M227-F256 HydrophobicContact CE-CE2 3.6Å; M227-F256 HydrophobicContact CE-CG 3.37Å; M227-F256 HydrophobicContact CE-CZ 4.23Å; M227-F256 HydrophobicContact CG-CB 4.3Å; M227-F256 HydrophobicContact CG-CD1 3.57Å; M227-F256 HydrophobicContact CG-CD2 4.4Å; M227-F256 HydrophobicContact CG-CE1 3.93Å; M227-F256 HydrophobicContact CG-CG 3.83Å; M227-F256 HydrophobicContact CG-CZ 4.49Å; M227-F256 HydrophobicContact SD-CG 4.46Å; M227-T258 HydrophobicContact CB-CG2 4.44Å; M227-T258 HydrophobicContact CG-CG2 4.15Å
228	E	93.6	Very high	95.5	Very high	107 Å²	107	50.8 Å²	50.8	50%	0.5	26%	0.263	S	S	.	.			trans	-54.4	141.6	175.6	-77.7	172.4	176.2	0	0	111.5	R200 T226	R200-E228 IonicContact CZ-OE2 3.23Å; R200-E228 IonicContact NE-OE2 2.89Å; R200-E228 PolarHBondContact NE-OE2 3.46Å; R200-E228 IonicContact NH2-OE2 3.45Å; T226-E228 WeakPolarHBondContact OG1-CB 3.5Å; T226-E228 VanDerWaalsContact OG1-CG 3.24Å; T226-E228 WeakPolarHBondContact OG1-CG 3.41Å; T226-E228 PolarHBondContact OG1-N 3.2Å; T226-E228 VanDerWaalsContact OG1-N 3.13Å
229	E	94.4	Very high	95.5	Very high	108 Å²	108	49.2 Å²	49.2	51%	0.505	26%	0.256	S	S	.	.			trans	-76.5	143.1	177.7	-67.8	173.3	-155	0	0	111.5	T235	E229-T235 HydrophobicContact CG-CG2 3.99Å
230	D	92.6	Very high	95.5	Very high	12 Å²	12	44.2 Å²	44.2	6%	0.064	23%	0.232	C	C	.	.			trans	-78.6	-171.1	171.8	82.7	-7.8	0	0	0	112.8	H199 N232 G233 D234	H199-D230 VanDerWaalsContact CD2-CB 3.46Å; H199-D230 WeakPolarHBondContact CD2-CB 3.31Å; H199-D230 IonicContact CD2-OD2 2.93Å; H199-D230 IonicContact CE1-OD2 3.87Å; H199-D230 IonicContact NE2-OD2 3.89Å; H199-D230 PolarHBondContact NE2-OD2 3.26Å; D230-N232 PolarHBondContact O-N 3.17Å; D230-N232 VanDerWaalsContact O-N 3.14Å; D230-N232 VanDerWaalsContact OD1-CA 3.27Å; D230-N232 WeakPolarHBondContact OD1-CA 3.48Å; D230-N232 WeakPolarHBondContact OD1-CB 3.48Å; D230-N232 PolarHBondContact OD1-N 3.31Å; D230-G233 PolarHBondContact O-N 2.64Å; D230-G233 PolarHBondContact OD1-N 2.79Å; D230-D234 PolarHBondContact N-O 2.88Å; D230-D234 PolarHBondContact OD1-N 2.98Å
231	Q	91.3	Very high	95.7	Very high	107 Å²	107	36 Å²	36	50%	0.5	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-15.5	178.4	-68.8	178.1	18.5	0	0	114.5	L196 S197 K264	L196-Q231 PolarHBondContact O-NE2 3.03Å; L196-Q231 PolarHBondContact O-OE1 3.18Å; S197-Q231 WeakPolarHBondContact O-CB 3.4Å; S197-Q231 WeakPolarHBondContact O-CG 3.41Å; S197-Q231 PolarHBondContact O-N 3.46Å; S197-Q231 VanDerWaalsContact O-N 3.13Å; Q231-K264 WeakPolarHBondContact O-CE 3.38Å; Q231-K264 PolarHBondContact O-NZ 2.96Å
232	N	92.5	Very high	95.9	Very high	91 Å²	91	34 Å²	34	49%	0.487	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-2.8	174.1	-56.3	-52	0	0	0	112.8	D230 D234 K264	D230-N232 PolarHBondContact O-N 3.17Å; D230-N232 VanDerWaalsContact O-N 3.14Å; D230-N232 VanDerWaalsContact OD1-CA 3.27Å; D230-N232 WeakPolarHBondContact OD1-CA 3.48Å; D230-N232 WeakPolarHBondContact OD1-CB 3.48Å; D230-N232 PolarHBondContact OD1-N 3.31Å; N232-D234 VanDerWaalsContact C-N 3.32Å; N232-D234 WeakPolarHBondContact CB-OD2 3.43Å; N232-K264 WeakPolarHBondContact O-CB 3.44Å; N232-K264 VanDerWaalsContact O-CG 3.22Å; N232-K264 WeakPolarHBondContact O-CG 3.19Å; N232-K264 PolarHBondContact O-N 2.74Å
233	G	95.3	Very high	95.9	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.186	C	C	.	.	S	Bend	trans	84.9	6.9	-172	0	0	0	0	0	113	D230 N263	D230-G233 PolarHBondContact O-N 2.64Å; D230-G233 PolarHBondContact OD1-N 2.79Å; G233-N263 WeakPolarHBondContact O-CA 3.31Å; G233-N263 WeakPolarHBondContact O-CB 3.43Å
234	D	96.7	Very high	96	Very high	24 Å²	24	31.6 Å²	31.6	13%	0.128	17%	0.171	C	C	.	.			trans	-81	124.3	-177.7	-67.3	-46.7	0	0	0	109.7	D230 N232 H238 L239 N263	D230-D234 PolarHBondContact N-O 2.88Å; D230-D234 PolarHBondContact OD1-N 2.98Å; N232-D234 VanDerWaalsContact C-N 3.32Å; N232-D234 WeakPolarHBondContact CB-OD2 3.43Å; D234-H238 HydrophobicContact CB-CB 3.92Å; D234-L239 HydrophobicContact CB-CD2 3.9Å; D234-L239 HydrophobicContact CB-CG 4.24Å; D234-N263 VanDerWaalsContact OD1-CB 3.27Å; D234-N263 WeakPolarHBondContact OD1-CB 3.41Å; D234-N263 PolarHBondContact OD1-ND2 3.3Å
235	T	97.6	Very high	96.1	Very high	5 Å²	5	34 Å²	34	3%	0.031	18%	0.181	C	C	.	.			trans	-81.1	165.8	169.7	73.5	0	0	0	0	110.4	E229 L237 H238 L239	E229-T235 HydrophobicContact CG-CG2 3.99Å; T235-L237 PolarHBondContact O-N 2.81Å; T235-L237 VanDerWaalsContact O-N 3.08Å; T235-L237 PolarHBondContact OG1-N 3.31Å; T235-H238 PolarHBondContact N-ND1 2.88Å; T235-H238 VanDerWaalsContact N-ND1 3.18Å; T235-H238 WeakPolarHBondContact O-CA 3.22Å; T235-H238 VanDerWaalsContact O-CB 3.31Å; T235-H238 WeakPolarHBondContact O-CB 3.42Å; T235-H238 PolarHBondContact O-N 3.28Å; T235-H238 PolarHBondContact OG1-ND1 3.43Å; T235-L239 PolarHBondContact O-N 3.46Å; T235-L239 VanDerWaalsContact O-N 3.13Å
236	P	97.9	Very high	96.2	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.006	18%	0.181	C	C	.	.	H	α-helix	trans	-53.3	-32	173.8	-28.4	35.4	0	0	0	114.1	F202 A203 A206 T226 M227 L239 A240 L252	F202-P236 HydrophobicContact CD1-CB 4.23Å; F202-P236 HydrophobicContact CD1-CG 3.89Å; F202-P236 HydrophobicContact CE1-CB 4.13Å; F202-P236 HydrophobicContact CE1-CG 4.08Å; A203-P236 HydrophobicContact CB-CG 4.15Å; A206-P236 HydrophobicContact CB-CB 3.69Å; A206-P236 WeakPolarHBondContact CB-O 3.47Å; T226-P236 WeakPolarHBondContact O-CG 3.44Å; M227-P236 HydrophobicContact SD-CB 4.14Å; M227-P236 HydrophobicContact SD-CG 4.04Å; P236-L239 PolarHBondContact O-N 3.29Å; P236-A240 WeakPolarHBondContact O-CB 3.08Å; P236-A240 PolarHBondContact O-N 2.97Å; P236-L252 HydrophobicContact CB-CD1 4.29Å
237	L	98.4	Very high	96.4	Very high	4 Å²	4	38.2 Å²	38.2	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-67.1	-40.5	175.4	-176.4	63.3	0	0	0	111.8	T235 A241 V249 L252 L253 A269 L285	T235-L237 PolarHBondContact O-N 2.81Å; T235-L237 VanDerWaalsContact O-N 3.08Å; T235-L237 PolarHBondContact OG1-N 3.31Å; L237-A241 WeakPolarHBondContact O-CB 3.45Å; L237-A241 PolarHBondContact O-N 3.05Å; L237-V249 HydrophobicContact CD1-CB 4.5Å; L237-V249 HydrophobicContact CD1-CG1 4.13Å; L237-V249 HydrophobicContact CD1-CG2 4.48Å; L237-L252 HydrophobicContact CD1-CB 4.09Å; L237-L252 HydrophobicContact CD1-CD1 4.44Å; L237-L253 HydrophobicContact CD1-CD2 4.19Å; L237-L253 HydrophobicContact CD1-CG 4.08Å; L237-L253 HydrophobicContact CD2-CD2 3.84Å; L237-A269 HydrophobicContact CD2-CB 4.16Å; L237-A269 HydrophobicContact CG-CB 3.79Å; L237-L285 HydrophobicContact CD1-CD2 4.34Å; L237-L285 HydrophobicContact CD2-CD2 4.41Å
238	H	98.4	Very high	96.5	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.009	19%	0.191	C	C	.	.	H	α-helix	trans	-58.8	-49.3	173.5	-69	89.4	0	0	0	110.8	D234 T235 A241 S242 E261 E267 A269 L272	D234-H238 HydrophobicContact CB-CB 3.92Å; T235-H238 PolarHBondContact N-ND1 2.88Å; T235-H238 VanDerWaalsContact N-ND1 3.18Å; T235-H238 WeakPolarHBondContact O-CA 3.22Å; T235-H238 VanDerWaalsContact O-CB 3.31Å; T235-H238 WeakPolarHBondContact O-CB 3.42Å; T235-H238 PolarHBondContact O-N 3.28Å; T235-H238 PolarHBondContact OG1-ND1 3.43Å; H238-A241 PolarHBondContact O-N 3.45Å; H238-S242 WeakPolarHBondContact O-CB 3.4Å; H238-S242 PolarHBondContact O-N 3.1Å; H238-S242 PolarHBondContact O-OG 3.31Å; H238-E261 PolarHBondContact CE1-O 3.14Å; H238-E261 VanDerWaalsContact CE1-O 3.31Å; H238-E261 PolarHBondContact NE2-O 2.97Å; H238-E261 VanDerWaalsContact NE2-O 3.1Å; H238-E267 PolarHBondContact CD2-O 3.33Å; H238-E267 PolarHBondContact NE2-O 3.25Å; H238-A269 PolarHBondContact CD2-N 3.18Å; H238-A269 PolarHBondContact NE2-N 2.83Å; H238-L272 HydrophobicContact CB-CD1 3.75Å
239	L	97.3	Very high	96.7	Very high	10 Å²	10	31.6 Å²	31.6	5%	0.052	17%	0.167	C	C	.	.	H	α-helix	trans	-63.8	-43	-177.9	-60.2	175.3	0	0	0	112.4	A203 E207 D234 T235 P236 S242 N243	A203-L239 HydrophobicContact CB-CD1 4.05Å; E207-L239 HydrophobicContact CB-CB 3.95Å; E207-L239 HydrophobicContact CB-CD1 4.29Å; E207-L239 HydrophobicContact CG-CB 4.3Å; D234-L239 HydrophobicContact CB-CD2 3.9Å; D234-L239 HydrophobicContact CB-CG 4.24Å; T235-L239 PolarHBondContact O-N 3.46Å; T235-L239 VanDerWaalsContact O-N 3.13Å; P236-L239 PolarHBondContact O-N 3.29Å; L239-S242 PolarHBondContact O-OG 3.46Å; L239-S242 VanDerWaalsContact O-OG 3.11Å; L239-N243 PolarHBondContact O-N 3.12Å; L239-N243 PolarHBondContact O-ND2 3.39Å
240	A	98.2	Very high	96.9	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65.1	-43.7	176.4	0	0	0	0	0	111.7	A206 P236 N243 G244 H245 A248 V249 L252	A206-A240 HydrophobicContact CB-CB 4.3Å; A206-A240 WeakPolarHBondContact O-CA 3.36Å; P236-A240 WeakPolarHBondContact O-CB 3.08Å; P236-A240 PolarHBondContact O-N 2.97Å; A240-N243 PolarHBondContact O-N 2.89Å; A240-G244 PolarHBondContact O-N 2.81Å; A240-G244 VanDerWaalsContact O-N 3.14Å; A240-H245 PolarHBondContact O-N 3Å; A240-A248 HydrophobicContact CB-CB 4.06Å; A240-V249 HydrophobicContact CB-CG2 3.87Å; A240-L252 HydrophobicContact CB-CD1 4Å
241	A	98.3	Very high	97.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-68	-42.1	-179.4	0	0	0	0	0	112.3	L237 H238 N243 G244 V249 A269 A273 H278 L285	L237-A241 WeakPolarHBondContact O-CB 3.45Å; L237-A241 PolarHBondContact O-N 3.05Å; H238-A241 PolarHBondContact O-N 3.45Å; A241-N243 PolarHBondContact O-N 3.01Å; A241-G244 PolarHBondContact O-N 2.93Å; A241-V249 HydrophobicContact CB-CG2 4.06Å; A241-A269 HydrophobicContact CB-CB 3.88Å; A241-A269 WeakPolarHBondContact CB-O 3.16Å; A241-A273 HydrophobicContact CB-CB 4.18Å; A241-H278 PolarHBondContact O-CD2 3.31Å; A241-L285 HydrophobicContact CB-CD1 4.09Å
242	S	97.4	Very high	97.5	Very high	19 Å²	19	26.3 Å²	26.3	13%	0.133	14%	0.143	C	C	.	.	H	α-helix	trans	-67.5	-23.1	179.7	68.7	0	0	0	0	114	H238 L239 H278	H238-S242 WeakPolarHBondContact O-CB 3.4Å; H238-S242 PolarHBondContact O-N 3.1Å; H238-S242 PolarHBondContact O-OG 3.31Å; L239-S242 PolarHBondContact O-OG 3.46Å; L239-S242 VanDerWaalsContact O-OG 3.11Å; S242-H278 PolarHBondContact O-NE2 3.12Å
243	N	95.5	Very high	97.7	Very high	50 Å²	50	22.5 Å²	22.5	27%	0.267	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	0.9	177.9	-69.5	-74.2	0	0	0	113.2	L239 A240 A241	L239-N243 PolarHBondContact O-N 3.12Å; L239-N243 PolarHBondContact O-ND2 3.39Å; A240-N243 PolarHBondContact O-N 2.89Å; A241-N243 PolarHBondContact O-N 3.01Å
244	G	97.3	Very high	97.8	Very high	25 Å²	25	31.3 Å²	31.3	26%	0.258	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.2	26.2	172.4	0	0	0	0	0	114.8	A240 A241 L246 H278 C281	A240-G244 PolarHBondContact O-N 2.81Å; A240-G244 VanDerWaalsContact O-N 3.14Å; A241-G244 PolarHBondContact O-N 2.93Å; G244-L246 PolarHBondContact O-N 2.97Å; G244-L246 VanDerWaalsContact O-N 3.14Å; G244-H278 WeakPolarHBondContact CA-CD2 3.33Å; G244-H278 PolarHBondContact N-CD2 2.9Å; G244-H278 PolarHBondContact N-NE2 2.98Å; G244-C281 VanDerWaalsContact C-SG 3.54Å
245	H	98.1	Very high	97.8	Very high	57 Å²	57	33 Å²	33	26%	0.264	18%	0.175	S	C	.	.			trans	-86.8	78.2	-178.7	-62.8	-49.1	0	0	0	111.5	E207 H208 G209 A240 D247 A248 V249	E207-H245 PolarHBondContact O-CD2 3Å; E207-H245 PolarHBondContact O-NE2 3.26Å; H208-H245 VanDerWaalsContact C-NE2 3.32Å; G209-H245 PolarHBondContact N-CD2 3.13Å; G209-H245 PolarHBondContact N-NE2 2.85Å; A240-H245 PolarHBondContact O-N 3Å; H245-D247 PolarHBondContact O-N 2.96Å; H245-A248 HydrophobicContact CB-CB 3.96Å; H245-A248 WeakPolarHBondContact O-CB 3.44Å; H245-A248 PolarHBondContact O-N 3.36Å; H245-A248 VanDerWaalsContact O-N 3.11Å; H245-V249 WeakPolarHBondContact O-CG2 3.36Å; H245-V249 PolarHBondContact O-N 3.09Å
246	L	98.4	Very high	97.7	Very high	45 Å²	45	35.3 Å²	35.3	24%	0.236	18%	0.184	C	C	.	.	H	α-helix	trans	-48.9	-52.3	-176.3	176.3	64.2	0	0	0	113.5	G244 A248 V249 Q250 D280 A284	G244-L246 PolarHBondContact O-N 2.97Å; G244-L246 VanDerWaalsContact O-N 3.14Å; L246-A248 VanDerWaalsContact C-N 3.26Å; L246-A248 PolarHBondContact O-N 3.32Å; L246-V249 WeakPolarHBondContact O-CB 3.34Å; L246-V249 PolarHBondContact O-N 3.29Å; L246-V249 VanDerWaalsContact O-N 3.13Å; L246-Q250 HydrophobicContact CD1-CG 4.06Å; L246-Q250 HydrophobicContact CG-CG 4.41Å; L246-Q250 WeakPolarHBondContact O-CG 2.96Å; L246-Q250 PolarHBondContact O-N 2.94Å; L246-D280 HydrophobicContact CD1-CB 4.05Å; L246-D280 VanDerWaalsContact CD1-O 3.32Å; L246-D280 WeakPolarHBondContact CD1-O 3.41Å; L246-D280 HydrophobicContact CD2-CB 3.84Å; L246-D280 HydrophobicContact CG-CB 4.35Å; L246-A284 HydrophobicContact CD1-CB 3.75Å
247	D	98.5	Very high	97.4	Very high	102 Å²	102	42.4 Å²	42.4	55%	0.545	22%	0.222	S	C	.	.	H	α-helix	trans	-63.9	-35.3	-175.6	-63.4	-26.1	0	0	0	111.6	V211 H245 L251	V211-D247 HydrophobicContact CG2-CB 3.59Å; H245-D247 PolarHBondContact O-N 2.96Å; D247-L251 VanDerWaalsContact O-CB 3.31Å; D247-L251 WeakPolarHBondContact O-CB 3.35Å; D247-L251 PolarHBondContact O-N 2.95Å
248	A	98.4	Very high	96.9	Very high	1 Å²	1	43 Å²	43	1%	0.008	23%	0.226	C	C	.	.	H	α-helix	trans	-69.1	-44.4	173.7	0	0	0	0	0	110.9	V211 L214 A240 H245 L246 Q250 L251 L252	V211-A248 HydrophobicContact CG2-CB 4.36Å; L214-A248 HydrophobicContact CD1-CB 3.79Å; A240-A248 HydrophobicContact CB-CB 4.06Å; H245-A248 HydrophobicContact CB-CB 3.96Å; H245-A248 WeakPolarHBondContact O-CB 3.44Å; H245-A248 PolarHBondContact O-N 3.36Å; H245-A248 VanDerWaalsContact O-N 3.11Å; L246-A248 VanDerWaalsContact C-N 3.26Å; L246-A248 PolarHBondContact O-N 3.32Å; A248-Q250 PolarHBondContact O-N 3.21Å; A248-L251 PolarHBondContact O-N 2.98Å; A248-L252 WeakPolarHBondContact O-CB 3.42Å; A248-L252 WeakPolarHBondContact O-CG 3.49Å; A248-L252 PolarHBondContact O-N 2.88Å
249	V	98.6	Very high	96.6	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-56.5	-50.1	174.7	169.1	0	0	0	0	110.8	L237 A240 A241 H245 L246 L251 L252 L253 L285	L237-V249 HydrophobicContact CD1-CB 4.5Å; L237-V249 HydrophobicContact CD1-CG1 4.13Å; L237-V249 HydrophobicContact CD1-CG2 4.48Å; A240-V249 HydrophobicContact CB-CG2 3.87Å; A241-V249 HydrophobicContact CB-CG2 4.06Å; H245-V249 WeakPolarHBondContact O-CG2 3.36Å; H245-V249 PolarHBondContact O-N 3.09Å; L246-V249 WeakPolarHBondContact O-CB 3.34Å; L246-V249 PolarHBondContact O-N 3.29Å; L246-V249 VanDerWaalsContact O-N 3.13Å; V249-L251 PolarHBondContact O-N 3.47Å; V249-L252 PolarHBondContact O-N 3.42Å; V249-L253 HydrophobicContact CG1-CD1 3.61Å; V249-L253 HydrophobicContact CG1-CG 4.28Å; V249-L253 WeakPolarHBondContact O-CB 3.23Å; V249-L253 VanDerWaalsContact O-CG 3.24Å; V249-L253 WeakPolarHBondContact O-CG 3.49Å; V249-L253 PolarHBondContact O-N 3.42Å; V249-L285 HydrophobicContact CG1-CD2 4.11Å; V249-L285 HydrophobicContact CG1-CG 4Å
250	Q	98.4	Very high	96.6	Very high	92 Å²	92	48.2 Å²	48.2	43%	0.43	25%	0.249	S	C	.	.	H	α-helix	trans	-61.4	-42.3	178.8	-72.7	-178.8	-13.4	0	0	112.3	L246 A248 K254 A284	L246-Q250 HydrophobicContact CD1-CG 4.06Å; L246-Q250 HydrophobicContact CG-CG 4.41Å; L246-Q250 WeakPolarHBondContact O-CG 2.96Å; L246-Q250 PolarHBondContact O-N 2.94Å; A248-Q250 PolarHBondContact O-N 3.21Å; Q250-K254 VanDerWaalsContact O-CB 3.31Å; Q250-K254 WeakPolarHBondContact O-CB 3.38Å; Q250-K254 PolarHBondContact O-N 3.18Å; Q250-K254 VanDerWaalsContact O-N 3.08Å; Q250-A284 HydrophobicContact CG-CB 4.13Å
251	L	98.4	Very high	96.5	Very high	25 Å²	25	52.9 Å²	52.9	13%	0.131	27%	0.271	C	S	.	.	H	α-helix	trans	-61.9	-47.6	176.1	-179.7	67.9	0	0	0	111.1	V211 L214 Q215 M218 D247 A248 V249 K254 S255	V211-L251 HydrophobicContact CG1-CD2 4.08Å; L214-L251 HydrophobicContact CB-CD2 3.65Å; L214-L251 HydrophobicContact CD1-CD2 4.3Å; Q215-L251 HydrophobicContact CG-CD1 4.05Å; Q215-L251 HydrophobicContact CG-CD2 3.66Å; M218-L251 HydrophobicContact CE-CD2 3.74Å; M218-L251 HydrophobicContact CE-CG 3.87Å; M218-L251 HydrophobicContact SD-CD1 4.46Å; M218-L251 HydrophobicContact SD-CD2 4.34Å; M218-L251 HydrophobicContact SD-CG 4.33Å; D247-L251 VanDerWaalsContact O-CB 3.31Å; D247-L251 WeakPolarHBondContact O-CB 3.35Å; D247-L251 PolarHBondContact O-N 2.95Å; A248-L251 PolarHBondContact O-N 2.98Å; V249-L251 PolarHBondContact O-N 3.47Å; L251-K254 PolarHBondContact O-N 3.27Å; L251-S255 WeakPolarHBondContact O-CB 3.41Å; L251-S255 PolarHBondContact O-N 2.81Å; L251-S255 PolarHBondContact O-OG 3.42Å; L251-S255 VanDerWaalsContact O-OG 3.12Å
252	L	98.1	Very high	96.5	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65	-43.2	-178.8	-66.9	169.9	0	0	0	111.5	F202 A206 M218 M227 P236 L237 A240 A248 V249 K254 S255 F256	F202-L252 HydrophobicContact CE1-CD2 3.81Å; F202-L252 HydrophobicContact CZ-CD2 3.64Å; A206-L252 HydrophobicContact CB-CD1 4.08Å; M218-L252 HydrophobicContact CE-CD2 4.04Å; M227-L252 HydrophobicContact CE-CB 3.94Å; M227-L252 HydrophobicContact CE-CD2 3.44Å; M227-L252 VanDerWaalsContact CE-CD2 3.44Å; M227-L252 HydrophobicContact CE-CG 4.14Å; P236-L252 HydrophobicContact CB-CD1 4.29Å; L237-L252 HydrophobicContact CD1-CB 4.09Å; L237-L252 HydrophobicContact CD1-CD1 4.44Å; A240-L252 HydrophobicContact CB-CD1 4Å; A248-L252 WeakPolarHBondContact O-CB 3.42Å; A248-L252 WeakPolarHBondContact O-CG 3.49Å; A248-L252 PolarHBondContact O-N 2.88Å; V249-L252 PolarHBondContact O-N 3.42Å; L252-K254 VanDerWaalsContact C-N 3.27Å; L252-K254 PolarHBondContact O-N 2.66Å; L252-S255 PolarHBondContact O-N 3.25Å; L252-F256 HydrophobicContact CD2-CD2 4.46Å; L252-F256 HydrophobicContact CD2-CE2 4.35Å; L252-F256 WeakPolarHBondContact O-CB 3.39Å; L252-F256 PolarHBondContact O-N 2.96Å
253	L	97.4	Very high	96.5	Very high	10 Å²	10	55.4 Å²	55.4	5%	0.052	29%	0.285	C	S	.	.	H	α-helix	trans	-63.6	-31.7	176.7	-70.7	168.6	0	0	0	113.1	L237 V249 F256 R259 L285 A288	L237-L253 HydrophobicContact CD1-CD2 4.19Å; L237-L253 HydrophobicContact CD1-CG 4.08Å; L237-L253 HydrophobicContact CD2-CD2 3.84Å; V249-L253 HydrophobicContact CG1-CD1 3.61Å; V249-L253 HydrophobicContact CG1-CG 4.28Å; V249-L253 WeakPolarHBondContact O-CB 3.23Å; V249-L253 VanDerWaalsContact O-CG 3.24Å; V249-L253 WeakPolarHBondContact O-CG 3.49Å; V249-L253 PolarHBondContact O-N 3.42Å; L253-F256 VanDerWaalsContact O-O 3.08Å; L253-R259 PolarHBondContact O-NH1 3.49Å; L253-R259 PolarHBondContact O-NH2 3.35Å; L253-L285 HydrophobicContact CD1-CD2 3.91Å; L253-L285 HydrophobicContact CD1-CG 4.39Å; L253-L285 HydrophobicContact CD2-CD2 4.01Å; L253-L285 HydrophobicContact CG-CD2 4.38Å; L253-A288 HydrophobicContact CB-CB 4.41Å; L253-A288 HydrophobicContact CD1-CB 3.8Å; L253-A288 HydrophobicContact CD2-CB 4.06Å; L253-A288 HydrophobicContact CG-CB 4.32Å
254	K	97.1	Very high	96.6	Very high	186 Å²	186	58.8 Å²	58.8	81%	0.809	30%	0.298	S	S	*	.	H	α-helix	trans	-77.5	-38.6	176.9	-177.4	-179.3	177.1	-175.6	0	112.3	Q250 L251 L252	Q250-K254 VanDerWaalsContact O-CB 3.31Å; Q250-K254 WeakPolarHBondContact O-CB 3.38Å; Q250-K254 PolarHBondContact O-N 3.18Å; Q250-K254 VanDerWaalsContact O-N 3.08Å; L251-K254 PolarHBondContact O-N 3.27Å; L252-K254 VanDerWaalsContact C-N 3.27Å; L252-K254 PolarHBondContact O-N 2.66Å
255	S	96.7	Very high	96.6	Very high	59 Å²	59	62.4 Å²	62.4	41%	0.413	31%	0.31	S	S	.	.	H	α-helix	trans	-85.3	-22.8	-174.7	-64.6	0	0	0	0	113.2	M218 L251 L252	M218-S255 PolarHBondContact SD-OG 3.48Å; L251-S255 WeakPolarHBondContact O-CB 3.41Å; L251-S255 PolarHBondContact O-N 2.81Å; L251-S255 PolarHBondContact O-OG 3.42Å; L251-S255 VanDerWaalsContact O-OG 3.12Å; L252-S255 PolarHBondContact O-N 3.25Å
256	F	95.4	Very high	96.5	Very high	53 Å²	53	60.2 Å²	60.2	23%	0.232	30%	0.304	C	S	.	.	S	Bend	trans	-131.3	146	-176.7	-60.4	-93.7	0	0	0	111.8	F202 M218 A225 M227 L252 L253 T258 R259	F202-F256 HydrophobicContact CZ-CE2 4.02Å; F202-F256 HydrophobicContact CZ-CZ 4.2Å; M218-F256 HydrophobicContact CE-CE2 4.03Å; A225-F256 HydrophobicContact CB-CZ 3.94Å; M227-F256 HydrophobicContact CE-CB 3.82Å; M227-F256 HydrophobicContact CE-CD1 4.03Å; M227-F256 HydrophobicContact CE-CD2 3.12Å; M227-F256 HydrophobicContact CE-CE1 4.42Å; M227-F256 HydrophobicContact CE-CE2 3.6Å; M227-F256 HydrophobicContact CE-CG 3.37Å; M227-F256 HydrophobicContact CE-CZ 4.23Å; M227-F256 HydrophobicContact CG-CB 4.3Å; M227-F256 HydrophobicContact CG-CD1 3.57Å; M227-F256 HydrophobicContact CG-CD2 4.4Å; M227-F256 HydrophobicContact CG-CE1 3.93Å; M227-F256 HydrophobicContact CG-CG 3.83Å; M227-F256 HydrophobicContact CG-CZ 4.49Å; M227-F256 HydrophobicContact SD-CG 4.46Å; L252-F256 HydrophobicContact CD2-CD2 4.46Å; L252-F256 HydrophobicContact CD2-CE2 4.35Å; L252-F256 WeakPolarHBondContact O-CB 3.39Å; L252-F256 PolarHBondContact O-N 2.96Å; L253-F256 VanDerWaalsContact O-O 3.08Å; F256-T258 HydrophobicContact CB-CG2 4.34Å; F256-T258 PolarHBondContact O-N 3.31Å; F256-T258 VanDerWaalsContact O-N 3.11Å; F256-R259 PolarHBondContact O-NH1 3.23Å; F256-R259 VanDerWaalsContact O-NH1 3.12Å
257	D	91.9	Very high	96.5	Very high	151 Å²	151	59.9 Å²	59.9	81%	0.807	30%	0.301	S	S	*	.			trans	-86.3	47.5	174.7	-161.1	30.6	0	0	0	111.1
258	T	87.9	Confident	96.5	Very high	17 Å²	17	55.1 Å²	55.1	10%	0.104	28%	0.276	C	S	.	.			trans	-103.4	128.8	174.4	53	0	0	0	0	109	M227 F256 E261	M227-T258 HydrophobicContact CB-CG2 4.44Å; M227-T258 HydrophobicContact CG-CG2 4.15Å; F256-T258 HydrophobicContact CB-CG2 4.34Å; F256-T258 PolarHBondContact O-N 3.31Å; F256-T258 VanDerWaalsContact O-N 3.11Å; T258-E261 HydrophobicContact CG2-CG 4.45Å
259	R	91.8	Very high	96.5	Very high	63 Å²	63	55.2 Å²	55.2	24%	0.238	28%	0.276	C	S	.	.	S	Bend	trans	-132	-59.5	-178.9	-60.8	-64.4	178.4	-103.7	2.1	111	L253 F256 A288	L253-R259 PolarHBondContact O-NH1 3.49Å; L253-R259 PolarHBondContact O-NH2 3.35Å; F256-R259 PolarHBondContact O-NH1 3.23Å; F256-R259 VanDerWaalsContact O-NH1 3.12Å; R259-A288 WeakPolarHBondContact CD-O 3.5Å; R259-A288 PolarHBondContact NE-O 3.23Å
260	D	96.7	Very high	96.5	Very high	58 Å²	58	55.2 Å²	55.2	31%	0.31	28%	0.276	S	S	.	.	S	Bend	trans	-121	22.5	-164.1	-68.4	-36.7	0	0	0	113.2	C290 D291 I294	D260-C290 WeakPolarHBondContact OD1-CA 3.37Å; D260-D291 PolarHBondContact OD1-N 3.35Å; D260-I294 HydrophobicContact CB-CD1 3.41Å; D260-I294 VanDerWaalsContact CB-CD1 3.41Å
261	E	97	Very high	96.5	Very high	98 Å²	98	52 Å²	52	46%	0.458	26%	0.26	S	S	.	.			trans	-57.4	145.3	171.3	-60.5	-55.3	138.7	0	0	109.9	H238 T258	H238-E261 PolarHBondContact CE1-O 3.14Å; H238-E261 VanDerWaalsContact CE1-O 3.31Å; H238-E261 PolarHBondContact NE2-O 2.97Å; H238-E261 VanDerWaalsContact NE2-O 3.1Å; T258-E261 HydrophobicContact CG2-CG 4.45Å
262	V	97.6	Very high	96.5	Very high	62 Å²	62	52 Å²	52	38%	0.376	26%	0.26	S	S	.	.	B	Isolated β-bridge	trans	-122.8	137.1	-177.3	-68.5	0	0	0	0	111	E267 T268 I294	V262-E267 WeakPolarHBondContact CA-O 3.47Å; V262-T268 HydrophobicContact CG1-CG2 3.69Å; V262-I294 HydrophobicContact CG1-CG2 3.95Å
263	N	97.2	Very high	96.5	Very high	10 Å²	10	52 Å²	52	5%	0.053	26%	0.26	C	S	.	.			trans	-75.3	-175.2	174.1	75.3	8.3	0	0	0	112.4	G233 D234 L265 G266 E267	G233-N263 WeakPolarHBondContact O-CA 3.31Å; G233-N263 WeakPolarHBondContact O-CB 3.43Å; D234-N263 VanDerWaalsContact OD1-CB 3.27Å; D234-N263 WeakPolarHBondContact OD1-CB 3.41Å; D234-N263 PolarHBondContact OD1-ND2 3.3Å; N263-L265 PolarHBondContact O-N 2.65Å; N263-L265 WeakPolarHBondContact OD1-CA 3.41Å; N263-L265 WeakPolarHBondContact OD1-CB 3.46Å; N263-L265 PolarHBondContact OD1-N 3.45Å; N263-G266 PolarHBondContact O-N 3.43Å; N263-G266 PolarHBondContact OD1-N 3.29Å; N263-E267 PolarHBondContact N-O 2.91Å; N263-E267 PolarHBondContact ND2-OE2 3.14Å; N263-E267 WeakPolarHBondContact OD1-CB 3.39Å; N263-E267 PolarHBondContact OD1-N 3.11Å
264	K	97.3	Very high	96.5	Very high	121 Å²	121	51.5 Å²	51.5	53%	0.526	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-12.6	-179.8	-67.4	177.2	-173.5	-179.1	0	114.5	Q231 N232 M297	Q231-K264 WeakPolarHBondContact O-CE 3.38Å; Q231-K264 PolarHBondContact O-NZ 2.96Å; N232-K264 WeakPolarHBondContact O-CB 3.44Å; N232-K264 VanDerWaalsContact O-CG 3.22Å; N232-K264 WeakPolarHBondContact O-CG 3.19Å; N232-K264 PolarHBondContact O-N 2.74Å; K264-M297 WeakPolarHBondContact O-CE 3.34Å; K264-M297 VanDerWaalsContact O-SD 3.37Å
265	L	96.9	Very high	96.6	Very high	100 Å²	100	44.2 Å²	44.2	52%	0.524	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	2.5	173.6	-61	178.4	0	0	0	112.4	N263 E267 T296 M297	N263-L265 PolarHBondContact O-N 2.65Å; N263-L265 WeakPolarHBondContact OD1-CA 3.41Å; N263-L265 WeakPolarHBondContact OD1-CB 3.46Å; N263-L265 PolarHBondContact OD1-N 3.45Å; L265-E267 VanDerWaalsContact C-N 3.28Å; L265-E267 HydrophobicContact CB-CG 3.89Å; L265-T296 WeakPolarHBondContact O-CB 3.49Å; L265-M297 WeakPolarHBondContact O-CB 3.14Å; L265-M297 WeakPolarHBondContact O-CG 3.29Å; L265-M297 PolarHBondContact O-N 3.01Å
266	G	97.5	Very high	96.5	Very high	12 Å²	12	42.3 Å²	42.3	12%	0.124	22%	0.216	C	C	.	.	S	Bend	trans	75.2	16.6	-174.7	0	0	0	0	0	113.2	N263 T296	N263-G266 PolarHBondContact O-N 3.43Å; N263-G266 PolarHBondContact OD1-N 3.29Å; G266-T296 WeakPolarHBondContact O-CA 3.46Å
267	E	98.3	Very high	96.6	Very high	37 Å²	37	41.5 Å²	41.5	17%	0.173	22%	0.218	C	C	.	.			trans	-88.7	131	-177	-58.3	169.5	145.9	0	0	109.6	H238 V262 N263 L265 Y271 L272 T296	H238-E267 PolarHBondContact CD2-O 3.33Å; H238-E267 PolarHBondContact NE2-O 3.25Å; V262-E267 WeakPolarHBondContact CA-O 3.47Å; N263-E267 PolarHBondContact N-O 2.91Å; N263-E267 PolarHBondContact ND2-OE2 3.14Å; N263-E267 WeakPolarHBondContact OD1-CB 3.39Å; N263-E267 PolarHBondContact OD1-N 3.11Å; L265-E267 VanDerWaalsContact C-N 3.28Å; L265-E267 HydrophobicContact CB-CG 3.89Å; E267-Y271 HydrophobicContact CB-CD1 3.7Å; E267-Y271 HydrophobicContact CB-CE1 4.26Å; E267-Y271 HydrophobicContact CB-CG 4.42Å; E267-Y271 HydrophobicContact CG-CD1 3.63Å; E267-Y271 HydrophobicContact CG-CE1 3.66Å; E267-Y271 WeakPolarHBondContact OE1-CE1 3.43Å; E267-L272 HydrophobicContact CB-CD2 4.04Å; E267-L272 HydrophobicContact CB-CG 4.19Å; E267-L272 HydrophobicContact CG-CD2 4.47Å; E267-L272 WeakPolarHBondContact OE2-CD2 3.33Å; E267-T296 HydrophobicContact CB-CG2 4.35Å; E267-T296 HydrophobicContact CG-CG2 3.59Å
268	T	98.4	Very high	96.9	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.018	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-87	164.3	170	61.9	0	0	0	0	110.9	V262 L270 Y271 L272 I294	V262-T268 HydrophobicContact CG1-CG2 3.69Å; T268-L270 PolarHBondContact O-N 2.85Å; T268-Y271 WeakPolarHBondContact O-CB 3.46Å; T268-Y271 PolarHBondContact O-N 3.43Å; T268-Y271 VanDerWaalsContact O-N 3.09Å; T268-Y271 PolarHBondContact OG1-N 3.48Å; T268-Y271 VanDerWaalsContact OG1-N 3.1Å; T268-L272 WeakPolarHBondContact O-CG 3.21Å; T268-L272 PolarHBondContact O-N 2.93Å; T268-I294 HydrophobicContact CG2-CB 3.96Å; T268-I294 HydrophobicContact CG2-CD1 4.04Å; T268-I294 HydrophobicContact CG2-CG2 3.67Å
269	A	98.3	Very high	97.4	Very high	2 Å²	2	40 Å²	40	2%	0.017	21%	0.205	C	C	.	.	H	α-helix	trans	-55.4	-37.7	170.9	0	0	0	0	0	112.4	L237 H238 A241 L272 A273 L285	L237-A269 HydrophobicContact CD2-CB 4.16Å; L237-A269 HydrophobicContact CG-CB 3.79Å; H238-A269 PolarHBondContact CD2-N 3.18Å; H238-A269 PolarHBondContact NE2-N 2.83Å; A241-A269 HydrophobicContact CB-CB 3.88Å; A241-A269 WeakPolarHBondContact CB-O 3.16Å; A269-L272 PolarHBondContact O-N 3.39Å; A269-A273 WeakPolarHBondContact O-CB 3.17Å; A269-A273 PolarHBondContact O-N 3.19Å; A269-L285 HydrophobicContact CB-CD1 4.43Å; A269-L285 HydrophobicContact CB-CD2 4.27Å
270	L	98.6	Very high	97.7	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-63.6	-44.4	175.1	178.5	65	0	0	0	112	T268 A274 V282 L285 L286 C290 P292	T268-L270 PolarHBondContact O-N 2.85Å; L270-A274 VanDerWaalsContact O-CB 3.29Å; L270-A274 WeakPolarHBondContact O-CB 3.41Å; L270-A274 PolarHBondContact O-N 3.4Å; L270-V282 HydrophobicContact CD1-CB 4.37Å; L270-V282 HydrophobicContact CD1-CG1 3.87Å; L270-V282 HydrophobicContact CD1-CG2 4.45Å; L270-L285 HydrophobicContact CB-CB 4.43Å; L270-L285 HydrophobicContact CB-CD1 4.37Å; L270-L285 HydrophobicContact CD1-CB 3.88Å; L270-L285 HydrophobicContact CD1-CD1 4.46Å; L270-L286 HydrophobicContact CD1-CD2 4.06Å; L270-L286 HydrophobicContact CD1-CG 3.95Å; L270-L286 HydrophobicContact CD2-CD2 3.73Å; L270-C290 HydrophobicContact CB-CB 4.44Å; L270-C290 HydrophobicContact CD2-CB 4.2Å; L270-P292 HydrophobicContact CD2-CB 3.96Å
271	Y	98.5	Very high	97.8	Very high	25 Å²	25	39.7 Å²	39.7	10%	0.098	21%	0.209	C	C	.	.	H	α-helix	trans	-60.6	-46	175	176	-87.1	0	0	0	111.4	E267 T268 A274 D275 T296 P305	E267-Y271 HydrophobicContact CB-CD1 3.7Å; E267-Y271 HydrophobicContact CB-CE1 4.26Å; E267-Y271 HydrophobicContact CB-CG 4.42Å; E267-Y271 HydrophobicContact CG-CD1 3.63Å; E267-Y271 HydrophobicContact CG-CE1 3.66Å; E267-Y271 WeakPolarHBondContact OE1-CE1 3.43Å; T268-Y271 WeakPolarHBondContact O-CB 3.46Å; T268-Y271 PolarHBondContact O-N 3.43Å; T268-Y271 VanDerWaalsContact O-N 3.09Å; T268-Y271 PolarHBondContact OG1-N 3.48Å; T268-Y271 VanDerWaalsContact OG1-N 3.1Å; Y271-A274 PolarHBondContact O-N 3.37Å; Y271-D275 HydrophobicContact CE1-CB 4.37Å; Y271-D275 PolarHBondContact O-N 2.89Å; Y271-T296 HydrophobicContact CD1-CG2 4.04Å; Y271-T296 HydrophobicContact CD2-CG2 3.78Å; Y271-T296 HydrophobicContact CE1-CG2 3.85Å; Y271-T296 HydrophobicContact CE2-CG2 3.58Å; Y271-T296 HydrophobicContact CG-CG2 4.01Å; Y271-P305 HydrophobicContact CD2-CG 4.47Å; Y271-P305 HydrophobicContact CE2-CG 3.92Å
272	L	98.3	Very high	97.8	Very high	23 Å²	23	35 Å²	35	12%	0.12	19%	0.187	C	C	.	.	H	α-helix	trans	-64.3	-43.1	-179.6	-67.3	177.3	0	0	0	112.3	H238 E267 T268 A269 A274 D275 A276	H238-L272 HydrophobicContact CB-CD1 3.75Å; E267-L272 HydrophobicContact CB-CD2 4.04Å; E267-L272 HydrophobicContact CB-CG 4.19Å; E267-L272 HydrophobicContact CG-CD2 4.47Å; E267-L272 WeakPolarHBondContact OE2-CD2 3.33Å; T268-L272 WeakPolarHBondContact O-CG 3.21Å; T268-L272 PolarHBondContact O-N 2.93Å; A269-L272 PolarHBondContact O-N 3.39Å; L272-A274 VanDerWaalsContact C-N 3.32Å; L272-A274 PolarHBondContact O-N 3.15Å; L272-D275 PolarHBondContact O-N 3.38Å; L272-A276 WeakPolarHBondContact O-CB 3.35Å; L272-A276 PolarHBondContact O-N 2.89Å
273	A	98.4	Very high	97.9	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.1	-40.6	174.1	0	0	0	0	0	111.8	A241 A269 A276 A277 H278 C281 V282 L285	A241-A273 HydrophobicContact CB-CB 4.18Å; A269-A273 WeakPolarHBondContact O-CB 3.17Å; A269-A273 PolarHBondContact O-N 3.19Å; A273-A276 PolarHBondContact O-N 3.05Å; A273-A277 PolarHBondContact O-N 3.32Å; A273-H278 HydrophobicContact CB-CB 4.46Å; A273-H278 PolarHBondContact O-N 2.82Å; A273-C281 HydrophobicContact CB-CB 3.98Å; A273-V282 HydrophobicContact CB-CG2 3.76Å; A273-L285 HydrophobicContact CB-CD1 4.06Å
274	A	98	Very high	97.9	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-67.3	-43.8	176.8	0	0	0	0	0	112.1	L270 Y271 L272 A276 A277 V282 A302 V306	L270-A274 VanDerWaalsContact O-CB 3.29Å; L270-A274 WeakPolarHBondContact O-CB 3.41Å; L270-A274 PolarHBondContact O-N 3.4Å; Y271-A274 PolarHBondContact O-N 3.37Å; L272-A274 VanDerWaalsContact C-N 3.32Å; L272-A274 PolarHBondContact O-N 3.15Å; A274-A276 VanDerWaalsContact C-N 3.32Å; A274-A276 PolarHBondContact O-N 3.37Å; A274-A277 PolarHBondContact O-N 3.47Å; A274-A277 VanDerWaalsContact O-N 3.17Å; A274-V282 HydrophobicContact CB-CG2 4.09Å; A274-A302 HydrophobicContact CB-CB 4.1Å; A274-V306 HydrophobicContact CB-CG1 3.85Å; A274-V306 VanDerWaalsContact O-CG1 3.31Å; A274-V306 WeakPolarHBondContact O-CG1 3.31Å
275	D	97.7	Very high	98	Very high	33 Å²	33	29.4 Å²	29.4	18%	0.176	16%	0.159	C	C	.	.	H	α-helix	trans	-62.4	-40	175.7	-172.8	62.5	0	0	0	111.5	N26 Y271 L272 A277 P305 K309	N26-D275 PolarHBondContact ND2-OD2 2.93Å; Y271-D275 HydrophobicContact CE1-CB 4.37Å; Y271-D275 PolarHBondContact O-N 2.89Å; L272-D275 PolarHBondContact O-N 3.38Å; D275-A277 VanDerWaalsContact C-N 3.26Å; D275-A277 PolarHBondContact O-N 3.11Å; D275-P305 HydrophobicContact CB-CB 4.14Å; D275-P305 HydrophobicContact CB-CG 4.24Å; D275-P305 WeakPolarHBondContact OD1-CB 3.38Å; D275-K309 PolarHBondContact O-NZ 3.32Å; D275-K309 WeakPolarHBondContact OD1-CE 3.37Å; D275-K309 IonicContact OD1-NZ 2.72Å; D275-K309 PolarHBondContact OD1-NZ 2.79Å; D275-K309 IonicContact OD2-NZ 3.5Å; D275-K309 PolarHBondContact OD2-NZ 3.5Å
276	A	95.8	Very high	98.1	Very high	20 Å²	20	25.1 Å²	25.1	17%	0.165	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-1.7	177.8	0	0	0	0	0	114.3	L272 A273 A274 H278	L272-A276 WeakPolarHBondContact O-CB 3.35Å; L272-A276 PolarHBondContact O-N 2.89Å; A273-A276 PolarHBondContact O-N 3.05Å; A274-A276 VanDerWaalsContact C-N 3.32Å; A274-A276 PolarHBondContact O-N 3.37Å; A276-H278 WeakPolarHBondContact CB-CD2 3.47Å; A276-H278 WeakPolarHBondContact CB-NE2 3.45Å
277	A	97.2	Very high	98	Very high	35 Å²	35	31.1 Å²	31.1	29%	0.289	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.5	34.6	179.2	0	0	0	0	0	115.3	A273 A274 D275 E279 H311 L314	A273-A277 PolarHBondContact O-N 3.32Å; A274-A277 PolarHBondContact O-N 3.47Å; A274-A277 VanDerWaalsContact O-N 3.17Å; D275-A277 VanDerWaalsContact C-N 3.26Å; D275-A277 PolarHBondContact O-N 3.11Å; A277-E279 PolarHBondContact O-N 2.97Å; A277-H311 WeakPolarHBondContact CB-NE2 3.29Å; A277-L314 HydrophobicContact CB-CD1 4.19Å
278	H	97.9	Very high	98	Very high	45 Å²	45	30.8 Å²	30.8	21%	0.208	17%	0.165	C	C	.	.			trans	-88	81.9	177.4	-62.3	-49.5	0	0	0	111.4	A241 S242 G244 A273 A276 D280 C281 V282	A241-H278 PolarHBondContact O-CD2 3.31Å; S242-H278 PolarHBondContact O-NE2 3.12Å; G244-H278 WeakPolarHBondContact CA-CD2 3.33Å; G244-H278 PolarHBondContact N-CD2 2.9Å; G244-H278 PolarHBondContact N-NE2 2.98Å; A273-H278 HydrophobicContact CB-CB 4.46Å; A273-H278 PolarHBondContact O-N 2.82Å; A276-H278 WeakPolarHBondContact CB-CD2 3.47Å; A276-H278 WeakPolarHBondContact CB-NE2 3.45Å; H278-D280 PolarHBondContact O-N 3.1Å; H278-C281 HydrophobicContact CB-CB 3.99Å; H278-C281 PolarHBondContact O-N 2.91Å; H278-C281 VanDerWaalsContact O-N 3.13Å; H278-V282 WeakPolarHBondContact O-CG2 3.42Å; H278-V282 PolarHBondContact O-N 2.94Å
279	E	97.9	Very high	97.8	Very high	92 Å²	92	33.2 Å²	33.2	43%	0.43	19%	0.191	S	C	.	.	H	α-helix	trans	-53.2	-47.7	-174.7	-170.7	168.3	160.7	0	0	113.9	A277 C281 V282 Q283 S313 L314	A277-E279 PolarHBondContact O-N 2.97Å; E279-C281 VanDerWaalsContact C-N 3.3Å; E279-C281 PolarHBondContact O-N 3.31Å; E279-V282 PolarHBondContact O-N 3.35Å; E279-Q283 PolarHBondContact O-N 3.08Å; E279-S313 WeakPolarHBondContact OE1-CB 3.4Å; E279-S313 WeakPolarHBondContact OE2-CB 3.41Å; E279-L314 HydrophobicContact CB-CD2 4.1Å; E279-L314 HydrophobicContact CB-CG 4.46Å; E279-L314 HydrophobicContact CG-CD2 4.12Å
280	D	98.2	Very high	97.8	Very high	113 Å²	113	33.4 Å²	33.4	60%	0.604	19%	0.192	S	C	*	.	H	α-helix	trans	-64	-36.8	-179.5	-54.2	-38.9	0	0	0	112.3	L246 H278 Q283 A284	L246-D280 HydrophobicContact CD1-CB 4.05Å; L246-D280 VanDerWaalsContact CD1-O 3.32Å; L246-D280 WeakPolarHBondContact CD1-O 3.41Å; L246-D280 HydrophobicContact CD2-CB 3.84Å; L246-D280 HydrophobicContact CG-CB 4.35Å; H278-D280 PolarHBondContact O-N 3.1Å; D280-Q283 PolarHBondContact O-N 3.47Å; D280-A284 PolarHBondContact O-N 3.1Å
281	C	98.5	Very high	97.8	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.014	21%	0.207	C	C	.	.	H	α-helix	trans	-69.3	-41.5	176.6	-68.5	0	0	0	0	111.2	G244 A273 H278 E279 Q283 A284 L285	G244-C281 VanDerWaalsContact C-SG 3.54Å; A273-C281 HydrophobicContact CB-CB 3.98Å; H278-C281 HydrophobicContact CB-CB 3.99Å; H278-C281 PolarHBondContact O-N 2.91Å; H278-C281 VanDerWaalsContact O-N 3.13Å; E279-C281 VanDerWaalsContact C-N 3.3Å; E279-C281 PolarHBondContact O-N 3.31Å; C281-Q283 VanDerWaalsContact C-N 3.33Å; C281-Q283 PolarHBondContact O-N 3.12Å; C281-A284 PolarHBondContact O-N 2.91Å; C281-L285 WeakPolarHBondContact O-CB 3.44Å; C281-L285 WeakPolarHBondContact O-CD1 3.37Å; C281-L285 VanDerWaalsContact O-CG 3.23Å; C281-L285 WeakPolarHBondContact O-CG 3.39Å; C281-L285 PolarHBondContact O-N 3.08Å
282	V	98.6	Very high	97.7	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.9	-45.6	174.8	172.2	0	0	0	0	110.4	L270 A273 A274 H278 E279 A284 L285 L286 L314 L317 L318	L270-V282 HydrophobicContact CD1-CB 4.37Å; L270-V282 HydrophobicContact CD1-CG1 3.87Å; L270-V282 HydrophobicContact CD1-CG2 4.45Å; A273-V282 HydrophobicContact CB-CG2 3.76Å; A274-V282 HydrophobicContact CB-CG2 4.09Å; H278-V282 WeakPolarHBondContact O-CG2 3.42Å; H278-V282 PolarHBondContact O-N 2.94Å; E279-V282 PolarHBondContact O-N 3.35Å; V282-A284 PolarHBondContact O-N 3.3Å; V282-L285 PolarHBondContact O-N 2.84Å; V282-L286 HydrophobicContact CG1-CD1 3.69Å; V282-L286 HydrophobicContact CG1-CG 4.33Å; V282-L286 WeakPolarHBondContact O-CB 3.4Å; V282-L286 VanDerWaalsContact O-CG 3.26Å; V282-L286 WeakPolarHBondContact O-CG 3.45Å; V282-L286 PolarHBondContact O-N 2.9Å; V282-L314 HydrophobicContact CB-CD2 3.71Å; V282-L314 HydrophobicContact CG1-CD2 3.8Å; V282-L314 HydrophobicContact CG2-CD2 3.73Å; V282-L317 HydrophobicContact CB-CD2 4.35Å; V282-L317 HydrophobicContact CG1-CD2 3.82Å; V282-L317 HydrophobicContact CG1-CG 4.45Å; V282-L318 HydrophobicContact CG1-CD2 4.29Å
283	Q	98.5	Very high	97.7	Very high	67 Å²	67	35.6 Å²	35.6	31%	0.313	21%	0.206	S	C	.	.	H	α-helix	trans	-55.9	-53	175.4	-177.9	69.7	37.2	0	0	111.3	E279 D280 C281 L285 L286 E287 L317	E279-Q283 PolarHBondContact O-N 3.08Å; D280-Q283 PolarHBondContact O-N 3.47Å; C281-Q283 VanDerWaalsContact C-N 3.33Å; C281-Q283 PolarHBondContact O-N 3.12Å; Q283-L285 VanDerWaalsContact C-N 3.31Å; Q283-L285 PolarHBondContact O-N 2.91Å; Q283-L286 PolarHBondContact O-N 3.25Å; Q283-E287 PolarHBondContact NE2-OE1 3.33Å; Q283-E287 WeakPolarHBondContact O-CB 3.36Å; Q283-E287 WeakPolarHBondContact O-CG 3.42Å; Q283-E287 PolarHBondContact O-N 2.92Å; Q283-L317 HydrophobicContact CB-CD2 4.09Å
284	A	98.2	Very high	97.7	Very high	7 Å²	7	37.7 Å²	37.7	6%	0.058	22%	0.217	C	C	.	.	H	α-helix	trans	-62	-37.9	-178.5	0	0	0	0	0	112.9	L246 Q250 D280 C281 V282 A288	L246-A284 HydrophobicContact CD1-CB 3.75Å; Q250-A284 HydrophobicContact CG-CB 4.13Å; D280-A284 PolarHBondContact O-N 3.1Å; C281-A284 PolarHBondContact O-N 2.91Å; V282-A284 PolarHBondContact O-N 3.3Å; A284-A288 WeakPolarHBondContact O-CB 3.33Å; A284-A288 PolarHBondContact O-N 2.87Å
285	L	98.4	Very high	97.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-68	-42.2	177.8	-73.9	161.2	0	0	0	111.8	L237 A241 V249 L253 A269 L270 A273 C281 V282 Q283 A288 G289 C290	L237-L285 HydrophobicContact CD1-CD2 4.34Å; L237-L285 HydrophobicContact CD2-CD2 4.41Å; A241-L285 HydrophobicContact CB-CD1 4.09Å; V249-L285 HydrophobicContact CG1-CD2 4.11Å; V249-L285 HydrophobicContact CG1-CG 4Å; L253-L285 HydrophobicContact CD1-CD2 3.91Å; L253-L285 HydrophobicContact CD1-CG 4.39Å; L253-L285 HydrophobicContact CD2-CD2 4.01Å; L253-L285 HydrophobicContact CG-CD2 4.38Å; A269-L285 HydrophobicContact CB-CD1 4.43Å; A269-L285 HydrophobicContact CB-CD2 4.27Å; L270-L285 HydrophobicContact CB-CB 4.43Å; L270-L285 HydrophobicContact CB-CD1 4.37Å; L270-L285 HydrophobicContact CD1-CB 3.88Å; L270-L285 HydrophobicContact CD1-CD1 4.46Å; A273-L285 HydrophobicContact CB-CD1 4.06Å; C281-L285 WeakPolarHBondContact O-CB 3.44Å; C281-L285 WeakPolarHBondContact O-CD1 3.37Å; C281-L285 VanDerWaalsContact O-CG 3.23Å; C281-L285 WeakPolarHBondContact O-CG 3.39Å; C281-L285 PolarHBondContact O-N 3.08Å; V282-L285 PolarHBondContact O-N 2.84Å; Q283-L285 VanDerWaalsContact C-N 3.31Å; Q283-L285 PolarHBondContact O-N 2.91Å; L285-A288 PolarHBondContact O-N 3.04Å; L285-G289 PolarHBondContact O-N 3.44Å; L285-C290 HydrophobicContact CB-CB 4.46Å; L285-C290 WeakPolarHBondContact O-CB 3.32Å; L285-C290 PolarHBondContact O-N 3.45Å; L285-C290 VanDerWaalsContact O-N 3.11Å; L285-C290 PolarHBondContact O-SG 2.89Å
286	L	98.1	Very high	97.7	Very high	11 Å²	11	39 Å²	39	6%	0.058	23%	0.225	C	C	.	.	H	α-helix	trans	-66.4	-42.7	176	-67.8	168.3	0	0	0	111.7	L270 V282 Q283 A288 G289 P292 L317 L318 N321	L270-L286 HydrophobicContact CD1-CD2 4.06Å; L270-L286 HydrophobicContact CD1-CG 3.95Å; L270-L286 HydrophobicContact CD2-CD2 3.73Å; V282-L286 HydrophobicContact CG1-CD1 3.69Å; V282-L286 HydrophobicContact CG1-CG 4.33Å; V282-L286 WeakPolarHBondContact O-CB 3.4Å; V282-L286 VanDerWaalsContact O-CG 3.26Å; V282-L286 WeakPolarHBondContact O-CG 3.45Å; V282-L286 PolarHBondContact O-N 2.9Å; Q283-L286 PolarHBondContact O-N 3.25Å; L286-A288 PolarHBondContact O-N 3.06Å; L286-G289 WeakPolarHBondContact O-CA 3.21Å; L286-G289 PolarHBondContact O-N 3.18Å; L286-P292 HydrophobicContact CD2-CB 4.19Å; L286-P292 HydrophobicContact CD2-CG 4.23Å; L286-L317 HydrophobicContact CD1-CD1 4.16Å; L286-L317 HydrophobicContact CD1-CD2 4.21Å; L286-L317 HydrophobicContact CD1-CG 3.75Å; L286-L318 HydrophobicContact CD1-CD2 4.15Å; L286-L318 HydrophobicContact CD2-CD2 4.34Å; L286-N321 HydrophobicContact CB-CB 4.31Å; L286-N321 HydrophobicContact CD1-CB 3.99Å; L286-N321 HydrophobicContact CD2-CB 3.88Å; L286-N321 HydrophobicContact CG-CB 4.28Å
287	E	97.2	Very high	97.7	Very high	137 Å²	137	44.6 Å²	44.6	64%	0.64	25%	0.25	S	C	*	.	H	α-helix	trans	-61.6	-30.6	174.6	-74.4	176.8	179.1	0	0	112.7	Q283 G289	Q283-E287 PolarHBondContact NE2-OE1 3.33Å; Q283-E287 WeakPolarHBondContact O-CB 3.36Å; Q283-E287 WeakPolarHBondContact O-CG 3.42Å; Q283-E287 PolarHBondContact O-N 2.92Å; E287-G289 PolarHBondContact O-N 3.32Å
288	A	96.6	Very high	97.6	Very high	31 Å²	31	43.7 Å²	43.7	26%	0.256	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-2.7	174.1	0	0	0	0	0	114	L253 R259 A284 L285 L286	L253-A288 HydrophobicContact CB-CB 4.41Å; L253-A288 HydrophobicContact CD1-CB 3.8Å; L253-A288 HydrophobicContact CD2-CB 4.06Å; L253-A288 HydrophobicContact CG-CB 4.32Å; R259-A288 WeakPolarHBondContact CD-O 3.5Å; R259-A288 PolarHBondContact NE-O 3.23Å; A284-A288 WeakPolarHBondContact O-CB 3.33Å; A284-A288 PolarHBondContact O-N 2.87Å; L285-A288 PolarHBondContact O-N 3.04Å; L286-A288 PolarHBondContact O-N 3.06Å
289	G	95.9	Very high	97.5	Very high	54 Å²	54	46.4 Å²	46.4	56%	0.557	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.8	20.8	175	0	0	0	0	0	115.5	L285 L286 E287	L285-G289 PolarHBondContact O-N 3.44Å; L286-G289 WeakPolarHBondContact O-CA 3.21Å; L286-G289 PolarHBondContact O-N 3.18Å; E287-G289 PolarHBondContact O-N 3.32Å
290	C	97.5	Very high	97.5	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.034	24%	0.241	C	C	.	.			trans	-70.1	141.5	174.9	-52.9	0	0	0	0	111	D260 L270 L285 P292	D260-C290 WeakPolarHBondContact OD1-CA 3.37Å; L270-C290 HydrophobicContact CB-CB 4.44Å; L270-C290 HydrophobicContact CD2-CB 4.2Å; L285-C290 HydrophobicContact CB-CB 4.46Å; L285-C290 WeakPolarHBondContact O-CB 3.32Å; L285-C290 PolarHBondContact O-N 3.45Å; L285-C290 VanDerWaalsContact O-N 3.11Å; L285-C290 PolarHBondContact O-SG 2.89Å; C290-P292 WeakPolarHBondContact O-CD 3.46Å
291	D	97.8	Very high	97.5	Very high	62 Å²	62	37.4 Å²	37.4	33%	0.332	21%	0.213	S	C	.	.			trans	-84.6	115.4	-175.7	-176.3	3.9	0	0	0	112.1	D260 N293 I294	D260-D291 PolarHBondContact OD1-N 3.35Å; D291-N293 PolarHBondContact O-N 3.05Å; D291-N293 WeakPolarHBondContact OD1-CB 3.37Å; D291-N293 PolarHBondContact OD1-N 3.16Å; D291-N293 PolarHBondContact OD1-ND2 3.12Å; D291-I294 HydrophobicContact CB-CD1 4.01Å; D291-I294 HydrophobicContact CB-CG1 4.06Å
292	P	97.5	Very high	97.4	Very high	5 Å²	5	37.4 Å²	37.4	3%	0.032	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-8.5	177.3	30	-36	0	0	0	114.4	L270 L286 C290 L318 A323	L270-P292 HydrophobicContact CD2-CB 3.96Å; L286-P292 HydrophobicContact CD2-CB 4.19Å; L286-P292 HydrophobicContact CD2-CG 4.23Å; C290-P292 WeakPolarHBondContact O-CD 3.46Å; P292-L318 HydrophobicContact CB-CD2 3.82Å; P292-A323 HydrophobicContact CB-CB 3.94Å; P292-A323 HydrophobicContact CG-CB 3.99Å
293	N	97.9	Very high	97.4	Very high	29 Å²	29	37.4 Å²	37.4	16%	0.155	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-4.1	-174.6	-56.4	-59.5	0	0	0	113.8	D291 V295 T322 A323 Q324 L327	D291-N293 PolarHBondContact O-N 3.05Å; D291-N293 WeakPolarHBondContact OD1-CB 3.37Å; D291-N293 PolarHBondContact OD1-N 3.16Å; D291-N293 PolarHBondContact OD1-ND2 3.12Å; N293-V295 PolarHBondContact O-N 3.27Å; N293-T322 PolarHBondContact ND2-O 2.97Å; N293-A323 WeakPolarHBondContact OD1-CA 3.36Å; N293-Q324 WeakPolarHBondContact OD1-CB 3.27Å; N293-Q324 WeakPolarHBondContact OD1-CG 3.49Å; N293-Q324 PolarHBondContact OD1-N 2.9Å; N293-L327 HydrophobicContact CB-CD1 4.49Å
294	I	97.8	Very high	97.4	Very high	44 Å²	44	34.3 Å²	34.3	23%	0.226	20%	0.198	C	C	.	.			trans	-65.8	129.5	173.1	-62.2	171.9	0	0	0	108.6	D260 V262 T268 D291	D260-I294 HydrophobicContact CB-CD1 3.41Å; D260-I294 VanDerWaalsContact CB-CD1 3.41Å; V262-I294 HydrophobicContact CG1-CG2 3.95Å; T268-I294 HydrophobicContact CG2-CB 3.96Å; T268-I294 HydrophobicContact CG2-CD1 4.04Å; T268-I294 HydrophobicContact CG2-CG2 3.67Å; D291-I294 HydrophobicContact CB-CD1 4.01Å; D291-I294 HydrophobicContact CB-CG1 4.06Å
295	V	97.6	Very high	97.3	Very high	46 Å²	46	34.1 Å²	34.1	28%	0.279	20%	0.197	S	C	.	.			trans	-107.1	140.7	-173.7	-69	0	0	0	0	110.8	N293 S300 L327	N293-V295 PolarHBondContact O-N 3.27Å; V295-S300 WeakPolarHBondContact CA-O 3.38Å; V295-L327 HydrophobicContact CG1-CD1 4.14Å
296	T	97.8	Very high	97.3	Very high	13 Å²	13	34.1 Å²	34.1	8%	0.08	20%	0.197	C	C	.	.			trans	-66.7	174.5	173.4	68.9	0	0	0	0	112.2	L265 G266 E267 Y271 G298 Q299 S300	L265-T296 WeakPolarHBondContact O-CB 3.49Å; G266-T296 WeakPolarHBondContact O-CA 3.46Å; E267-T296 HydrophobicContact CB-CG2 4.35Å; E267-T296 HydrophobicContact CG-CG2 3.59Å; Y271-T296 HydrophobicContact CD1-CG2 4.04Å; Y271-T296 HydrophobicContact CD2-CG2 3.78Å; Y271-T296 HydrophobicContact CE1-CG2 3.85Å; Y271-T296 HydrophobicContact CE2-CG2 3.58Å; Y271-T296 HydrophobicContact CG-CG2 4.01Å; T296-G298 PolarHBondContact O-N 3.26Å; T296-G298 VanDerWaalsContact O-N 3.09Å; T296-G298 PolarHBondContact OG1-N 3.21Å; T296-Q299 WeakPolarHBondContact O-CA 3.23Å; T296-Q299 PolarHBondContact O-N 3.19Å; T296-S300 WeakPolarHBondContact CG2-O 3.45Å; T296-S300 PolarHBondContact N-O 3.43Å; T296-S300 WeakPolarHBondContact OG1-CB 3.42Å; T296-S300 PolarHBondContact OG1-N 2.9Å
297	M	96.5	Very high	97.3	Very high	139 Å²	139	33.6 Å²	33.6	69%	0.685	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-27.1	169.7	-72.9	-168.6	176.9	0	0	113.1	K264 L265 Q299	K264-M297 WeakPolarHBondContact O-CE 3.34Å; K264-M297 VanDerWaalsContact O-SD 3.37Å; L265-M297 WeakPolarHBondContact O-CB 3.14Å; L265-M297 WeakPolarHBondContact O-CG 3.29Å; L265-M297 PolarHBondContact O-N 3.01Å; M297-Q299 PolarHBondContact O-N 2.88Å
298	G	94.9	Very high	97.3	Very high	16 Å²	16	31 Å²	31	17%	0.165	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	10.4	173.2	0	0	0	0	0	114.5	T296 S300 Q330	T296-G298 PolarHBondContact O-N 3.26Å; T296-G298 VanDerWaalsContact O-N 3.09Å; T296-G298 PolarHBondContact OG1-N 3.21Å; G298-S300 PolarHBondContact O-N 3.38Å; G298-Q330 WeakPolarHBondContact O-CB 3.3Å; G298-Q330 PolarHBondContact O-N 3.45Å
299	Q	97.1	Very high	97.4	Very high	101 Å²	101	32.8 Å²	32.8	47%	0.472	18%	0.184	S	C	.	.	S	Bend	trans	58	26.4	-172.3	-61.7	-70.5	-14.6	0	0	113.1	T296 M297 N329	T296-Q299 WeakPolarHBondContact O-CA 3.23Å; T296-Q299 PolarHBondContact O-N 3.19Å; M297-Q299 PolarHBondContact O-N 2.88Å; Q299-N329 VanDerWaalsContact O-CA 3.32Å; Q299-N329 WeakPolarHBondContact O-CA 3.24Å
300	S	97.2	Very high	97.4	Very high	16 Å²	16	31 Å²	31	11%	0.112	17%	0.166	C	C	.	.			trans	-95.7	119.4	-176.5	-165.9	0	0	0	0	110	V295 T296 G298 H304	V295-S300 WeakPolarHBondContact CA-O 3.38Å; T296-S300 WeakPolarHBondContact CG2-O 3.45Å; T296-S300 PolarHBondContact N-O 3.43Å; T296-S300 WeakPolarHBondContact OG1-CB 3.42Å; T296-S300 PolarHBondContact OG1-N 2.9Å; G298-S300 PolarHBondContact O-N 3.38Å; S300-H304 WeakPolarHBondContact OG-CB 3.31Å
301	S	97.3	Very high	97.4	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.007	18%	0.177	C	C	.	.			trans	-82.5	172.1	169.9	70.6	0	0	0	0	111.8	L303 H304 P305	S301-L303 PolarHBondContact O-N 3.48Å; S301-L303 VanDerWaalsContact O-N 3.16Å; S301-H304 PolarHBondContact N-ND1 2.84Å; S301-H304 WeakPolarHBondContact O-CB 3.44Å; S301-H304 PolarHBondContact O-N 2.88Å; S301-H304 VanDerWaalsContact O-N 3.12Å; S301-H304 PolarHBondContact OG-CE1 3.33Å; S301-H304 PolarHBondContact OG-ND1 3.13Å; S301-P305 WeakPolarHBondContact O-CD 3.31Å
302	A	97.4	Very high	97.5	Very high	2 Å²	2	32.1 Å²	32.1	2%	0.017	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-27.5	177.3	0	0	0	0	0	113.6	A274 H304 P305 V306 L318	A274-A302 HydrophobicContact CB-CB 4.1Å; A302-H304 VanDerWaalsContact C-N 3.33Å; A302-H304 PolarHBondContact O-N 3.49Å; A302-P305 WeakPolarHBondContact O-CD 3.47Å; A302-V306 WeakPolarHBondContact O-CG2 3.5Å; A302-L318 HydrophobicContact CB-CD1 4.18Å; A302-L318 HydrophobicContact CB-CD2 4.06Å
303	L	97.9	Very high	97.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-73.1	-24	-180	-165	63.6	0	0	0	113.2	S301 V306 S307 V315 L318 I319 M325 P335 L351	S301-L303 PolarHBondContact O-N 3.48Å; S301-L303 VanDerWaalsContact O-N 3.16Å; L303-V306 HydrophobicContact CD1-CG2 4.08Å; L303-V306 VanDerWaalsContact O-CG2 3.24Å; L303-V306 WeakPolarHBondContact O-CG2 3.49Å; L303-S307 VanDerWaalsContact O-CB 3.23Å; L303-S307 WeakPolarHBondContact O-CB 3.46Å; L303-S307 PolarHBondContact O-N 3.03Å; L303-S307 VanDerWaalsContact O-N 3.13Å; L303-S307 PolarHBondContact O-OG 2.89Å; L303-V315 HydrophobicContact CD1-CB 4.37Å; L303-V315 HydrophobicContact CD1-CG1 4.19Å; L303-V315 HydrophobicContact CD1-CG2 4.23Å; L303-L318 HydrophobicContact CB-CD1 4.48Å; L303-L318 HydrophobicContact CD1-CB 3.99Å; L303-L318 HydrophobicContact CD1-CD1 4.02Å; L303-I319 HydrophobicContact CD1-CG1 4.46Å; L303-M325 HydrophobicContact CD2-CB 4.28Å; L303-M325 HydrophobicContact CD2-CG 4.02Å; L303-P335 HydrophobicContact CB-CG 4.12Å; L303-P335 HydrophobicContact CD2-CB 4.06Å; L303-P335 HydrophobicContact CD2-CG 3.91Å; L303-P335 HydrophobicContact CG-CB 3.97Å; L303-P335 HydrophobicContact CG-CG 3.98Å; L303-L351 HydrophobicContact CD2-CD2 4.22Å
304	H	98.4	Very high	97.5	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-65.4	-58.5	-179.5	-71.3	79.4	0	0	0	113.1	S300 S301 A302 V306 S307 E308 L327 N329 Q333 L338	S300-H304 WeakPolarHBondContact OG-CB 3.31Å; S301-H304 PolarHBondContact N-ND1 2.84Å; S301-H304 WeakPolarHBondContact O-CB 3.44Å; S301-H304 PolarHBondContact O-N 2.88Å; S301-H304 VanDerWaalsContact O-N 3.12Å; S301-H304 PolarHBondContact OG-CE1 3.33Å; S301-H304 PolarHBondContact OG-ND1 3.13Å; A302-H304 VanDerWaalsContact C-N 3.33Å; A302-H304 PolarHBondContact O-N 3.49Å; H304-V306 VanDerWaalsContact C-N 3.33Å; H304-V306 PolarHBondContact O-N 3.26Å; H304-S307 PolarHBondContact O-N 3.35Å; H304-E308 WeakPolarHBondContact O-CB 3.25Å; H304-E308 PolarHBondContact O-N 3.13Å; H304-L327 PolarHBondContact CE1-O 3.35Å; H304-L327 VanDerWaalsContact CE1-O 3.32Å; H304-L327 PolarHBondContact NE2-O 2.95Å; H304-N329 PolarHBondContact NE2-N 3.44Å; H304-Q333 PolarHBondContact NE2-O 3.29Å; H304-L338 HydrophobicContact CB-CD1 3.98Å
305	P	97.5	Very high	97.5	Very high	4 Å²	4	31.5 Å²	31.5	3%	0.026	17%	0.173	C	C	.	.	H	α-helix	trans	-64.8	-36.3	-176.4	25.5	-35.1	0	0	0	112.2	Y271 D275 S301 A302 S307 E308 K309	Y271-P305 HydrophobicContact CD2-CG 4.47Å; Y271-P305 HydrophobicContact CE2-CG 3.92Å; D275-P305 HydrophobicContact CB-CB 4.14Å; D275-P305 HydrophobicContact CB-CG 4.24Å; D275-P305 WeakPolarHBondContact OD1-CB 3.38Å; S301-P305 WeakPolarHBondContact O-CD 3.31Å; A302-P305 WeakPolarHBondContact O-CD 3.47Å; P305-S307 VanDerWaalsContact C-N 3.32Å; P305-S307 PolarHBondContact O-N 3.3Å; P305-E308 PolarHBondContact O-N 3Å; P305-K309 WeakPolarHBondContact O-CB 3.36Å; P305-K309 WeakPolarHBondContact O-CG 3.42Å; P305-K309 PolarHBondContact O-N 3.01Å
306	V	97.8	Very high	97.5	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-67.4	-34	177.2	-59.5	0	0	0	0	112.2	A274 A302 L303 H304 G310 H311 L314 V315 L318	A274-V306 HydrophobicContact CB-CG1 3.85Å; A274-V306 VanDerWaalsContact O-CG1 3.31Å; A274-V306 WeakPolarHBondContact O-CG1 3.31Å; A302-V306 WeakPolarHBondContact O-CG2 3.5Å; L303-V306 HydrophobicContact CD1-CG2 4.08Å; L303-V306 VanDerWaalsContact O-CG2 3.24Å; L303-V306 WeakPolarHBondContact O-CG2 3.49Å; H304-V306 VanDerWaalsContact C-N 3.33Å; H304-V306 PolarHBondContact O-N 3.26Å; V306-G310 PolarHBondContact O-N 3.34Å; V306-H311 HydrophobicContact CB-CB 4.24Å; V306-H311 PolarHBondContact O-N 3.12Å; V306-L314 HydrophobicContact CB-CB 4.14Å; V306-L314 HydrophobicContact CG1-CB 3.87Å; V306-L314 HydrophobicContact CG1-CD1 3.83Å; V306-L314 HydrophobicContact CG1-CG 4.46Å; V306-V315 HydrophobicContact CB-CG2 4.27Å; V306-V315 HydrophobicContact CG2-CG2 3.69Å; V306-L318 HydrophobicContact CG1-CD1 4.42Å; V306-L318 HydrophobicContact CG2-CD1 3.77Å
307	S	98.2	Very high	97.5	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-73.9	-37.9	175.6	-61.2	0	0	0	0	111.8	L303 H304 P305 P335 A339	L303-S307 VanDerWaalsContact O-CB 3.23Å; L303-S307 WeakPolarHBondContact O-CB 3.46Å; L303-S307 PolarHBondContact O-N 3.03Å; L303-S307 VanDerWaalsContact O-N 3.13Å; L303-S307 PolarHBondContact O-OG 2.89Å; H304-S307 PolarHBondContact O-N 3.35Å; P305-S307 VanDerWaalsContact C-N 3.32Å; P305-S307 PolarHBondContact O-N 3.3Å; S307-P335 WeakPolarHBondContact CB-O 3.27Å; S307-A339 WeakPolarHBondContact O-CA 3.43Å
308	E	97.8	Very high	97.6	Very high	83 Å²	83	27.3 Å²	27.3	39%	0.388	15%	0.146	S	C	.	.	H	α-helix	trans	-64.7	-38.3	175.8	-169.5	175.4	-165.3	0	0	112.5	H304 P305 L338 N342 H344	H304-E308 WeakPolarHBondContact O-CB 3.25Å; H304-E308 PolarHBondContact O-N 3.13Å; P305-E308 PolarHBondContact O-N 3Å; E308-L338 HydrophobicContact CB-CB 4.03Å; E308-L338 HydrophobicContact CB-CD1 4.25Å; E308-L338 HydrophobicContact CG-CB 4.43Å; E308-N342 WeakPolarHBondContact CG-ND2 3.44Å; E308-N342 PolarHBondContact O-ND2 2.9Å; E308-H344 PolarHBondContact O-CD2 3.36Å; E308-H344 PolarHBondContact O-NE2 3.4Å
309	K	97.1	Very high	97.7	Very high	67 Å²	67	28.4 Å²	28.4	29%	0.291	15%	0.148	S	C	.	.	H	α-helix	trans	-91.9	-11.7	-178.1	-63.8	176.6	-168.9	178.8	0	114.1	D275 P305 H311	D275-K309 PolarHBondContact O-NZ 3.32Å; D275-K309 WeakPolarHBondContact OD1-CE 3.37Å; D275-K309 IonicContact OD1-NZ 2.72Å; D275-K309 PolarHBondContact OD1-NZ 2.79Å; D275-K309 IonicContact OD2-NZ 3.5Å; D275-K309 PolarHBondContact OD2-NZ 3.5Å; P305-K309 WeakPolarHBondContact O-CB 3.36Å; P305-K309 WeakPolarHBondContact O-CG 3.42Å; P305-K309 PolarHBondContact O-N 3.01Å; K309-H311 WeakPolarHBondContact CB-NE2 3.27Å
310	G	97.2	Very high	97.7	Very high	18 Å²	18	30.5 Å²	30.5	19%	0.186	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.3	20.2	174	0	0	0	0	0	115.8	V306 T312 H344	V306-G310 PolarHBondContact O-N 3.34Å; G310-T312 PolarHBondContact O-N 2.95Å; G310-T312 PolarHBondContact O-OG1 3.45Å; G310-H344 VanDerWaalsContact CA-CD2 3.48Å; G310-H344 WeakPolarHBondContact CA-CD2 3.41Å; G310-H344 PolarHBondContact N-CD2 2.98Å; G310-H344 PolarHBondContact N-NE2 3.48Å
311	H	97.8	Very high	97.7	Very high	55 Å²	55	32.2 Å²	32.2	26%	0.255	17%	0.166	S	C	.	.			trans	-77.8	86.6	-177.9	-60.4	-58.4	0	0	0	111.6	A277 V306 K309 S313 L314 V315	A277-H311 WeakPolarHBondContact CB-NE2 3.29Å; V306-H311 HydrophobicContact CB-CB 4.24Å; V306-H311 PolarHBondContact O-N 3.12Å; K309-H311 WeakPolarHBondContact CB-NE2 3.27Å; H311-S313 PolarHBondContact O-N 3.42Å; H311-L314 HydrophobicContact CB-CB 4.05Å; H311-L314 HydrophobicContact CB-CD1 3.93Å; H311-L314 HydrophobicContact CB-CG 4.36Å; H311-L314 PolarHBondContact O-N 2.92Å; H311-V315 WeakPolarHBondContact O-CG2 3.41Å; H311-V315 PolarHBondContact O-N 3.35Å
312	T	97.9	Very high	97.6	Very high	34 Å²	34	37.4 Å²	37.4	21%	0.209	20%	0.198	C	C	.	.	H	α-helix	trans	-65.1	-38.5	-170.4	-53.1	0	0	0	0	113.5	G310 V315 K316 P346 V347	G310-T312 PolarHBondContact O-N 2.95Å; G310-T312 PolarHBondContact O-OG1 3.45Å; T312-V315 PolarHBondContact O-N 3.34Å; T312-K316 WeakPolarHBondContact O-CG 3.48Å; T312-K316 PolarHBondContact O-N 3.08Å; T312-K316 VanDerWaalsContact O-N 3.08Å; T312-P346 HydrophobicContact CG2-CB 3.95Å; T312-P346 WeakPolarHBondContact OG1-CB 3.45Å; T312-V347 WeakPolarHBondContact OG1-CG2 3.29Å
313	S	97.8	Very high	97.6	Very high	63 Å²	63	37.8 Å²	37.8	44%	0.441	20%	0.2	S	C	.	.	H	α-helix	trans	-62.2	-46.2	176.6	-50.6	0	0	0	0	111.5	E279 H311 V315 K316 L317	E279-S313 WeakPolarHBondContact OE1-CB 3.4Å; E279-S313 WeakPolarHBondContact OE2-CB 3.41Å; H311-S313 PolarHBondContact O-N 3.42Å; S313-V315 VanDerWaalsContact C-N 3.35Å; S313-V315 PolarHBondContact O-N 2.7Å; S313-K316 WeakPolarHBondContact O-CB 3.37Å; S313-K316 PolarHBondContact O-N 3.23Å; S313-L317 WeakPolarHBondContact O-CB 3.16Å; S313-L317 PolarHBondContact O-N 3.27Å
314	L	98.3	Very high	97.5	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-62.9	-38.2	176.4	-77.2	175.9	0	0	0	112.9	A277 E279 V282 V306 H311 L317 L318	A277-L314 HydrophobicContact CB-CD1 4.19Å; E279-L314 HydrophobicContact CB-CD2 4.1Å; E279-L314 HydrophobicContact CB-CG 4.46Å; E279-L314 HydrophobicContact CG-CD2 4.12Å; V282-L314 HydrophobicContact CB-CD2 3.71Å; V282-L314 HydrophobicContact CG1-CD2 3.8Å; V282-L314 HydrophobicContact CG2-CD2 3.73Å; V306-L314 HydrophobicContact CB-CB 4.14Å; V306-L314 HydrophobicContact CG1-CB 3.87Å; V306-L314 HydrophobicContact CG1-CD1 3.83Å; V306-L314 HydrophobicContact CG1-CG 4.46Å; H311-L314 HydrophobicContact CB-CB 4.05Å; H311-L314 HydrophobicContact CB-CD1 3.93Å; H311-L314 HydrophobicContact CB-CG 4.36Å; H311-L314 PolarHBondContact O-N 2.92Å; L314-L317 HydrophobicContact CD2-CD2 4.45Å; L314-L317 PolarHBondContact O-N 3.17Å; L314-L318 WeakPolarHBondContact O-CB 3.46Å; L314-L318 VanDerWaalsContact O-CG 3.29Å; L314-L318 WeakPolarHBondContact O-CG 3.35Å; L314-L318 PolarHBondContact O-N 3.24Å
315	V	98.4	Very high	97.5	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.5	-47.3	174.1	168	0	0	0	0	110.7	L303 V306 H311 T312 S313 L318 I319 V347 T350 L351	L303-V315 HydrophobicContact CD1-CB 4.37Å; L303-V315 HydrophobicContact CD1-CG1 4.19Å; L303-V315 HydrophobicContact CD1-CG2 4.23Å; V306-V315 HydrophobicContact CB-CG2 4.27Å; V306-V315 HydrophobicContact CG2-CG2 3.69Å; H311-V315 WeakPolarHBondContact O-CG2 3.41Å; H311-V315 PolarHBondContact O-N 3.35Å; T312-V315 PolarHBondContact O-N 3.34Å; S313-V315 VanDerWaalsContact C-N 3.35Å; S313-V315 PolarHBondContact O-N 2.7Å; V315-L318 PolarHBondContact O-N 3.2Å; V315-I319 HydrophobicContact CG1-CD1 3.68Å; V315-I319 WeakPolarHBondContact O-CD1 3.36Å; V315-I319 WeakPolarHBondContact O-CG1 3.33Å; V315-I319 PolarHBondContact O-N 3.39Å; V315-V347 HydrophobicContact CG1-CG1 4.37Å; V315-V347 HydrophobicContact CG2-CG1 3.93Å; V315-V347 HydrophobicContact CG2-CG2 4.14Å; V315-T350 HydrophobicContact CG1-CG2 3.96Å; V315-L351 HydrophobicContact CG1-CD2 4.11Å; V315-L351 HydrophobicContact CG1-CG 4.15Å
316	K	98.1	Very high	97.4	Very high	99 Å²	99	47.3 Å²	47.3	43%	0.43	25%	0.247	S	C	.	.	H	α-helix	trans	-59.5	-49.2	176.4	-70.7	179	178.1	-175.8	0	111.2	T312 S313 L318 I319 E320 T350	T312-K316 WeakPolarHBondContact O-CG 3.48Å; T312-K316 PolarHBondContact O-N 3.08Å; T312-K316 VanDerWaalsContact O-N 3.08Å; S313-K316 WeakPolarHBondContact O-CB 3.37Å; S313-K316 PolarHBondContact O-N 3.23Å; K316-L318 PolarHBondContact O-N 3.35Å; K316-I319 PolarHBondContact O-N 3.23Å; K316-E320 WeakPolarHBondContact O-CB 3.44Å; K316-E320 VanDerWaalsContact O-CG 3.3Å; K316-E320 WeakPolarHBondContact O-CG 3.49Å; K316-E320 PolarHBondContact O-N 2.99Å; K316-T350 HydrophobicContact CG-CG2 3.52Å
317	L	97.8	Very high	97.4	Very high	11 Å²	11	49.3 Å²	49.3	6%	0.058	26%	0.258	C	S	.	.	H	α-helix	trans	-58.9	-44.9	-178.3	177.1	56.2	0	0	0	112.6	V282 Q283 L286 S313 L314 E320 N321	V282-L317 HydrophobicContact CB-CD2 4.35Å; V282-L317 HydrophobicContact CG1-CD2 3.82Å; V282-L317 HydrophobicContact CG1-CG 4.45Å; Q283-L317 HydrophobicContact CB-CD2 4.09Å; L286-L317 HydrophobicContact CD1-CD1 4.16Å; L286-L317 HydrophobicContact CD1-CD2 4.21Å; L286-L317 HydrophobicContact CD1-CG 3.75Å; S313-L317 WeakPolarHBondContact O-CB 3.16Å; S313-L317 PolarHBondContact O-N 3.27Å; L314-L317 HydrophobicContact CD2-CD2 4.45Å; L314-L317 PolarHBondContact O-N 3.17Å; L317-E320 PolarHBondContact O-N 3.47Å; L317-N321 WeakPolarHBondContact CD1-ND2 3.47Å; L317-N321 PolarHBondContact O-N 3.01Å; L317-N321 VanDerWaalsContact O-N 3.15Å; L317-N321 PolarHBondContact O-ND2 3.42Å
318	L	98.1	Very high	97.3	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65.9	-41.8	177.7	-73.3	168.1	0	0	0	111.9	V282 L286 P292 A302 L303 V306 L314 V315 K316 N321 T322 A323	V282-L318 HydrophobicContact CG1-CD2 4.29Å; L286-L318 HydrophobicContact CD1-CD2 4.15Å; L286-L318 HydrophobicContact CD2-CD2 4.34Å; P292-L318 HydrophobicContact CB-CD2 3.82Å; A302-L318 HydrophobicContact CB-CD1 4.18Å; A302-L318 HydrophobicContact CB-CD2 4.06Å; L303-L318 HydrophobicContact CB-CD1 4.48Å; L303-L318 HydrophobicContact CD1-CB 3.99Å; L303-L318 HydrophobicContact CD1-CD1 4.02Å; V306-L318 HydrophobicContact CG1-CD1 4.42Å; V306-L318 HydrophobicContact CG2-CD1 3.77Å; L314-L318 WeakPolarHBondContact O-CB 3.46Å; L314-L318 VanDerWaalsContact O-CG 3.29Å; L314-L318 WeakPolarHBondContact O-CG 3.35Å; L314-L318 PolarHBondContact O-N 3.24Å; V315-L318 PolarHBondContact O-N 3.2Å; K316-L318 PolarHBondContact O-N 3.35Å; L318-N321 CarbonylContact O-C 3.42Å; L318-N321 VanDerWaalsContact O-C 3.29Å; L318-N321 PolarHBondContact O-N 3.43Å; L318-T322 PolarHBondContact O-N 3.25Å; L318-A323 HydrophobicContact CB-CB 3.84Å; L318-A323 WeakPolarHBondContact O-CB 3.22Å; L318-A323 PolarHBondContact O-N 3.39Å
319	I	97.5	Very high	97.3	Very high	38 Å²	38	49.7 Å²	49.7	20%	0.195	26%	0.26	C	S	.	.	H	α-helix	trans	-63.9	-43.6	177.3	-68.2	166.1	0	0	0	110.9	L303 V315 K316 N321 T322 M325 T350 L351 A354	L303-I319 HydrophobicContact CD1-CG1 4.46Å; V315-I319 HydrophobicContact CG1-CD1 3.68Å; V315-I319 WeakPolarHBondContact O-CD1 3.36Å; V315-I319 WeakPolarHBondContact O-CG1 3.33Å; V315-I319 PolarHBondContact O-N 3.39Å; K316-I319 PolarHBondContact O-N 3.23Å; I319-N321 PolarHBondContact O-N 3.36Å; I319-T322 PolarHBondContact O-N 3.34Å; I319-M325 HydrophobicContact CD1-CG 4.46Å; I319-M325 HydrophobicContact CD1-SD 4.07Å; I319-M325 HydrophobicContact CG1-CG 4.13Å; I319-M325 HydrophobicContact CG1-SD 4.17Å; I319-M325 HydrophobicContact CG2-SD 4.46Å; I319-T350 HydrophobicContact CD1-CG2 4.21Å; I319-L351 HydrophobicContact CD1-CD2 3.88Å; I319-A354 HydrophobicContact CD1-CB 4.11Å; I319-A354 HydrophobicContact CG2-CB 3.92Å
320	E	96.9	Very high	97.2	Very high	146 Å²	146	52.7 Å²	52.7	68%	0.682	28%	0.275	S	S	*	.	H	α-helix	trans	-59.6	-29.3	175.6	-73.8	170	-170.9	0	0	112	K316 L317	K316-E320 WeakPolarHBondContact O-CB 3.44Å; K316-E320 VanDerWaalsContact O-CG 3.3Å; K316-E320 WeakPolarHBondContact O-CG 3.49Å; K316-E320 PolarHBondContact O-N 2.99Å; L317-E320 PolarHBondContact O-N 3.47Å
321	N	96.9	Very high	97.1	Very high	51 Å²	51	55.9 Å²	55.9	27%	0.273	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	34	175.1	-69.7	-85.4	0	0	0	113.2	L286 L317 L318 I319 A323	L286-N321 HydrophobicContact CB-CB 4.31Å; L286-N321 HydrophobicContact CD1-CB 3.99Å; L286-N321 HydrophobicContact CD2-CB 3.88Å; L286-N321 HydrophobicContact CG-CB 4.28Å; L317-N321 WeakPolarHBondContact CD1-ND2 3.47Å; L317-N321 PolarHBondContact O-N 3.01Å; L317-N321 VanDerWaalsContact O-N 3.15Å; L317-N321 PolarHBondContact O-ND2 3.42Å; L318-N321 CarbonylContact O-C 3.42Å; L318-N321 VanDerWaalsContact O-C 3.29Å; L318-N321 PolarHBondContact O-N 3.43Å; I319-N321 PolarHBondContact O-N 3.36Å; N321-A323 VanDerWaalsContact C-N 3.33Å; N321-A323 PolarHBondContact O-N 3.36Å
322	T	95.1	Very high	97.1	Very high	111 Å²	111	57.2 Å²	57.2	68%	0.681	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	25.8	169.4	70.2	0	0	0	0	116	N293 L318 I319 Q324	N293-T322 PolarHBondContact ND2-O 2.97Å; L318-T322 PolarHBondContact O-N 3.25Å; I319-T322 PolarHBondContact O-N 3.34Å; T322-Q324 PolarHBondContact O-N 2.73Å
323	A	96.9	Very high	97	Very high	9 Å²	9	56.4 Å²	56.4	7%	0.074	29%	0.287	C	S	.	.			trans	-63.8	132.2	170.4	0	0	0	0	0	111.7	P292 N293 L318 N321 M325	P292-A323 HydrophobicContact CB-CB 3.94Å; P292-A323 HydrophobicContact CG-CB 3.99Å; N293-A323 WeakPolarHBondContact OD1-CA 3.36Å; L318-A323 HydrophobicContact CB-CB 3.84Å; L318-A323 WeakPolarHBondContact O-CB 3.22Å; L318-A323 PolarHBondContact O-N 3.39Å; N321-A323 VanDerWaalsContact C-N 3.33Å; N321-A323 PolarHBondContact O-N 3.36Å; A323-M325 PolarHBondContact O-N 3.37Å
324	Q	97	Very high	97	Very high	103 Å²	103	53.5 Å²	53.5	48%	0.481	27%	0.268	S	S	.	.			trans	-73.4	116.3	177.1	-69.7	179.5	5.4	0	0	110.1	N293 T322 D326 L327	N293-Q324 WeakPolarHBondContact OD1-CB 3.27Å; N293-Q324 WeakPolarHBondContact OD1-CG 3.49Å; N293-Q324 PolarHBondContact OD1-N 2.9Å; T322-Q324 PolarHBondContact O-N 2.73Å; Q324-D326 VanDerWaalsContact C-N 3.32Å; Q324-D326 PolarHBondContact O-N 2.9Å; Q324-L327 HydrophobicContact CB-CD1 3.85Å; Q324-L327 HydrophobicContact CB-CG 3.76Å; Q324-L327 VanDerWaalsContact OE1-CD2 3.28Å
325	M	96.6	Very high	97	Very high	33 Å²	33	53.4 Å²	53.4	16%	0.163	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-17.4	-176.6	-60.4	-179.7	-75.7	0	0	114.4	L303 I319 A323 P335 L351 A354 C356	L303-M325 HydrophobicContact CD2-CB 4.28Å; L303-M325 HydrophobicContact CD2-CG 4.02Å; I319-M325 HydrophobicContact CD1-CG 4.46Å; I319-M325 HydrophobicContact CD1-SD 4.07Å; I319-M325 HydrophobicContact CG1-CG 4.13Å; I319-M325 HydrophobicContact CG1-SD 4.17Å; I319-M325 HydrophobicContact CG2-SD 4.46Å; A323-M325 PolarHBondContact O-N 3.37Å; M325-P335 VanDerWaalsContact O-CD 3.31Å; M325-P335 WeakPolarHBondContact O-CD 3.31Å; M325-L351 HydrophobicContact CG-CD2 4.26Å; M325-L351 HydrophobicContact SD-CD2 4.28Å; M325-A354 HydrophobicContact CE-CB 3.95Å; M325-A354 WeakPolarHBondContact CE-O 3.46Å; M325-A354 HydrophobicContact SD-CB 3.4Å; M325-A354 WeakPolarHBondContact SD-CB 3.36Å; M325-C356 HydrophobicContact CB-CB 3.76Å; M325-C356 HydrophobicContact CE-CB 4.23Å; M325-C356 HydrophobicContact CG-CB 4.49Å; M325-C356 HydrophobicContact SD-CB 3.93Å
326	D	96.4	Very high	97	Very high	69 Å²	69	53.6 Å²	53.6	37%	0.369	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	4	-168	-68.1	-16	0	0	0	113.1	Q324 Q328 N357 I360	Q324-D326 VanDerWaalsContact C-N 3.32Å; Q324-D326 PolarHBondContact O-N 2.9Å; D326-Q328 PolarHBondContact O-N 3.18Å; D326-N357 PolarHBondContact OD1-N 3.43Å; D326-N357 VanDerWaalsContact OD2-CB 3.27Å; D326-N357 WeakPolarHBondContact OD2-CB 3.37Å; D326-N357 PolarHBondContact OD2-N 2.89Å; D326-I360 HydrophobicContact CB-CD1 3.62Å
327	L	96.9	Very high	97	Very high	42 Å²	42	49.8 Å²	49.8	22%	0.22	25%	0.251	C	S	.	.			trans	-60.8	137.7	173.9	-74.2	175.4	0	0	0	110.1	N293 V295 H304 Q324 A334 P335	N293-L327 HydrophobicContact CB-CD1 4.49Å; V295-L327 HydrophobicContact CG1-CD1 4.14Å; H304-L327 PolarHBondContact CE1-O 3.35Å; H304-L327 VanDerWaalsContact CE1-O 3.32Å; H304-L327 PolarHBondContact NE2-O 2.95Å; Q324-L327 HydrophobicContact CB-CD1 3.85Å; Q324-L327 HydrophobicContact CB-CG 3.76Å; Q324-L327 VanDerWaalsContact OE1-CD2 3.28Å; L327-A334 WeakPolarHBondContact O-CA 3.39Å; L327-P335 VanDerWaalsContact O-CD 3.27Å; L327-P335 WeakPolarHBondContact O-CD 3.26Å
328	Q	97	Very high	97	Very high	73 Å²	73	49.4 Å²	49.4	34%	0.341	25%	0.249	S	C	.	.			trans	-110.8	128.5	-178.5	-69	-175.9	-77.3	0	0	110.4	D326 L332 I360 T361	D326-Q328 PolarHBondContact O-N 3.18Å; Q328-L332 PolarHBondContact NE2-O 3.12Å; Q328-I360 HydrophobicContact CG-CG2 3.79Å; Q328-T361 PolarHBondContact NE2-O 3.11Å
329	N	96.7	Very high	97	Very high	18 Å²	18	49.4 Å²	49.4	10%	0.096	25%	0.249	C	C	.	.			trans	-70.5	-177.5	174.1	73.3	14.2	0	0	0	113	Q299 H304 H331 L332 Q333	Q299-N329 VanDerWaalsContact O-CA 3.32Å; Q299-N329 WeakPolarHBondContact O-CA 3.24Å; H304-N329 PolarHBondContact NE2-N 3.44Å; N329-H331 PolarHBondContact O-N 2.94Å; N329-H331 WeakPolarHBondContact OD1-CA 3.34Å; N329-H331 WeakPolarHBondContact OD1-CB 3.41Å; N329-H331 PolarHBondContact OD1-N 3.48Å; N329-L332 WeakPolarHBondContact O-CA 3.49Å; N329-L332 PolarHBondContact O-N 3.35Å; N329-L332 PolarHBondContact OD1-N 3.3Å; N329-Q333 PolarHBondContact N-O 2.98Å; N329-Q333 WeakPolarHBondContact OD1-CB 3.35Å; N329-Q333 PolarHBondContact OD1-N 3.05Å
330	Q	96.4	Very high	97	Very high	130 Å²	130	47.7 Å²	47.7	61%	0.607	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-18	179.1	64.4	179.8	-16.2	0	0	114.9	G298	G298-Q330 WeakPolarHBondContact O-CB 3.3Å; G298-Q330 PolarHBondContact O-N 3.45Å
331	H	94.8	Very high	97	Very high	86 Å²	86	45.1 Å²	45.1	40%	0.398	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	12.3	174.7	-58.8	-52.9	0	0	0	113	N329 Q333 H363	N329-H331 PolarHBondContact O-N 2.94Å; N329-H331 WeakPolarHBondContact OD1-CA 3.34Å; N329-H331 WeakPolarHBondContact OD1-CB 3.41Å; N329-H331 PolarHBondContact OD1-N 3.48Å; H331-Q333 HydrophobicContact CB-CG 4Å; H331-Q333 PolarHBondContact O-N 3.3Å; H331-H363 WeakPolarHBondContact O-CB 3.27Å; H331-H363 PolarHBondContact O-N 3.05Å
332	L	96.8	Very high	97	Very high	83 Å²	83	45.9 Å²	45.9	44%	0.435	23%	0.231	S	C	.	.	S	Bend	trans	58.8	24.2	-171.9	-55.7	-179.2	0	0	0	113.3	Q328 N329 T361 D362	Q328-L332 PolarHBondContact NE2-O 3.12Å; N329-L332 WeakPolarHBondContact O-CA 3.49Å; N329-L332 PolarHBondContact O-N 3.35Å; N329-L332 PolarHBondContact OD1-N 3.3Å; L332-T361 VanDerWaalsContact O-O 3.04Å; L332-D362 WeakPolarHBondContact O-CA 3.46Å
333	Q	97.1	Very high	97	Very high	16 Å²	16	41.8 Å²	41.8	8%	0.075	21%	0.207	C	C	.	.			trans	-94	123.6	-177.3	-64.5	170	-16.4	0	0	109.9	H304 N329 H331 Y337 L338 D362	H304-Q333 PolarHBondContact NE2-O 3.29Å; N329-Q333 PolarHBondContact N-O 2.98Å; N329-Q333 WeakPolarHBondContact OD1-CB 3.35Å; N329-Q333 PolarHBondContact OD1-N 3.05Å; H331-Q333 HydrophobicContact CB-CG 4Å; H331-Q333 PolarHBondContact O-N 3.3Å; Q333-Y337 HydrophobicContact CB-CD1 3.82Å; Q333-Y337 HydrophobicContact CB-CE1 4.42Å; Q333-Y337 HydrophobicContact CB-CG 4.26Å; Q333-Y337 HydrophobicContact CG-CD1 3.53Å; Q333-Y337 HydrophobicContact CG-CE1 3.63Å; Q333-Y337 HydrophobicContact CG-CG 4.17Å; Q333-Y337 VanDerWaalsContact NE2-CE1 3.27Å; Q333-L338 HydrophobicContact CB-CD2 4.23Å; Q333-L338 HydrophobicContact CB-CG 4.47Å; Q333-D362 HydrophobicContact CG-CB 3.94Å
334	A	97.4	Very high	97.1	Very high	3 Å²	3	43.9 Å²	43.9	3%	0.025	22%	0.215	C	C	.	.			trans	-81	160.3	170.3	0	0	0	0	0	111.8	L327 L336 Y337 L338 I360	L327-A334 WeakPolarHBondContact O-CA 3.39Å; A334-L336 VanDerWaalsContact C-N 3.28Å; A334-L336 PolarHBondContact O-N 3.36Å; A334-Y337 WeakPolarHBondContact O-CA 3.41Å; A334-Y337 VanDerWaalsContact O-CB 3.25Å; A334-Y337 WeakPolarHBondContact O-CB 3.45Å; A334-Y337 PolarHBondContact O-N 3.16Å; A334-L338 PolarHBondContact O-N 3.02Å; A334-I360 HydrophobicContact CB-CB 4.35Å; A334-I360 HydrophobicContact CB-CD1 3.86Å; A334-I360 HydrophobicContact CB-CG2 3.96Å
335	P	97.9	Very high	97	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-46.9	-44.1	174.6	-32	34.4	0	0	0	114.7	L303 S307 M325 L327 Y337 L338 A339 L351	L303-P335 HydrophobicContact CB-CG 4.12Å; L303-P335 HydrophobicContact CD2-CB 4.06Å; L303-P335 HydrophobicContact CD2-CG 3.91Å; L303-P335 HydrophobicContact CG-CB 3.97Å; L303-P335 HydrophobicContact CG-CG 3.98Å; S307-P335 WeakPolarHBondContact CB-O 3.27Å; M325-P335 VanDerWaalsContact O-CD 3.31Å; M325-P335 WeakPolarHBondContact O-CD 3.31Å; L327-P335 VanDerWaalsContact O-CD 3.27Å; L327-P335 WeakPolarHBondContact O-CD 3.26Å; P335-Y337 VanDerWaalsContact C-N 3.28Å; P335-Y337 PolarHBondContact O-N 2.99Å; P335-L338 PolarHBondContact O-N 3.12Å; P335-A339 PolarHBondContact O-N 2.95Å; P335-L351 HydrophobicContact CB-CD1 4.47Å
336	L	98	Very high	97.1	Very high	5 Å²	5	43.8 Å²	43.8	3%	0.026	22%	0.221	C	C	.	.	H	α-helix	trans	-59.3	-39.1	176.3	-178.3	68.3	0	0	0	112.2	A334 A339 V340 I348 L351 L352 V358 V368	A334-L336 VanDerWaalsContact C-N 3.28Å; A334-L336 PolarHBondContact O-N 3.36Å; L336-A339 PolarHBondContact O-N 3.35Å; L336-V340 HydrophobicContact CD1-CG2 4.4Å; L336-V340 HydrophobicContact CG-CG2 4.47Å; L336-V340 WeakPolarHBondContact O-CB 3.39Å; L336-V340 WeakPolarHBondContact O-CG2 3.36Å; L336-V340 PolarHBondContact O-N 3.44Å; L336-I348 HydrophobicContact CD1-CG2 4.11Å; L336-L351 HydrophobicContact CB-CD1 4.23Å; L336-L351 HydrophobicContact CD1-CB 4.06Å; L336-L351 HydrophobicContact CD1-CD1 4.21Å; L336-L352 HydrophobicContact CD1-CD2 4.3Å; L336-L352 HydrophobicContact CD1-CG 4.36Å; L336-L352 HydrophobicContact CD2-CD2 4.14Å; L336-V358 HydrophobicContact CD2-CB 4.43Å; L336-V358 HydrophobicContact CD2-CG1 4.06Å; L336-V368 HydrophobicContact CD2-CG1 4.31Å; L336-V368 HydrophobicContact CD2-CG2 3.98Å; L336-V368 HydrophobicContact CG-CG1 4.22Å; L336-V368 HydrophobicContact CG-CG2 4.48Å
337	Y	97.8	Very high	97.2	Very high	19 Å²	19	40.5 Å²	40.5	8%	0.075	20%	0.204	C	C	.	.	H	α-helix	trans	-62.7	-44.8	178	-177.1	-78.4	0	0	0	111.5	Q333 A334 P335 V340 K341 D362 V368 V371	Q333-Y337 HydrophobicContact CB-CD1 3.82Å; Q333-Y337 HydrophobicContact CB-CE1 4.42Å; Q333-Y337 HydrophobicContact CB-CG 4.26Å; Q333-Y337 HydrophobicContact CG-CD1 3.53Å; Q333-Y337 HydrophobicContact CG-CE1 3.63Å; Q333-Y337 HydrophobicContact CG-CG 4.17Å; Q333-Y337 VanDerWaalsContact NE2-CE1 3.27Å; A334-Y337 WeakPolarHBondContact O-CA 3.41Å; A334-Y337 VanDerWaalsContact O-CB 3.25Å; A334-Y337 WeakPolarHBondContact O-CB 3.45Å; A334-Y337 PolarHBondContact O-N 3.16Å; P335-Y337 VanDerWaalsContact C-N 3.28Å; P335-Y337 PolarHBondContact O-N 2.99Å; Y337-V340 PolarHBondContact O-N 3.23Å; Y337-K341 HydrophobicContact CE1-CB 4.47Å; Y337-K341 HydrophobicContact CE1-CD 4.15Å; Y337-K341 VanDerWaalsContact O-CB 3.29Å; Y337-K341 WeakPolarHBondContact O-CB 3.5Å; Y337-K341 PolarHBondContact O-N 3.38Å; Y337-D362 HydrophobicContact CD2-CB 4.21Å; Y337-D362 HydrophobicContact CE2-CB 3.7Å; Y337-D362 PolarHBondContact OH-OD2 3.41Å; Y337-V368 VanDerWaalsContact CA-CG1 3.49Å; Y337-V368 HydrophobicContact CD2-CG1 3.99Å; Y337-V368 HydrophobicContact CG-CG1 4.3Å; Y337-V371 HydrophobicContact CD2-CG2 4.34Å; Y337-V371 HydrophobicContact CE2-CG2 3.44Å; Y337-V371 VanDerWaalsContact CE2-CG2 3.44Å; Y337-V371 WeakPolarHBondContact OH-CG2 3.35Å
338	L	97.9	Very high	97.2	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-64.3	-40.5	178.1	-62.2	175.6	0	0	0	111.6	H304 E308 Q333 A334 P335 N342	H304-L338 HydrophobicContact CB-CD1 3.98Å; E308-L338 HydrophobicContact CB-CB 4.03Å; E308-L338 HydrophobicContact CB-CD1 4.25Å; E308-L338 HydrophobicContact CG-CB 4.43Å; Q333-L338 HydrophobicContact CB-CD2 4.23Å; Q333-L338 HydrophobicContact CB-CG 4.47Å; A334-L338 PolarHBondContact O-N 3.02Å; P335-L338 PolarHBondContact O-N 3.12Å; L338-N342 PolarHBondContact O-N 3.15Å; L338-N342 VanDerWaalsContact O-N 3.12Å; L338-N342 PolarHBondContact O-ND2 3.36Å
339	A	98.1	Very high	97.2	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64.5	-41.6	176.1	0	0	0	0	0	112.5	S307 P335 L336 C343 H344 V347 I348 L351	S307-A339 WeakPolarHBondContact O-CA 3.43Å; P335-A339 PolarHBondContact O-N 2.95Å; L336-A339 PolarHBondContact O-N 3.35Å; A339-C343 PolarHBondContact O-N 2.82Å; A339-H344 PolarHBondContact O-N 3.18Å; A339-V347 HydrophobicContact CB-CB 4.2Å; A339-V347 HydrophobicContact CB-CG1 3.56Å; A339-I348 HydrophobicContact CB-CG1 3.84Å; A339-L351 HydrophobicContact CB-CD1 4.35Å
340	V	97.8	Very high	97.3	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.006	20%	0.195	C	C	.	.	H	α-helix	trans	-67.4	-47.1	176.8	167.7	0	0	0	0	111.5	L336 Y337 N342 C343 I348 V368 V371 A372 I380 L384	L336-V340 HydrophobicContact CD1-CG2 4.4Å; L336-V340 HydrophobicContact CG-CG2 4.47Å; L336-V340 WeakPolarHBondContact O-CB 3.39Å; L336-V340 WeakPolarHBondContact O-CG2 3.36Å; L336-V340 PolarHBondContact O-N 3.44Å; Y337-V340 PolarHBondContact O-N 3.23Å; V340-N342 VanDerWaalsContact C-N 3.26Å; V340-N342 PolarHBondContact O-N 3.42Å; V340-C343 PolarHBondContact O-N 3.33Å; V340-I348 HydrophobicContact CB-CD1 4.43Å; V340-I348 HydrophobicContact CG2-CD1 3.83Å; V340-I348 HydrophobicContact CG2-CG1 3.9Å; V340-I348 HydrophobicContact CG2-CG2 4.29Å; V340-V368 HydrophobicContact CB-CB 4.29Å; V340-V368 HydrophobicContact CG1-CB 4.29Å; V340-V368 HydrophobicContact CG2-CB 4.09Å; V340-V371 HydrophobicContact CG1-CG1 4.47Å; V340-A372 HydrophobicContact CG1-CB 3.94Å; V340-I380 HydrophobicContact CG1-CG2 4.08Å; V340-I380 HydrophobicContact CG2-CG2 4.05Å; V340-L384 HydrophobicContact CG2-CD1 4.34Å; V340-L384 HydrophobicContact CG2-CD2 4.49Å
341	K	97	Very high	97.3	Very high	93 Å²	93	32.6 Å²	32.6	40%	0.404	17%	0.166	S	C	.	.	H	α-helix	trans	-57.2	-39.6	178.7	-177.9	-174.6	172.4	-164.1	0	112.1	Y337 V371 L375	Y337-K341 HydrophobicContact CE1-CB 4.47Å; Y337-K341 HydrophobicContact CE1-CD 4.15Å; Y337-K341 VanDerWaalsContact O-CB 3.29Å; Y337-K341 WeakPolarHBondContact O-CB 3.5Å; Y337-K341 PolarHBondContact O-N 3.38Å; K341-V371 HydrophobicContact CB-CG1 4.28Å; K341-L375 WeakPolarHBondContact O-CD1 2.89Å
342	N	96.5	Very high	97.4	Very high	67 Å²	67	29.8 Å²	29.8	36%	0.358	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	4.8	178	-65.4	-65.5	0	0	0	113.9	E308 L338 V340 H344	E308-N342 WeakPolarHBondContact CG-ND2 3.44Å; E308-N342 PolarHBondContact O-ND2 2.9Å; L338-N342 PolarHBondContact O-N 3.15Å; L338-N342 VanDerWaalsContact O-N 3.12Å; L338-N342 PolarHBondContact O-ND2 3.36Å; V340-N342 VanDerWaalsContact C-N 3.26Å; V340-N342 PolarHBondContact O-N 3.42Å; N342-H344 WeakPolarHBondContact CB-NE2 3.23Å; N342-H344 PolarHBondContact O-N 3.04Å
343	C	96.5	Very high	97.3	Very high	25 Å²	25	32.2 Å²	32.2	17%	0.169	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	35.2	173.9	-55.5	0	0	0	0	115.5	A339 V340 I345 R377 I380	A339-C343 PolarHBondContact O-N 2.82Å; V340-C343 PolarHBondContact O-N 3.33Å; C343-I345 PolarHBondContact O-N 3.2Å; C343-I345 VanDerWaalsContact O-N 3.08Å; C343-R377 VanDerWaalsContact CB-NH1 3.31Å; C343-R377 PolarHBondContact SG-NH1 2.95Å; C343-I380 HydrophobicContact CB-CD1 3.98Å
344	H	97.7	Very high	97.2	Very high	53 Å²	53	33.5 Å²	33.5	25%	0.245	18%	0.176	C	C	.	.			trans	-83.1	78.6	178.8	-65	-54.7	0	0	0	112.1	E308 G310 A339 N342 V347 I348	E308-H344 PolarHBondContact O-CD2 3.36Å; E308-H344 PolarHBondContact O-NE2 3.4Å; G310-H344 VanDerWaalsContact CA-CD2 3.48Å; G310-H344 WeakPolarHBondContact CA-CD2 3.41Å; G310-H344 PolarHBondContact N-CD2 2.98Å; G310-H344 PolarHBondContact N-NE2 3.48Å; A339-H344 PolarHBondContact O-N 3.18Å; N342-H344 WeakPolarHBondContact CB-NE2 3.23Å; N342-H344 PolarHBondContact O-N 3.04Å; H344-V347 HydrophobicContact CB-CB 4.08Å; H344-V347 HydrophobicContact CB-CG2 4.22Å; H344-V347 PolarHBondContact O-N 3.37Å; H344-V347 VanDerWaalsContact O-N 3.09Å; H344-I348 VanDerWaalsContact O-CG1 3.31Å; H344-I348 WeakPolarHBondContact O-CG1 3.46Å; H344-I348 PolarHBondContact O-N 2.71Å
345	I	96.5	Very high	97	Very high	58 Å²	58	36.1 Å²	36.1	30%	0.297	20%	0.203	S	C	.	.	H	α-helix	trans	-48.3	-46.8	-175.9	-61.3	177	0	0	0	113.8	C343 V347 I348 H349 D379 I380 M383	C343-I345 PolarHBondContact O-N 3.2Å; C343-I345 VanDerWaalsContact O-N 3.08Å; I345-V347 PolarHBondContact O-N 3.03Å; I345-I348 PolarHBondContact O-N 3.13Å; I345-H349 WeakPolarHBondContact O-CB 3.24Å; I345-H349 PolarHBondContact O-N 2.93Å; I345-D379 HydrophobicContact CD1-CB 4.38Å; I345-I380 HydrophobicContact CG1-CD1 4.48Å; I345-I380 HydrophobicContact CG1-CG1 4.12Å; I345-M383 HydrophobicContact CG2-CE 3.69Å
346	P	98	Very high	96.8	Very high	75 Å²	75	36.5 Å²	36.5	49%	0.487	21%	0.206	S	C	.	.	H	α-helix	trans	-67.8	-33.4	-178.3	-21.1	34.7	0	0	0	113.8	T312 T350	T312-P346 HydrophobicContact CG2-CB 3.95Å; T312-P346 WeakPolarHBondContact OG1-CB 3.45Å; P346-T350 WeakPolarHBondContact O-CB 3.44Å; P346-T350 PolarHBondContact O-N 3.5Å; P346-T350 VanDerWaalsContact O-N 3.09Å; P346-T350 PolarHBondContact O-OG1 3.5Å
347	V	98.3	Very high	96.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-68.2	-46.2	173.2	171.2	0	0	0	0	110.6	T312 V315 A339 H344 I345 H349 T350 L351	T312-V347 WeakPolarHBondContact OG1-CG2 3.29Å; V315-V347 HydrophobicContact CG1-CG1 4.37Å; V315-V347 HydrophobicContact CG2-CG1 3.93Å; V315-V347 HydrophobicContact CG2-CG2 4.14Å; A339-V347 HydrophobicContact CB-CB 4.2Å; A339-V347 HydrophobicContact CB-CG1 3.56Å; H344-V347 HydrophobicContact CB-CB 4.08Å; H344-V347 HydrophobicContact CB-CG2 4.22Å; H344-V347 PolarHBondContact O-N 3.37Å; H344-V347 VanDerWaalsContact O-N 3.09Å; I345-V347 PolarHBondContact O-N 3.03Å; V347-H349 VanDerWaalsContact C-N 3.29Å; V347-H349 PolarHBondContact O-N 3.4Å; V347-T350 PolarHBondContact O-N 3.35Å; V347-L351 HydrophobicContact CG1-CD1 3.72Å; V347-L351 HydrophobicContact CG1-CG 4.29Å; V347-L351 WeakPolarHBondContact O-CG 3.26Å; V347-L351 PolarHBondContact O-N 3.49Å
348	I	98.1	Very high	96.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-56.6	-47.7	177.4	-62.3	163	0	0	0	109.7	L336 A339 V340 H344 I345 T350 L351 L352 I380 M383	L336-I348 HydrophobicContact CD1-CG2 4.11Å; A339-I348 HydrophobicContact CB-CG1 3.84Å; V340-I348 HydrophobicContact CB-CD1 4.43Å; V340-I348 HydrophobicContact CG2-CD1 3.83Å; V340-I348 HydrophobicContact CG2-CG1 3.9Å; V340-I348 HydrophobicContact CG2-CG2 4.29Å; H344-I348 VanDerWaalsContact O-CG1 3.31Å; H344-I348 WeakPolarHBondContact O-CG1 3.46Å; H344-I348 PolarHBondContact O-N 2.71Å; I345-I348 PolarHBondContact O-N 3.13Å; I348-T350 VanDerWaalsContact C-N 3.35Å; I348-T350 PolarHBondContact O-N 3.03Å; I348-L351 PolarHBondContact O-N 2.9Å; I348-L352 HydrophobicContact CG2-CD1 3.84Å; I348-L352 HydrophobicContact CG2-CG 4.35Å; I348-L352 WeakPolarHBondContact O-CB 3.4Å; I348-L352 WeakPolarHBondContact O-CG 3.32Å; I348-L352 PolarHBondContact O-N 2.98Å; I348-I380 HydrophobicContact CD1-CD1 3.71Å; I348-I380 HydrophobicContact CD1-CG1 3.88Å; I348-I380 HydrophobicContact CD1-CG2 3.98Å; I348-M383 HydrophobicContact CB-SD 4.33Å; I348-M383 HydrophobicContact CG2-SD 3.77Å
349	H	96.9	Very high	96.4	Very high	84 Å²	84	42.1 Å²	42.1	39%	0.389	24%	0.238	S	C	.	.	H	α-helix	trans	-57.1	-48.7	177.2	-171.6	-90.5	0	0	0	111.9	I345 V347 L351 L352 E353 M383	I345-H349 WeakPolarHBondContact O-CB 3.24Å; I345-H349 PolarHBondContact O-N 2.93Å; V347-H349 VanDerWaalsContact C-N 3.29Å; V347-H349 PolarHBondContact O-N 3.4Å; H349-L351 PolarHBondContact O-N 3.2Å; H349-L352 PolarHBondContact O-N 3.02Å; H349-E353 IonicContact CE1-OE1 3.35Å; H349-E353 PolarHBondContact CE1-OE1 3.38Å; H349-E353 IonicContact CE1-OE2 2.69Å; H349-E353 PolarHBondContact CE1-OE2 3.5Å; H349-E353 VanDerWaalsContact CE1-OE2 3.23Å; H349-E353 IonicContact ND1-OE1 3.83Å; H349-E353 PolarHBondContact ND1-OE1 2.92Å; H349-E353 IonicContact ND1-OE2 3.83Å; H349-E353 PolarHBondContact ND1-OE2 3.46Å; H349-E353 IonicContact NE2-OE1 3.66Å; H349-E353 WeakPolarHBondContact O-CG 3.37Å; H349-E353 PolarHBondContact O-N 2.95Å; H349-M383 VanDerWaalsContact CA-SD 3.56Å; H349-M383 HydrophobicContact CB-CE 4.15Å; H349-M383 HydrophobicContact CB-SD 3.86Å
350	T	97.8	Very high	96.3	Very high	13 Å²	13	43.2 Å²	43.2	8%	0.08	24%	0.244	C	C	.	.	H	α-helix	trans	-62	-44.9	-178.3	-58.7	0	0	0	0	111.6	V315 K316 I319 P346 V347 I348 E353 A354	V315-T350 HydrophobicContact CG1-CG2 3.96Å; K316-T350 HydrophobicContact CG-CG2 3.52Å; I319-T350 HydrophobicContact CD1-CG2 4.21Å; P346-T350 WeakPolarHBondContact O-CB 3.44Å; P346-T350 PolarHBondContact O-N 3.5Å; P346-T350 VanDerWaalsContact O-N 3.09Å; P346-T350 PolarHBondContact O-OG1 3.5Å; V347-T350 PolarHBondContact O-N 3.35Å; I348-T350 VanDerWaalsContact C-N 3.35Å; I348-T350 PolarHBondContact O-N 3.03Å; T350-E353 PolarHBondContact O-N 3.37Å; T350-A354 WeakPolarHBondContact O-CB 3.31Å; T350-A354 PolarHBondContact O-N 3.45Å
351	L	97.3	Very high	96.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.5	-38.4	178.4	-72.8	169.1	0	0	0	112.3	L303 V315 I319 M325 P335 L336 A339 V347 I348 H349 A354 G355 C356	L303-L351 HydrophobicContact CD2-CD2 4.22Å; V315-L351 HydrophobicContact CG1-CD2 4.11Å; V315-L351 HydrophobicContact CG1-CG 4.15Å; I319-L351 HydrophobicContact CD1-CD2 3.88Å; M325-L351 HydrophobicContact CG-CD2 4.26Å; M325-L351 HydrophobicContact SD-CD2 4.28Å; P335-L351 HydrophobicContact CB-CD1 4.47Å; L336-L351 HydrophobicContact CB-CD1 4.23Å; L336-L351 HydrophobicContact CD1-CB 4.06Å; L336-L351 HydrophobicContact CD1-CD1 4.21Å; A339-L351 HydrophobicContact CB-CD1 4.35Å; V347-L351 HydrophobicContact CG1-CD1 3.72Å; V347-L351 HydrophobicContact CG1-CG 4.29Å; V347-L351 WeakPolarHBondContact O-CG 3.26Å; V347-L351 PolarHBondContact O-N 3.49Å; I348-L351 PolarHBondContact O-N 2.9Å; H349-L351 PolarHBondContact O-N 3.2Å; L351-A354 PolarHBondContact O-N 3.01Å; L351-G355 PolarHBondContact O-N 3.42Å; L351-C356 VanDerWaalsContact C-SG 3.55Å; L351-C356 PolarHBondContact O-N 2.91Å; L351-C356 PolarHBondContact O-SG 3.03Å
352	L	95.8	Very high	96.1	Very high	28 Å²	28	41 Å²	41	15%	0.147	24%	0.238	C	C	.	.	H	α-helix	trans	-69	-41	176.7	-68.4	176	0	0	0	111.9	L336 I348 H349 A354 G355 V358 M383 L384 A387	L336-L352 HydrophobicContact CD1-CD2 4.3Å; L336-L352 HydrophobicContact CD1-CG 4.36Å; L336-L352 HydrophobicContact CD2-CD2 4.14Å; I348-L352 HydrophobicContact CG2-CD1 3.84Å; I348-L352 HydrophobicContact CG2-CG 4.35Å; I348-L352 WeakPolarHBondContact O-CB 3.4Å; I348-L352 WeakPolarHBondContact O-CG 3.32Å; I348-L352 PolarHBondContact O-N 2.98Å; H349-L352 PolarHBondContact O-N 3.02Å; L352-A354 VanDerWaalsContact C-N 3.27Å; L352-A354 PolarHBondContact O-N 2.93Å; L352-G355 PolarHBondContact O-N 2.94Å; L352-G355 VanDerWaalsContact O-N 3.07Å; L352-V358 HydrophobicContact CD2-CG1 3.33Å; L352-M383 HydrophobicContact CD1-CB 4.37Å; L352-M383 HydrophobicContact CD1-CG 3.61Å; L352-M383 HydrophobicContact CD1-SD 3.8Å; L352-L384 HydrophobicContact CD1-CD2 4.29Å; L352-L384 HydrophobicContact CD2-CD2 4.33Å; L352-A387 HydrophobicContact CD1-CB 4.46Å; L352-A387 HydrophobicContact CD2-CB 3.87Å
353	E	95.1	Very high	96	Very high	134 Å²	134	41.4 Å²	41.4	63%	0.626	24%	0.237	S	C	*	.	H	α-helix	trans	-62.2	-36	174.5	-75.5	-179.3	135.4	0	0	112.3	H349 T350 G355	H349-E353 IonicContact CE1-OE1 3.35Å; H349-E353 PolarHBondContact CE1-OE1 3.38Å; H349-E353 IonicContact CE1-OE2 2.69Å; H349-E353 PolarHBondContact CE1-OE2 3.5Å; H349-E353 VanDerWaalsContact CE1-OE2 3.23Å; H349-E353 IonicContact ND1-OE1 3.83Å; H349-E353 PolarHBondContact ND1-OE1 2.92Å; H349-E353 IonicContact ND1-OE2 3.83Å; H349-E353 PolarHBondContact ND1-OE2 3.46Å; H349-E353 IonicContact NE2-OE1 3.66Å; H349-E353 WeakPolarHBondContact O-CG 3.37Å; H349-E353 PolarHBondContact O-N 2.95Å; T350-E353 PolarHBondContact O-N 3.37Å; E353-G355 PolarHBondContact O-N 2.98Å
354	A	94.8	Very high	95.9	Very high	42 Å²	42	46.5 Å²	46.5	35%	0.347	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-9.8	175.6	0	0	0	0	0	113.5	I319 M325 T350 L351 L352	I319-A354 HydrophobicContact CD1-CB 4.11Å; I319-A354 HydrophobicContact CG2-CB 3.92Å; M325-A354 HydrophobicContact CE-CB 3.95Å; M325-A354 WeakPolarHBondContact CE-O 3.46Å; M325-A354 HydrophobicContact SD-CB 3.4Å; M325-A354 WeakPolarHBondContact SD-CB 3.36Å; T350-A354 WeakPolarHBondContact O-CB 3.31Å; T350-A354 PolarHBondContact O-N 3.45Å; L351-A354 PolarHBondContact O-N 3.01Å; L352-A354 VanDerWaalsContact C-N 3.27Å; L352-A354 PolarHBondContact O-N 2.93Å
355	G	92.5	Very high	95.9	Very high	58 Å²	58	46 Å²	46	60%	0.598	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.8	30	174.8	0	0	0	0	0	114.9	L351 L352 E353	L351-G355 PolarHBondContact O-N 3.42Å; L352-G355 PolarHBondContact O-N 2.94Å; L352-G355 VanDerWaalsContact O-N 3.07Å; E353-G355 PolarHBondContact O-N 2.98Å
356	C	94.3	Very high	95.8	Very high	9 Å²	9	43.9 Å²	43.9	6%	0.061	24%	0.244	C	C	.	.			trans	-59.3	155.2	174.3	67.3	0	0	0	0	112.8	M325 L351 V358	M325-C356 HydrophobicContact CB-CB 3.76Å; M325-C356 HydrophobicContact CE-CB 4.23Å; M325-C356 HydrophobicContact CG-CB 4.49Å; M325-C356 HydrophobicContact SD-CB 3.93Å; L351-C356 VanDerWaalsContact C-SG 3.55Å; L351-C356 PolarHBondContact O-N 2.91Å; L351-C356 PolarHBondContact O-SG 3.03Å; C356-V358 PolarHBondContact O-N 3.37Å
357	N	95.1	Very high	95.8	Very high	74 Å²	74	40.5 Å²	40.5	40%	0.396	22%	0.222	S	C	.	.			trans	-74.4	102.6	177.7	-177.1	0.9	0	0	0	111.1	D326 N359 I360	D326-N357 PolarHBondContact OD1-N 3.43Å; D326-N357 VanDerWaalsContact OD2-CB 3.27Å; D326-N357 WeakPolarHBondContact OD2-CB 3.37Å; D326-N357 PolarHBondContact OD2-N 2.89Å; N357-N359 PolarHBondContact O-N 3.32Å; N357-N359 WeakPolarHBondContact OD1-CB 3.4Å; N357-N359 PolarHBondContact OD1-N 3.43Å; N357-I360 HydrophobicContact CB-CD1 3.98Å; N357-I360 HydrophobicContact CB-CG1 4Å; N357-I360 WeakPolarHBondContact O-CG1 3.47Å
358	V	94.8	Very high	95.7	Very high	16 Å²	16	40.7 Å²	40.7	10%	0.097	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-17.6	178.8	-61.9	0	0	0	0	114.1	L336 L352 C356 A387 M389	L336-V358 HydrophobicContact CD2-CB 4.43Å; L336-V358 HydrophobicContact CD2-CG1 4.06Å; L352-V358 HydrophobicContact CD2-CG1 3.33Å; C356-V358 PolarHBondContact O-N 3.37Å; V358-A387 HydrophobicContact CG1-CB 4.11Å; V358-M389 HydrophobicContact CB-CE 3.82Å; V358-M389 HydrophobicContact CB-CG 3.82Å; V358-M389 HydrophobicContact CB-SD 4.39Å; V358-M389 HydrophobicContact CG2-CB 4.13Å; V358-M389 HydrophobicContact CG2-CE 4.36Å; V358-M389 HydrophobicContact CG2-CG 3.61Å; V358-M389 WeakPolarHBondContact O-CE 3.22Å
359	N	95.1	Very high	95.6	Very high	54 Å²	54	40.9 Å²	40.9	29%	0.289	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	5.4	-173.9	-63.9	-37.1	0	0	0	113.9	N357 D390 L393	N357-N359 PolarHBondContact O-N 3.32Å; N357-N359 WeakPolarHBondContact OD1-CB 3.4Å; N357-N359 PolarHBondContact OD1-N 3.43Å; N359-D390 PolarHBondContact OD1-N 2.92Å; N359-L393 HydrophobicContact CB-CD1 3.9Å
360	I	95.8	Very high	95.6	Very high	24 Å²	24	37 Å²	37	12%	0.123	21%	0.206	C	C	.	.			trans	-63.7	138.3	176.3	-62.9	172.7	0	0	0	109.9	D326 Q328 A334 N357	D326-I360 HydrophobicContact CB-CD1 3.62Å; Q328-I360 HydrophobicContact CG-CG2 3.79Å; A334-I360 HydrophobicContact CB-CB 4.35Å; A334-I360 HydrophobicContact CB-CD1 3.86Å; A334-I360 HydrophobicContact CB-CG2 3.96Å; N357-I360 HydrophobicContact CB-CD1 3.98Å; N357-I360 HydrophobicContact CB-CG1 4Å; N357-I360 WeakPolarHBondContact O-CG1 3.47Å
361	T	95.4	Very high	95.5	Very high	44 Å²	44	36.8 Å²	36.8	27%	0.27	21%	0.205	S	C	.	.	B	Isolated β-bridge	trans	-115.1	146.7	-179.5	60.9	0	0	0	0	111.7	Q328 L332 Q366 T367	Q328-T361 PolarHBondContact NE2-O 3.11Å; L332-T361 VanDerWaalsContact O-O 3.04Å; T361-Q366 WeakPolarHBondContact CA-O 3.41Å; T361-T367 HydrophobicContact CG2-CG2 3.71Å
362	D	95.2	Very high	95.5	Very high	3 Å²	3	36.8 Å²	36.8	2%	0.016	21%	0.205	C	C	.	.			trans	-80.3	-174.5	176	88.6	-32.7	0	0	0	112.8	L332 Q333 Y337 R364 S365 Q366	L332-D362 WeakPolarHBondContact O-CA 3.46Å; Q333-D362 HydrophobicContact CG-CB 3.94Å; Y337-D362 HydrophobicContact CD2-CB 4.21Å; Y337-D362 HydrophobicContact CE2-CB 3.7Å; Y337-D362 PolarHBondContact OH-OD2 3.41Å; D362-R364 PolarHBondContact O-N 3.09Å; D362-R364 VanDerWaalsContact OD1-CA 3.31Å; D362-R364 WeakPolarHBondContact OD1-CA 3.33Å; D362-R364 WeakPolarHBondContact OD1-CB 3.44Å; D362-R364 PolarHBondContact OD1-N 3.35Å; D362-S365 WeakPolarHBondContact O-CA 3.4Å; D362-S365 PolarHBondContact O-N 3.2Å; D362-S365 PolarHBondContact OD1-N 3.08Å; D362-Q366 PolarHBondContact N-O 3.12Å; D362-Q366 WeakPolarHBondContact OD1-CB 3.19Å; D362-Q366 PolarHBondContact OD1-N 3.09Å
363	H	95.4	Very high	95.5	Very high	75 Å²	75	35.4 Å²	35.4	35%	0.347	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-11.9	175.5	74.8	-62.1	0	0	0	114.9	H331 K396	H331-H363 WeakPolarHBondContact O-CB 3.27Å; H331-H363 PolarHBondContact O-N 3.05Å; H363-K396 WeakPolarHBondContact O-CE 3.42Å; H363-K396 PolarHBondContact O-NZ 3.09Å
364	R	95.1	Very high	95.4	Very high	133 Å²	133	33.8 Å²	33.8	50%	0.502	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	10.8	173.3	-64.1	178.8	179.1	-167.9	-2.1	112.7	D362 Q366 K396	D362-R364 PolarHBondContact O-N 3.09Å; D362-R364 VanDerWaalsContact OD1-CA 3.31Å; D362-R364 WeakPolarHBondContact OD1-CA 3.33Å; D362-R364 WeakPolarHBondContact OD1-CB 3.44Å; D362-R364 PolarHBondContact OD1-N 3.35Å; R364-Q366 HydrophobicContact CB-CG 3.88Å; R364-Q366 PolarHBondContact O-N 3.41Å; R364-K396 WeakPolarHBondContact O-CG 2.73Å; R364-K396 PolarHBondContact O-N 3.17Å
365	S	96.1	Very high	95.3	Very high	41 Å²	41	35.2 Å²	35.2	29%	0.287	19%	0.192	S	C	.	.	S	Bend	trans	59.2	21.1	-171.5	-54.9	0	0	0	0	112.4	D362	D362-S365 WeakPolarHBondContact O-CA 3.4Å; D362-S365 PolarHBondContact O-N 3.2Å; D362-S365 PolarHBondContact OD1-N 3.08Å
366	Q	96.1	Very high	95.4	Very high	15 Å²	15	34.2 Å²	34.2	7%	0.07	18%	0.178	C	C	.	.			trans	-84.2	126.4	178	-66.3	-176.5	-76.9	0	0	109.7	T361 D362 R364 H370 D395	T361-Q366 WeakPolarHBondContact CA-O 3.41Å; D362-Q366 PolarHBondContact N-O 3.12Å; D362-Q366 WeakPolarHBondContact OD1-CB 3.19Å; D362-Q366 PolarHBondContact OD1-N 3.09Å; R364-Q366 HydrophobicContact CB-CG 3.88Å; R364-Q366 PolarHBondContact O-N 3.41Å; Q366-H370 HydrophobicContact CB-CB 4.03Å; Q366-H370 HydrophobicContact CG-CB 4.33Å; Q366-D395 HydrophobicContact CG-CB 3.94Å
367	T	96.3	Very high	95.4	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.018	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-75.7	166.4	166.7	70.8	0	0	0	0	110.5	T361 L369 H370 V371 L393	T361-T367 HydrophobicContact CG2-CG2 3.71Å; T367-L369 PolarHBondContact O-N 2.99Å; T367-L369 VanDerWaalsContact O-N 3.15Å; T367-L369 PolarHBondContact OG1-N 3.29Å; T367-H370 PolarHBondContact N-ND1 3.11Å; T367-H370 VanDerWaalsContact N-ND1 3.18Å; T367-H370 WeakPolarHBondContact O-CB 3.08Å; T367-H370 PolarHBondContact O-N 3.24Å; T367-H370 PolarHBondContact OG1-ND1 3.25Å; T367-V371 PolarHBondContact O-N 3.18Å; T367-L393 HydrophobicContact CG2-CB 3.84Å; T367-L393 HydrophobicContact CG2-CD1 3.54Å; T367-L393 HydrophobicContact CG2-CG 4.35Å
368	V	96.8	Very high	95.4	Very high	5 Å²	5	37 Å²	37	3%	0.03	19%	0.186	C	C	.	.	H	α-helix	trans	-60.6	-24.6	175.2	-57.3	0	0	0	0	113.3	L336 Y337 V340 V371 A372 L384 M389	L336-V368 HydrophobicContact CD2-CG1 4.31Å; L336-V368 HydrophobicContact CD2-CG2 3.98Å; L336-V368 HydrophobicContact CG-CG1 4.22Å; L336-V368 HydrophobicContact CG-CG2 4.48Å; Y337-V368 VanDerWaalsContact CA-CG1 3.49Å; Y337-V368 HydrophobicContact CD2-CG1 3.99Å; Y337-V368 HydrophobicContact CG-CG1 4.3Å; V340-V368 HydrophobicContact CB-CB 4.29Å; V340-V368 HydrophobicContact CG1-CB 4.29Å; V340-V368 HydrophobicContact CG2-CB 4.09Å; V368-V371 PolarHBondContact O-N 3.16Å; V368-A372 WeakPolarHBondContact O-CB 3.35Å; V368-A372 PolarHBondContact O-N 3.45Å; V368-L384 HydrophobicContact CB-CD1 4.41Å; V368-L384 HydrophobicContact CG2-CD1 3.95Å; V368-L384 HydrophobicContact CG2-CD2 3.65Å; V368-L384 HydrophobicContact CG2-CG 4.46Å; V368-M389 HydrophobicContact CG2-CE 3.28Å; V368-M389 HydrophobicContact CG2-SD 4.22Å
369	L	97.2	Very high	95.4	Very high	3 Å²	3	40.2 Å²	40.2	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-70.7	-36.7	174.3	-172.9	63.8	0	0	0	112.5	T367 V371 A372 A373 V381 L384 L385 M389 L391 A401	T367-L369 PolarHBondContact O-N 2.99Å; T367-L369 VanDerWaalsContact O-N 3.15Å; T367-L369 PolarHBondContact OG1-N 3.29Å; L369-V371 VanDerWaalsContact C-N 3.3Å; L369-V371 PolarHBondContact O-N 3.29Å; L369-A372 PolarHBondContact O-N 3.44Å; L369-A373 VanDerWaalsContact O-CB 3.26Å; L369-A373 WeakPolarHBondContact O-CB 3.47Å; L369-A373 PolarHBondContact O-N 3.14Å; L369-V381 HydrophobicContact CD1-CG1 4.12Å; L369-V381 HydrophobicContact CD1-CG2 4.42Å; L369-L384 HydrophobicContact CD1-CB 4.41Å; L369-L384 HydrophobicContact CD1-CD1 4.45Å; L369-L385 HydrophobicContact CD1-CD2 4.14Å; L369-L385 HydrophobicContact CD1-CG 4.41Å; L369-L385 HydrophobicContact CD2-CD2 3.93Å; L369-M389 HydrophobicContact CB-CE 4.12Å; L369-M389 HydrophobicContact CB-SD 3.89Å; L369-L391 HydrophobicContact CD2-CD2 3.34Å; L369-A401 HydrophobicContact CB-CB 4.17Å; L369-A401 HydrophobicContact CD2-CB 3.71Å; L369-A401 HydrophobicContact CG-CB 3.67Å
370	H	96.7	Very high	95.4	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.009	19%	0.189	C	C	.	.	H	α-helix	trans	-59.8	-45.5	174.8	-67.9	81.6	0	0	0	110.3	Q366 T367 A373 E374 L393 K399 T400 A401	Q366-H370 HydrophobicContact CB-CB 4.03Å; Q366-H370 HydrophobicContact CG-CB 4.33Å; T367-H370 PolarHBondContact N-ND1 3.11Å; T367-H370 VanDerWaalsContact N-ND1 3.18Å; T367-H370 WeakPolarHBondContact O-CB 3.08Å; T367-H370 PolarHBondContact O-N 3.24Å; T367-H370 PolarHBondContact OG1-ND1 3.25Å; H370-A373 PolarHBondContact O-N 3.16Å; H370-E374 PolarHBondContact O-N 2.95Å; H370-L393 PolarHBondContact CE1-O 3.47Å; H370-K399 PolarHBondContact NE2-O 2.7Å; H370-K399 VanDerWaalsContact NE2-O 3.12Å; H370-T400 VanDerWaalsContact NE2-C 3.34Å; H370-A401 PolarHBondContact NE2-N 3.46Å; H370-A401 VanDerWaalsContact NE2-N 3.16Å
371	V	95.6	Very high	95.5	Very high	9 Å²	9	36.5 Å²	36.5	6%	0.055	18%	0.183	C	C	.	.	H	α-helix	trans	-67.2	-45.7	179	-179.1	0	0	0	0	111.3	Y337 V340 K341 T367 V368 L369 A373 E374 L375	Y337-V371 HydrophobicContact CD2-CG2 4.34Å; Y337-V371 HydrophobicContact CE2-CG2 3.44Å; Y337-V371 VanDerWaalsContact CE2-CG2 3.44Å; Y337-V371 WeakPolarHBondContact OH-CG2 3.35Å; V340-V371 HydrophobicContact CG1-CG1 4.47Å; K341-V371 HydrophobicContact CB-CG1 4.28Å; T367-V371 PolarHBondContact O-N 3.18Å; V368-V371 PolarHBondContact O-N 3.16Å; L369-V371 VanDerWaalsContact C-N 3.3Å; L369-V371 PolarHBondContact O-N 3.29Å; V371-A373 VanDerWaalsContact C-N 3.27Å; V371-A373 PolarHBondContact O-N 3.02Å; V371-E374 PolarHBondContact O-N 3.29Å; V371-L375 HydrophobicContact CG1-CD1 3.79Å; V371-L375 HydrophobicContact CG1-CG 4.27Å; V371-L375 WeakPolarHBondContact O-CB 3.44Å; V371-L375 VanDerWaalsContact O-CG 3.27Å; V371-L375 WeakPolarHBondContact O-CG 3.5Å; V371-L375 PolarHBondContact O-N 3.48Å
372	A	96.5	Very high	95.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61.8	-35.7	178.2	0	0	0	0	0	112.7	V340 V368 L369 A376 R377 I380 V381 L384	V340-A372 HydrophobicContact CG1-CB 3.94Å; V368-A372 WeakPolarHBondContact O-CB 3.35Å; V368-A372 PolarHBondContact O-N 3.45Å; L369-A372 PolarHBondContact O-N 3.44Å; A372-A376 PolarHBondContact O-N 3.38Å; A372-R377 PolarHBondContact O-N 2.63Å; A372-I380 HydrophobicContact CB-CG2 3.92Å; A372-V381 HydrophobicContact CB-CG2 3.81Å; A372-L384 HydrophobicContact CB-CD1 3.78Å
373	A	95.5	Very high	95.5	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-67.4	-46.2	174.5	0	0	0	0	0	112.2	L369 H370 V371 L375 A376 A405 I413	L369-A373 VanDerWaalsContact O-CB 3.26Å; L369-A373 WeakPolarHBondContact O-CB 3.47Å; L369-A373 PolarHBondContact O-N 3.14Å; H370-A373 PolarHBondContact O-N 3.16Å; V371-A373 VanDerWaalsContact C-N 3.27Å; V371-A373 PolarHBondContact O-N 3.02Å; A373-L375 VanDerWaalsContact C-N 3.28Å; A373-L375 PolarHBondContact O-N 3.37Å; A373-A376 PolarHBondContact O-N 2.83Å; A373-A405 HydrophobicContact CB-CB 4.06Å; A373-I413 HydrophobicContact CB-CG2 3.95Å
374	E	93.6	Very high	95.5	Very high	99 Å²	99	32.8 Å²	32.8	46%	0.463	16%	0.163	S	C	.	.	H	α-helix	trans	-64.1	-32.1	176.9	-175.8	169.8	-156.8	0	0	112.7	H370 V371 A376 V404	H370-E374 PolarHBondContact O-N 2.95Å; V371-E374 PolarHBondContact O-N 3.29Å; E374-A376 VanDerWaalsContact C-N 3.31Å; E374-V404 HydrophobicContact CB-CG1 4.2Å
375	L	93.4	Very high	95.5	Very high	72 Å²	72	26.4 Å²	26.4	38%	0.377	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	0.9	177.5	-66	177.7	0	0	0	114.3	K341 V371 A373 R377	K341-L375 WeakPolarHBondContact O-CD1 2.89Å; V371-L375 HydrophobicContact CG1-CD1 3.79Å; V371-L375 HydrophobicContact CG1-CG 4.27Å; V371-L375 WeakPolarHBondContact O-CB 3.44Å; V371-L375 VanDerWaalsContact O-CG 3.27Å; V371-L375 WeakPolarHBondContact O-CG 3.5Å; V371-L375 PolarHBondContact O-N 3.48Å; A373-L375 VanDerWaalsContact C-N 3.28Å; A373-L375 PolarHBondContact O-N 3.37Å; L375-R377 VanDerWaalsContact C-N 3.26Å; L375-R377 HydrophobicContact CB-CG 3.89Å; L375-R377 WeakPolarHBondContact O-CG 3.4Å; L375-R377 PolarHBondContact O-N 2.89Å
376	A	94.3	Very high	95.3	Very high	37 Å²	37	28.6 Å²	28.6	31%	0.306	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	29.2	179.6	0	0	0	0	0	115	A372 A373 E374 V378 E410	A372-A376 PolarHBondContact O-N 3.38Å; A373-A376 PolarHBondContact O-N 2.83Å; E374-A376 VanDerWaalsContact C-N 3.31Å; A376-V378 PolarHBondContact O-N 2.97Å; A376-E410 HydrophobicContact CB-CG 4.04Å; A376-E410 WeakPolarHBondContact CB-OE1 3.49Å; A376-E410 WeakPolarHBondContact CB-OE2 3.46Å
377	R	93.4	Very high	95	Very high	99 Å²	99	30.1 Å²	30.1	37%	0.374	16%	0.159	S	C	.	.			trans	-94.3	82.2	-173.1	-58.8	-58.5	-68.5	-111.6	-2.6	112.3	C343 A372 L375 D379 I380 V381	C343-R377 VanDerWaalsContact CB-NH1 3.31Å; C343-R377 PolarHBondContact SG-NH1 2.95Å; A372-R377 PolarHBondContact O-N 2.63Å; L375-R377 VanDerWaalsContact C-N 3.26Å; L375-R377 HydrophobicContact CB-CG 3.89Å; L375-R377 WeakPolarHBondContact O-CG 3.4Å; L375-R377 PolarHBondContact O-N 2.89Å; R377-D379 VanDerWaalsContact C-N 3.3Å; R377-D379 PolarHBondContact O-N 3.25Å; R377-I380 HydrophobicContact CB-CB 4.03Å; R377-I380 HydrophobicContact CB-CD1 3.82Å; R377-I380 HydrophobicContact CB-CG1 4.06Å; R377-I380 HydrophobicContact CG-CD1 4.13Å; R377-I380 PolarHBondContact O-N 3.34Å; R377-V381 WeakPolarHBondContact O-CG2 3.3Å; R377-V381 PolarHBondContact O-N 3.39Å
378	V	94.9	Very high	94.6	Very high	42 Å²	42	31.8 Å²	31.8	26%	0.255	18%	0.176	S	C	.	.	H	α-helix	trans	-48	-45.2	-179.3	174.1	0	0	0	0	113.6	A376 I380 V381 D382 I412 I413 M416 K446	A376-V378 PolarHBondContact O-N 2.97Å; V378-I380 PolarHBondContact O-N 3.3Å; V378-V381 PolarHBondContact O-N 3.06Å; V378-D382 PolarHBondContact O-N 3.24Å; V378-I412 HydrophobicContact CG1-CG2 4.36Å; V378-I412 HydrophobicContact CG2-CG2 4Å; V378-I413 HydrophobicContact CG2-CG1 4.32Å; V378-M416 HydrophobicContact CG1-CE 4.24Å; V378-M416 HydrophobicContact CG1-SD 3.79Å; V378-M416 WeakPolarHBondContact O-CE 3.35Å; V378-K446 HydrophobicContact CG1-CD 4.42Å; V378-K446 HydrophobicContact CG1-CG 4.27Å
379	D	94.8	Very high	94.3	Very high	84 Å²	84	32 Å²	32	45%	0.449	18%	0.177	S	C	.	.	H	α-helix	trans	-67.2	-37.9	-178.3	-63.9	-42	0	0	0	112.9	I345 R377 M383 K446	I345-D379 HydrophobicContact CD1-CB 4.38Å; R377-D379 VanDerWaalsContact C-N 3.3Å; R377-D379 PolarHBondContact O-N 3.25Å; D379-M383 PolarHBondContact O-N 3.06Å; D379-M383 VanDerWaalsContact O-N 3.13Å; D379-K446 WeakPolarHBondContact OD1-CE 3.2Å; D379-K446 IonicContact OD1-NZ 3.9Å; D379-K446 PolarHBondContact OD1-NZ 2.84Å
380	I	96.4	Very high	94.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-70	-44	177.5	-62.1	176.4	0	0	0	109.4	V340 C343 I345 I348 A372 R377 V378 D382 M383 L384	V340-I380 HydrophobicContact CG1-CG2 4.08Å; V340-I380 HydrophobicContact CG2-CG2 4.05Å; C343-I380 HydrophobicContact CB-CD1 3.98Å; I345-I380 HydrophobicContact CG1-CD1 4.48Å; I345-I380 HydrophobicContact CG1-CG1 4.12Å; I348-I380 HydrophobicContact CD1-CD1 3.71Å; I348-I380 HydrophobicContact CD1-CG1 3.88Å; I348-I380 HydrophobicContact CD1-CG2 3.98Å; A372-I380 HydrophobicContact CB-CG2 3.92Å; R377-I380 HydrophobicContact CB-CB 4.03Å; R377-I380 HydrophobicContact CB-CD1 3.82Å; R377-I380 HydrophobicContact CB-CG1 4.06Å; R377-I380 HydrophobicContact CG-CD1 4.13Å; R377-I380 PolarHBondContact O-N 3.34Å; V378-I380 PolarHBondContact O-N 3.3Å; I380-D382 PolarHBondContact O-N 3.15Å; I380-M383 PolarHBondContact O-N 2.96Å; I380-L384 HydrophobicContact CG2-CD1 3.81Å; I380-L384 HydrophobicContact CG2-CG 4.12Å; I380-L384 WeakPolarHBondContact O-CB 3.33Å; I380-L384 VanDerWaalsContact O-CG 3.27Å; I380-L384 WeakPolarHBondContact O-CG 3.32Å; I380-L384 PolarHBondContact O-N 3.21Å
381	V	97	Very high	94	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-58.3	-46.3	175	172.9	0	0	0	0	111	L369 A372 R377 V378 M383 L384 L385 I413 M416	L369-V381 HydrophobicContact CD1-CG1 4.12Å; L369-V381 HydrophobicContact CD1-CG2 4.42Å; A372-V381 HydrophobicContact CB-CG2 3.81Å; R377-V381 WeakPolarHBondContact O-CG2 3.3Å; R377-V381 PolarHBondContact O-N 3.39Å; V378-V381 PolarHBondContact O-N 3.06Å; V381-M383 VanDerWaalsContact C-N 3.28Å; V381-M383 PolarHBondContact O-N 3.18Å; V381-L384 PolarHBondContact O-N 3.07Å; V381-L385 HydrophobicContact CG1-CD1 3.65Å; V381-L385 HydrophobicContact CG1-CG 4.04Å; V381-L385 WeakPolarHBondContact O-CB 3.27Å; V381-L385 WeakPolarHBondContact O-CG 3.46Å; V381-L385 PolarHBondContact O-N 3.39Å; V381-I413 HydrophobicContact CG1-CG2 4.14Å; V381-I413 HydrophobicContact CG2-CD1 4.04Å; V381-I413 HydrophobicContact CG2-CG1 4.25Å; V381-I413 HydrophobicContact CG2-CG2 4.16Å; V381-M416 HydrophobicContact CB-CE 4.16Å; V381-M416 HydrophobicContact CG1-CB 4.44Å; V381-M416 HydrophobicContact CG1-CE 3.84Å; V381-M416 HydrophobicContact CG1-SD 4.39Å
382	D	95.3	Very high	93.9	Very high	8 Å²	8	40 Å²	40	4%	0.043	22%	0.224	C	C	.	.	H	α-helix	trans	-60.3	-40.3	178.4	-171.4	60.7	0	0	0	111.6	V378 I380 K386 M416 T444 F445 K446	V378-D382 PolarHBondContact O-N 3.24Å; I380-D382 PolarHBondContact O-N 3.15Å; D382-K386 WeakPolarHBondContact O-CD 3.43Å; D382-K386 WeakPolarHBondContact O-CG 3.45Å; D382-K386 PolarHBondContact O-N 3.48Å; D382-K386 WeakPolarHBondContact OD1-CE 3.26Å; D382-K386 IonicContact OD1-NZ 3.02Å; D382-K386 WeakPolarHBondContact OD2-CE 3.46Å; D382-K386 IonicContact OD2-NZ 2.83Å; D382-K386 PolarHBondContact OD2-NZ 2.88Å; D382-M416 HydrophobicContact CB-CE 3.51Å; D382-T444 PolarHBondContact OD1-OG1 2.87Å; D382-T444 PolarHBondContact OD2-OG1 3.12Å; D382-F445 PolarHBondContact OD1-N 2.92Å; D382-K446 HydrophobicContact CB-CD 4.41Å; D382-K446 VanDerWaalsContact CB-CE 3.48Å; D382-K446 HydrophobicContact CB-CG 4.05Å; D382-K446 VanDerWaalsContact OD2-CE 3.31Å; D382-K446 WeakPolarHBondContact OD2-CE 3.43Å
383	M	94.6	Very high	93.9	Very high	36 Å²	36	42.4 Å²	42.4	18%	0.177	24%	0.236	C	C	.	.	H	α-helix	trans	-67	-46.9	178.2	-160.1	-173.7	-64	0	0	111.8	I345 I348 H349 L352 D379 I380 V381 K386 A387	I345-M383 HydrophobicContact CG2-CE 3.69Å; I348-M383 HydrophobicContact CB-SD 4.33Å; I348-M383 HydrophobicContact CG2-SD 3.77Å; H349-M383 VanDerWaalsContact CA-SD 3.56Å; H349-M383 HydrophobicContact CB-CE 4.15Å; H349-M383 HydrophobicContact CB-SD 3.86Å; L352-M383 HydrophobicContact CD1-CB 4.37Å; L352-M383 HydrophobicContact CD1-CG 3.61Å; L352-M383 HydrophobicContact CD1-SD 3.8Å; D379-M383 PolarHBondContact O-N 3.06Å; D379-M383 VanDerWaalsContact O-N 3.13Å; I380-M383 PolarHBondContact O-N 2.96Å; V381-M383 VanDerWaalsContact C-N 3.28Å; V381-M383 PolarHBondContact O-N 3.18Å; M383-K386 PolarHBondContact O-N 3.47Å; M383-A387 PolarHBondContact O-N 2.75Å
384	L	95.5	Very high	93.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.2	-46.2	177.8	-75.3	179.9	0	0	0	112.1	V340 L352 V368 L369 A372 I380 V381 K386 A387 M389	V340-L384 HydrophobicContact CG2-CD1 4.34Å; V340-L384 HydrophobicContact CG2-CD2 4.49Å; L352-L384 HydrophobicContact CD1-CD2 4.29Å; L352-L384 HydrophobicContact CD2-CD2 4.33Å; V368-L384 HydrophobicContact CB-CD1 4.41Å; V368-L384 HydrophobicContact CG2-CD1 3.95Å; V368-L384 HydrophobicContact CG2-CD2 3.65Å; V368-L384 HydrophobicContact CG2-CG 4.46Å; L369-L384 HydrophobicContact CD1-CB 4.41Å; L369-L384 HydrophobicContact CD1-CD1 4.45Å; A372-L384 HydrophobicContact CB-CD1 3.78Å; I380-L384 HydrophobicContact CG2-CD1 3.81Å; I380-L384 HydrophobicContact CG2-CG 4.12Å; I380-L384 WeakPolarHBondContact O-CB 3.33Å; I380-L384 VanDerWaalsContact O-CG 3.27Å; I380-L384 WeakPolarHBondContact O-CG 3.32Å; I380-L384 PolarHBondContact O-N 3.21Å; V381-L384 PolarHBondContact O-N 3.07Å; L384-K386 VanDerWaalsContact C-N 3.28Å; L384-K386 PolarHBondContact O-N 2.92Å; L384-A387 WeakPolarHBondContact O-CB 3.48Å; L384-A387 PolarHBondContact O-N 3.46Å; L384-M389 HydrophobicContact CB-SD 3.62Å; L384-M389 HydrophobicContact CD1-SD 4.37Å; L384-M389 HydrophobicContact CD2-SD 3.99Å; L384-M389 HydrophobicContact CG-SD 4.2Å; L384-M389 WeakPolarHBondContact O-CG 3.48Å
385	L	95.1	Very high	94	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.1	-35.8	178.4	-69.3	176.3	0	0	0	112	L369 V381 A387 G388 L391 M416 I417 A420 F424 F445	L369-L385 HydrophobicContact CD1-CD2 4.14Å; L369-L385 HydrophobicContact CD1-CG 4.41Å; L369-L385 HydrophobicContact CD2-CD2 3.93Å; V381-L385 HydrophobicContact CG1-CD1 3.65Å; V381-L385 HydrophobicContact CG1-CG 4.04Å; V381-L385 WeakPolarHBondContact O-CB 3.27Å; V381-L385 WeakPolarHBondContact O-CG 3.46Å; V381-L385 PolarHBondContact O-N 3.39Å; L385-A387 VanDerWaalsContact C-N 3.27Å; L385-A387 PolarHBondContact O-N 2.87Å; L385-G388 PolarHBondContact O-N 3.46Å; L385-L391 HydrophobicContact CD2-CD1 4.39Å; L385-L391 HydrophobicContact CD2-CD2 3.63Å; L385-M416 HydrophobicContact CD1-CB 3.88Å; L385-I417 HydrophobicContact CD1-CG1 4.4Å; L385-I417 HydrophobicContact CD2-CG1 4.38Å; L385-A420 HydrophobicContact CB-CB 4.09Å; L385-A420 HydrophobicContact CD1-CB 3.97Å; L385-A420 HydrophobicContact CD2-CB 3.78Å; L385-A420 HydrophobicContact CG-CB 4.16Å; L385-F424 WeakPolarHBondContact O-CE2 3.35Å; L385-F424 VanDerWaalsContact O-CZ 3.24Å; L385-F424 WeakPolarHBondContact O-CZ 3.22Å; L385-F445 HydrophobicContact CB-CD2 3.55Å; L385-F445 HydrophobicContact CB-CE2 3.76Å; L385-F445 HydrophobicContact CB-CG 4.46Å; L385-F445 HydrophobicContact CD1-CB 4.23Å; L385-F445 HydrophobicContact CD1-CD2 4.17Å; L385-F445 HydrophobicContact CD1-CG 4.34Å
386	K	92.3	Very high	94.1	Very high	87 Å²	87	46.7 Å²	46.7	38%	0.378	25%	0.252	S	S	.	.	H	α-helix	trans	-65.8	-29.6	174.7	-72.4	168.6	-164.5	-172.4	0	113	D382 M383 L384 G388 L443 F445	D382-K386 WeakPolarHBondContact O-CD 3.43Å; D382-K386 WeakPolarHBondContact O-CG 3.45Å; D382-K386 PolarHBondContact O-N 3.48Å; D382-K386 WeakPolarHBondContact OD1-CE 3.26Å; D382-K386 IonicContact OD1-NZ 3.02Å; D382-K386 WeakPolarHBondContact OD2-CE 3.46Å; D382-K386 IonicContact OD2-NZ 2.83Å; D382-K386 PolarHBondContact OD2-NZ 2.88Å; M383-K386 PolarHBondContact O-N 3.47Å; L384-K386 VanDerWaalsContact C-N 3.28Å; L384-K386 PolarHBondContact O-N 2.92Å; K386-G388 PolarHBondContact O-N 2.99Å; K386-L443 WeakPolarHBondContact CE-O 3.44Å; K386-L443 HydrophobicContact CG-CD2 4.36Å; K386-L443 HydrophobicContact CG-CG 4.49Å; K386-L443 PolarHBondContact NZ-O 3.17Å; K386-F445 HydrophobicContact CG-CD2 4.45Å; K386-F445 HydrophobicContact CG-CE2 4.13Å
387	A	90.9	Very high	94.1	Very high	47 Å²	47	51.1 Å²	51.1	39%	0.388	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-5	177.5	0	0	0	0	0	113.6	L352 V358 M383 L384 L385	L352-A387 HydrophobicContact CD1-CB 4.46Å; L352-A387 HydrophobicContact CD2-CB 3.87Å; V358-A387 HydrophobicContact CG1-CB 4.11Å; M383-A387 PolarHBondContact O-N 2.75Å; L384-A387 WeakPolarHBondContact O-CB 3.48Å; L384-A387 PolarHBondContact O-N 3.46Å; L385-A387 VanDerWaalsContact C-N 3.27Å; L385-A387 PolarHBondContact O-N 2.87Å
388	G	86	Confident	94.2	Very high	37 Å²	37	48.2 Å²	48.2	38%	0.381	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	76	40.3	172.1	0	0	0	0	0	114	L385 K386	L385-G388 PolarHBondContact O-N 3.46Å; K386-G388 PolarHBondContact O-N 2.99Å
389	M	91.1	Very high	94.3	Very high	10 Å²	10	51.4 Å²	51.4	5%	0.049	28%	0.278	C	S	.	.			trans	-61.6	155	176.9	-52.3	-173.4	76.2	0	0	112.8	V358 V368 L369 L384 L391	V358-M389 HydrophobicContact CB-CE 3.82Å; V358-M389 HydrophobicContact CB-CG 3.82Å; V358-M389 HydrophobicContact CB-SD 4.39Å; V358-M389 HydrophobicContact CG2-CB 4.13Å; V358-M389 HydrophobicContact CG2-CE 4.36Å; V358-M389 HydrophobicContact CG2-CG 3.61Å; V358-M389 WeakPolarHBondContact O-CE 3.22Å; V368-M389 HydrophobicContact CG2-CE 3.28Å; V368-M389 HydrophobicContact CG2-SD 4.22Å; L369-M389 HydrophobicContact CB-CE 4.12Å; L369-M389 HydrophobicContact CB-SD 3.89Å; L384-M389 HydrophobicContact CB-SD 3.62Å; L384-M389 HydrophobicContact CD1-SD 4.37Å; L384-M389 HydrophobicContact CD2-SD 3.99Å; L384-M389 HydrophobicContact CG-SD 4.2Å; L384-M389 WeakPolarHBondContact O-CG 3.48Å; M389-L391 HydrophobicContact CB-CD2 4.47Å; M389-L391 PolarHBondContact O-N 3.11Å
390	D	93.1	Very high	94.3	Very high	64 Å²	64	48.1 Å²	48.1	34%	0.342	26%	0.262	S	S	.	.			trans	-75.7	105.4	168.7	-173.2	-4.9	0	0	0	110.5	N359 T392 L393	N359-D390 PolarHBondContact OD1-N 2.92Å; D390-T392 PolarHBondContact O-N 2.9Å; D390-T392 WeakPolarHBondContact OD1-CB 3.37Å; D390-T392 PolarHBondContact OD1-N 3.23Å; D390-T392 PolarHBondContact OD1-OG1 3.39Å; D390-T392 PolarHBondContact OD2-OG1 2.92Å; D390-L393 HydrophobicContact CB-CD1 3.98Å; D390-L393 HydrophobicContact CB-CG 3.95Å
391	L	94.4	Very high	94.3	Very high	18 Å²	18	48.3 Å²	48.3	9%	0.094	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-6.3	-178.9	-53.2	178.5	0	0	0	112.8	L369 L385 M389 A420 E421	L369-L391 HydrophobicContact CD2-CD2 3.34Å; L385-L391 HydrophobicContact CD2-CD1 4.39Å; L385-L391 HydrophobicContact CD2-CD2 3.63Å; M389-L391 HydrophobicContact CB-CD2 4.47Å; M389-L391 PolarHBondContact O-N 3.11Å; L391-A420 HydrophobicContact CD1-CB 4.04Å; L391-E421 HydrophobicContact CB-CG 4.05Å; L391-E421 HydrophobicContact CD1-CB 4.21Å; L391-E421 HydrophobicContact CD1-CG 3.44Å; L391-E421 VanDerWaalsContact CD1-CG 3.44Å; L391-E421 HydrophobicContact CG-CG 4.37Å
392	T	94.1	Very high	94.3	Very high	101 Å²	101	48.5 Å²	48.5	62%	0.62	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-12.2	-178.7	72.7	0	0	0	0	113.5	D390	D390-T392 PolarHBondContact O-N 2.9Å; D390-T392 WeakPolarHBondContact OD1-CB 3.37Å; D390-T392 PolarHBondContact OD1-N 3.23Å; D390-T392 PolarHBondContact OD1-OG1 3.39Å; D390-T392 PolarHBondContact OD2-OG1 2.92Å
393	L	95.8	Very high	94.3	Very high	50 Å²	50	49.5 Å²	49.5	26%	0.262	27%	0.273	S	S	.	.			trans	-62.9	139.3	-180	-65.1	176.4	0	0	0	111.2	N359 T367 H370 D390	N359-L393 HydrophobicContact CB-CD1 3.9Å; T367-L393 HydrophobicContact CG2-CB 3.84Å; T367-L393 HydrophobicContact CG2-CD1 3.54Å; T367-L393 HydrophobicContact CG2-CG 4.35Å; H370-L393 PolarHBondContact CE1-O 3.47Å; D390-L393 HydrophobicContact CB-CD1 3.98Å; D390-L393 HydrophobicContact CB-CG 3.95Å
394	Q	96.4	Very high	94.3	Very high	110 Å²	110	47.9 Å²	47.9	51%	0.514	27%	0.266	S	S	.	.	B	Isolated β-bridge	trans	-117.9	143	-176.2	-63.6	177.5	13.7	0	0	111.1	G398 K399 T400	Q394-G398 PolarHBondContact OE1-O 3.21Å; Q394-K399 CarbonylContact C-O 3.29Å; Q394-K399 VanDerWaalsContact CA-O 3.3Å; Q394-K399 WeakPolarHBondContact CA-O 3.32Å; Q394-T400 HydrophobicContact CG-CG2 3.89Å
395	D	95.7	Very high	94.3	Very high	14 Å²	14	47.9 Å²	47.9	8%	0.075	27%	0.266	C	S	.	.			trans	-70.3	178.1	168.9	70.7	13.6	0	0	0	112.4	Q366 Q397 G398 K399	Q366-D395 HydrophobicContact CG-CB 3.94Å; D395-Q397 PolarHBondContact O-N 3.39Å; D395-Q397 VanDerWaalsContact O-N 3.08Å; D395-Q397 VanDerWaalsContact OD1-CA 3.27Å; D395-Q397 WeakPolarHBondContact OD1-CA 3.42Å; D395-Q397 WeakPolarHBondContact OD1-CB 3.35Å; D395-Q397 PolarHBondContact OD1-N 2.95Å; D395-Q397 PolarHBondContact OD2-OE1 3.33Å; D395-G398 PolarHBondContact O-N 2.99Å; D395-G398 PolarHBondContact OD1-N 2.79Å; D395-G398 VanDerWaalsContact OD1-N 3.1Å; D395-K399 PolarHBondContact N-O 3.43Å; D395-K399 WeakPolarHBondContact OD1-CB 3.26Å; D395-K399 PolarHBondContact OD1-N 3.08Å
396	K	95.6	Very high	94.3	Very high	136 Å²	136	48 Å²	48	59%	0.591	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-17.2	176.8	-83.9	-173.1	178.2	176.9	0	114.5	H363 R364 G398	H363-K396 WeakPolarHBondContact O-CE 3.42Å; H363-K396 PolarHBondContact O-NZ 3.09Å; R364-K396 WeakPolarHBondContact O-CG 2.73Å; R364-K396 PolarHBondContact O-N 3.17Å; K396-G398 VanDerWaalsContact C-N 3.35Å
397	Q	94.8	Very high	94.3	Very high	130 Å²	130	51 Å²	51	61%	0.607	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	3.4	175.6	-67	74.5	37.6	0	0	112.3	D395 K399	D395-Q397 PolarHBondContact O-N 3.39Å; D395-Q397 VanDerWaalsContact O-N 3.08Å; D395-Q397 VanDerWaalsContact OD1-CA 3.27Å; D395-Q397 WeakPolarHBondContact OD1-CA 3.42Å; D395-Q397 WeakPolarHBondContact OD1-CB 3.35Å; D395-Q397 PolarHBondContact OD1-N 2.95Å; D395-Q397 PolarHBondContact OD2-OE1 3.33Å; Q397-K399 VanDerWaalsContact C-N 3.3Å; Q397-K399 HydrophobicContact CB-CG 4.17Å
398	G	95.6	Very high	94.3	Very high	39 Å²	39	50.3 Å²	50.3	40%	0.402	27%	0.27	S	S	.	.	S	Bend	trans	73	22.2	-177.4	0	0	0	0	0	112.9	Q394 D395 K396	Q394-G398 PolarHBondContact OE1-O 3.21Å; D395-G398 PolarHBondContact O-N 2.99Å; D395-G398 PolarHBondContact OD1-N 2.79Å; D395-G398 VanDerWaalsContact OD1-N 3.1Å; K396-G398 VanDerWaalsContact C-N 3.35Å
399	K	95.1	Very high	94.5	Very high	108 Å²	108	53.1 Å²	53.1	47%	0.47	28%	0.276	S	S	.	.			trans	-100.9	134	179.8	-58.9	-61.2	-175	174.3	0	109.9	H370 Q394 D395 Q397 A403 V404	H370-K399 PolarHBondContact NE2-O 2.7Å; H370-K399 VanDerWaalsContact NE2-O 3.12Å; Q394-K399 CarbonylContact C-O 3.29Å; Q394-K399 VanDerWaalsContact CA-O 3.3Å; Q394-K399 WeakPolarHBondContact CA-O 3.32Å; D395-K399 PolarHBondContact N-O 3.43Å; D395-K399 WeakPolarHBondContact OD1-CB 3.26Å; D395-K399 PolarHBondContact OD1-N 3.08Å; Q397-K399 VanDerWaalsContact C-N 3.3Å; Q397-K399 HydrophobicContact CB-CG 4.17Å; K399-A403 HydrophobicContact CB-CB 4.18Å; K399-A403 HydrophobicContact CD-CB 4.06Å; K399-V404 HydrophobicContact CB-CG2 4.18Å
400	T	96.4	Very high	94.7	Very high	16 Å²	16	55.4 Å²	55.4	10%	0.098	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-79.2	167.2	168.4	61.1	0	0	0	0	110.3	H370 Q394 L402 A403 V404	H370-T400 VanDerWaalsContact NE2-C 3.34Å; Q394-T400 HydrophobicContact CG-CG2 3.89Å; T400-L402 PolarHBondContact O-N 2.7Å; T400-A403 PolarHBondContact O-N 3.04Å; T400-A403 PolarHBondContact OG1-N 3.05Å; T400-V404 PolarHBondContact O-N 3.23Å
401	A	96.1	Very high	94.7	Very high	4 Å²	4	53.8 Å²	53.8	3%	0.033	28%	0.279	C	S	.	.	H	α-helix	trans	-59.2	-32.3	175.1	0	0	0	0	0	112.7	L369 H370 V404 A405 I417	L369-A401 HydrophobicContact CB-CB 4.17Å; L369-A401 HydrophobicContact CD2-CB 3.71Å; L369-A401 HydrophobicContact CG-CB 3.67Å; H370-A401 PolarHBondContact NE2-N 3.46Å; H370-A401 VanDerWaalsContact NE2-N 3.16Å; A401-V404 PolarHBondContact O-N 3.07Å; A401-A405 WeakPolarHBondContact O-CB 3.48Å; A401-A405 PolarHBondContact O-N 3.28Å; A401-I417 HydrophobicContact CB-CD1 4.35Å
402	L	96.8	Very high	94.7	Very high	3 Å²	3	56.2 Å²	56.2	2%	0.016	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-46.8	172.6	179	62.6	0	0	0	111.5	T400 V404 A405 A406 V414 I417 I418 Q486 A489	T400-L402 PolarHBondContact O-N 2.7Å; L402-V404 VanDerWaalsContact C-N 3.34Å; L402-A405 PolarHBondContact O-N 3.39Å; L402-A406 WeakPolarHBondContact O-CB 3.47Å; L402-A406 PolarHBondContact O-N 3.45Å; L402-V414 HydrophobicContact CD1-CB 4.5Å; L402-V414 HydrophobicContact CD1-CG1 3.93Å; L402-I417 HydrophobicContact CB-CG2 3.95Å; L402-I417 HydrophobicContact CD1-CB 4.22Å; L402-I417 HydrophobicContact CD1-CG2 4.11Å; L402-I418 HydrophobicContact CD1-CD1 4.22Å; L402-I418 HydrophobicContact CD1-CG1 3.72Å; L402-I418 HydrophobicContact CD2-CG1 4.37Å; L402-Q486 HydrophobicContact CD2-CG 4.24Å; L402-A489 HydrophobicContact CD1-CB 3.95Å; L402-A489 HydrophobicContact CD2-CB 4.19Å; L402-A489 HydrophobicContact CG-CB 3.93Å
403	A	95.3	Very high	94.8	Very high	29 Å²	29	51.4 Å²	51.4	24%	0.24	26%	0.262	C	S	.	.	H	α-helix	trans	-68.6	-33.8	179.4	0	0	0	0	0	112.1	K399 T400 R407	K399-A403 HydrophobicContact CB-CB 4.18Å; K399-A403 HydrophobicContact CD-CB 4.06Å; T400-A403 PolarHBondContact O-N 3.04Å; T400-A403 PolarHBondContact OG1-N 3.05Å; A403-R407 WeakPolarHBondContact O-CB 3.49Å; A403-R407 PolarHBondContact O-N 3.33Å
404	V	94.8	Very high	94.8	Very high	3 Å²	3	49 Å²	49	2%	0.018	25%	0.25	C	C	.	.	H	α-helix	trans	-65.7	-46.4	172.7	173.8	0	0	0	0	111.1	E374 K399 T400 A401 L402 A406 R407 A408	E374-V404 HydrophobicContact CB-CG1 4.2Å; K399-V404 HydrophobicContact CB-CG2 4.18Å; T400-V404 PolarHBondContact O-N 3.23Å; A401-V404 PolarHBondContact O-N 3.07Å; L402-V404 VanDerWaalsContact C-N 3.34Å; V404-A406 VanDerWaalsContact C-N 3.35Å; V404-A406 PolarHBondContact O-N 3.02Å; V404-R407 PolarHBondContact O-N 3.45Å; V404-A408 WeakPolarHBondContact O-CB 3.19Å; V404-A408 PolarHBondContact O-N 2.92Å
405	A	95.8	Very high	94.8	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.4	-43.3	176.8	0	0	0	0	0	112.1	A373 A401 L402 A408 D409 E410 I413 V414 I417	A373-A405 HydrophobicContact CB-CB 4.06Å; A401-A405 WeakPolarHBondContact O-CB 3.48Å; A401-A405 PolarHBondContact O-N 3.28Å; L402-A405 PolarHBondContact O-N 3.39Å; A405-A408 PolarHBondContact O-N 3.36Å; A405-D409 PolarHBondContact O-N 3.35Å; A405-E410 PolarHBondContact O-N 3.46Å; A405-E410 VanDerWaalsContact O-N 3.09Å; A405-I413 HydrophobicContact CB-CB 4.35Å; A405-I413 HydrophobicContact CB-CG2 3.74Å; A405-V414 HydrophobicContact CB-CG2 3.78Å; A405-I417 HydrophobicContact CB-CD1 4.13Å
406	A	94.3	Very high	94.9	Very high	3 Å²	3	43.7 Å²	43.7	3%	0.025	22%	0.224	C	C	.	.	H	α-helix	trans	-62.6	-47.6	176.9	0	0	0	0	0	111.4	L402 V404 A408 D409 V414 A489 Q493	L402-A406 WeakPolarHBondContact O-CB 3.47Å; L402-A406 PolarHBondContact O-N 3.45Å; V404-A406 VanDerWaalsContact C-N 3.35Å; V404-A406 PolarHBondContact O-N 3.02Å; A406-A408 PolarHBondContact O-N 2.97Å; A406-D409 PolarHBondContact O-N 2.89Å; A406-D409 VanDerWaalsContact O-N 3.08Å; A406-V414 HydrophobicContact CB-CG2 4.11Å; A406-A489 HydrophobicContact CB-CB 4.04Å; A406-Q493 PolarHBondContact O-NE2 3.22Å
407	R	92.3	Very high	94.9	Very high	148 Å²	148	37.2 Å²	37.2	56%	0.558	20%	0.197	S	C	*	.	H	α-helix	trans	-61.8	-30.3	176.9	-172.9	-171.7	58.4	68.7	-3.1	113	A403 V404 D409	A403-R407 WeakPolarHBondContact O-CB 3.49Å; A403-R407 PolarHBondContact O-N 3.33Å; V404-R407 PolarHBondContact O-N 3.45Å; R407-D409 VanDerWaalsContact C-N 3.27Å
408	A	90.7	Very high	95	Very high	33 Å²	33	31 Å²	31	27%	0.273	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-1.5	178.9	0	0	0	0	0	113.9	V404 A405 A406 E410	V404-A408 WeakPolarHBondContact O-CB 3.19Å; V404-A408 PolarHBondContact O-N 2.92Å; A405-A408 PolarHBondContact O-N 3.36Å; A406-A408 PolarHBondContact O-N 2.97Å; A408-E410 HydrophobicContact CB-CG 4.03Å; A408-E410 PolarHBondContact O-N 2.96Å
409	D	90.8	Very high	95	Very high	96 Å²	96	29.7 Å²	29.7	51%	0.513	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	28.6	-174.4	-158.6	31.4	0	0	0	113.8	A405 A406 R407 V411 Q493	A405-D409 PolarHBondContact O-N 3.35Å; A406-D409 PolarHBondContact O-N 2.89Å; A406-D409 VanDerWaalsContact O-N 3.08Å; R407-D409 VanDerWaalsContact C-N 3.27Å; D409-V411 PolarHBondContact O-N 3.49Å; D409-V411 VanDerWaalsContact O-N 3.16Å; D409-Q493 VanDerWaalsContact CA-OE1 3.29Å; D409-Q493 PolarHBondContact OD1-OE1 3.42Å
410	E	94.2	Very high	95	Very high	59 Å²	59	24.5 Å²	24.5	28%	0.276	13%	0.128	S	C	.	.			trans	-90.8	68.3	-179.6	-68.5	-59.2	154.5	0	0	111.8	A376 A405 A408 I412 I413 V414	A376-E410 HydrophobicContact CB-CG 4.04Å; A376-E410 WeakPolarHBondContact CB-OE1 3.49Å; A376-E410 WeakPolarHBondContact CB-OE2 3.46Å; A405-E410 PolarHBondContact O-N 3.46Å; A405-E410 VanDerWaalsContact O-N 3.09Å; A408-E410 HydrophobicContact CB-CG 4.03Å; A408-E410 PolarHBondContact O-N 2.96Å; E410-I412 PolarHBondContact O-N 3.21Å; E410-I412 VanDerWaalsContact O-N 3.11Å; E410-I413 HydrophobicContact CB-CB 4.08Å; E410-I413 HydrophobicContact CB-CD1 4.12Å; E410-I413 HydrophobicContact CB-CG1 4.38Å; E410-I413 HydrophobicContact CG-CD1 4.4Å; E410-I413 PolarHBondContact O-N 3.05Å; E410-V414 PolarHBondContact O-N 3.45Å
411	V	93.1	Very high	94.9	Very high	29 Å²	29	25.3 Å²	25.3	18%	0.176	13%	0.131	C	C	.	.	H	α-helix	trans	-45.5	-45.3	-175.9	-178.5	0	0	0	0	113.2	D409 V414 D415 Q493 W494 R506	D409-V411 PolarHBondContact O-N 3.49Å; D409-V411 VanDerWaalsContact O-N 3.16Å; V411-V414 PolarHBondContact O-N 3.5Å; V411-D415 PolarHBondContact O-N 3.49Å; V411-D415 VanDerWaalsContact O-N 3.07Å; V411-Q493 HydrophobicContact CG2-CB 4.06Å; V411-Q493 HydrophobicContact CG2-CG 3.99Å; V411-W494 HydrophobicContact CG1-CH2 3.95Å; V411-W494 HydrophobicContact CG1-CZ2 4.12Å; V411-W494 HydrophobicContact CG2-CZ2 4.16Å; V411-R506 VanDerWaalsContact CG1-CZ 3.45Å; V411-R506 PolarHBondContact O-NH2 2.9Å
412	I	94.4	Very high	94.7	Very high	70 Å²	70	27.7 Å²	27.7	36%	0.359	14%	0.139	S	C	.	.	H	α-helix	trans	-65.7	-43.1	-177.8	-61.2	-178.7	0	0	0	110.6	V378 E410 D415 M416 L447	V378-I412 HydrophobicContact CG1-CG2 4.36Å; V378-I412 HydrophobicContact CG2-CG2 4Å; E410-I412 PolarHBondContact O-N 3.21Å; E410-I412 VanDerWaalsContact O-N 3.11Å; I412-D415 PolarHBondContact O-N 3.11Å; I412-M416 HydrophobicContact CG2-CG 4.44Å; I412-M416 HydrophobicContact CG2-SD 3.92Å; I412-M416 WeakPolarHBondContact O-CG 3.46Å; I412-M416 PolarHBondContact O-N 3.44Å; I412-L447 HydrophobicContact CB-CD1 4.18Å; I412-L447 HydrophobicContact CD1-CD1 3.93Å; I412-L447 HydrophobicContact CG1-CD1 3.81Å; I412-L447 HydrophobicContact CG2-CD1 3.52Å
413	I	96.6	Very high	94.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-70.1	-38.8	-178.9	-67.1	175.6	0	0	0	110.2	A373 V378 V381 A405 E410 D415 M416 I417	A373-I413 HydrophobicContact CB-CG2 3.95Å; V378-I413 HydrophobicContact CG2-CG1 4.32Å; V381-I413 HydrophobicContact CG1-CG2 4.14Å; V381-I413 HydrophobicContact CG2-CD1 4.04Å; V381-I413 HydrophobicContact CG2-CG1 4.25Å; V381-I413 HydrophobicContact CG2-CG2 4.16Å; A405-I413 HydrophobicContact CB-CB 4.35Å; A405-I413 HydrophobicContact CB-CG2 3.74Å; E410-I413 HydrophobicContact CB-CB 4.08Å; E410-I413 HydrophobicContact CB-CD1 4.12Å; E410-I413 HydrophobicContact CB-CG1 4.38Å; E410-I413 HydrophobicContact CG-CD1 4.4Å; E410-I413 PolarHBondContact O-N 3.05Å; I413-D415 VanDerWaalsContact C-N 3.33Å; I413-D415 PolarHBondContact O-N 2.7Å; I413-M416 WeakPolarHBondContact O-CB 3.4Å; I413-M416 PolarHBondContact O-N 3.13Å; I413-I417 HydrophobicContact CG2-CD1 3.76Å; I413-I417 HydrophobicContact CG2-CG1 4.27Å; I413-I417 VanDerWaalsContact O-CG1 3.32Å; I413-I417 WeakPolarHBondContact O-CG1 3.43Å; I413-I417 PolarHBondContact O-N 3.18Å
414	V	96.4	Very high	94.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-54.4	-51.8	171.1	172.4	0	0	0	0	110	L402 A405 A406 E410 V411 M416 I417 I418 A489	L402-V414 HydrophobicContact CD1-CB 4.5Å; L402-V414 HydrophobicContact CD1-CG1 3.93Å; A405-V414 HydrophobicContact CB-CG2 3.78Å; A406-V414 HydrophobicContact CB-CG2 4.11Å; E410-V414 PolarHBondContact O-N 3.45Å; V411-V414 PolarHBondContact O-N 3.5Å; V414-M416 VanDerWaalsContact C-N 3.3Å; V414-M416 PolarHBondContact O-N 3.39Å; V414-I417 PolarHBondContact O-N 3.47Å; V414-I418 HydrophobicContact CG1-CD1 3.8Å; V414-I418 HydrophobicContact CG1-CG1 4.48Å; V414-I418 VanDerWaalsContact O-CG1 3.26Å; V414-I418 WeakPolarHBondContact O-CG1 3.34Å; V414-I418 PolarHBondContact O-N 3.32Å; V414-A489 HydrophobicContact CG1-CB 4.04Å
415	D	96	Very high	93.9	Very high	10 Å²	10	33 Å²	33	5%	0.053	16%	0.162	C	C	.	.	H	α-helix	trans	-61.3	-39.9	180	-67.4	-1.3	0	0	0	111.9	V411 I412 I413 K419 R506 I510	V411-D415 PolarHBondContact O-N 3.49Å; V411-D415 VanDerWaalsContact O-N 3.07Å; I412-D415 PolarHBondContact O-N 3.11Å; I413-D415 VanDerWaalsContact C-N 3.33Å; I413-D415 PolarHBondContact O-N 2.7Å; D415-K419 WeakPolarHBondContact O-CB 3.24Å; D415-K419 WeakPolarHBondContact O-CG 3.34Å; D415-K419 PolarHBondContact O-N 2.6Å; D415-R506 IonicContact OD1-CZ 3.96Å; D415-R506 IonicContact OD1-NE 3.76Å; D415-R506 PolarHBondContact OD1-NE 3.36Å; D415-R506 IonicContact OD1-NH2 3.97Å; D415-R506 PolarHBondContact OD1-NH2 2.69Å; D415-R506 IonicContact OD2-NE 2.92Å; D415-R506 PolarHBondContact OD2-NE 3.05Å; D415-I510 HydrophobicContact CB-CD1 4.15Å; D415-I510 HydrophobicContact CB-CG1 4.09Å
416	M	97.1	Very high	93.5	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-63.2	-46.2	177.1	-71.3	171.4	71.2	0	0	112.5	V378 V381 D382 L385 I412 I413 V414 K419 A420 F445 K446	V378-M416 HydrophobicContact CG1-CE 4.24Å; V378-M416 HydrophobicContact CG1-SD 3.79Å; V378-M416 WeakPolarHBondContact O-CE 3.35Å; V381-M416 HydrophobicContact CB-CE 4.16Å; V381-M416 HydrophobicContact CG1-CB 4.44Å; V381-M416 HydrophobicContact CG1-CE 3.84Å; V381-M416 HydrophobicContact CG1-SD 4.39Å; D382-M416 HydrophobicContact CB-CE 3.51Å; L385-M416 HydrophobicContact CD1-CB 3.88Å; I412-M416 HydrophobicContact CG2-CG 4.44Å; I412-M416 HydrophobicContact CG2-SD 3.92Å; I412-M416 WeakPolarHBondContact O-CG 3.46Å; I412-M416 PolarHBondContact O-N 3.44Å; I413-M416 WeakPolarHBondContact O-CB 3.4Å; I413-M416 PolarHBondContact O-N 3.13Å; V414-M416 VanDerWaalsContact C-N 3.3Å; V414-M416 PolarHBondContact O-N 3.39Å; M416-K419 PolarHBondContact O-N 3.15Å; M416-A420 PolarHBondContact O-N 2.92Å; M416-F445 HydrophobicContact CB-CB 4.11Å; M416-F445 HydrophobicContact CE-CB 4.48Å; M416-F445 HydrophobicContact CG-CB 4.28Å; M416-F445 VanDerWaalsContact CG-O 3.24Å; M416-F445 WeakPolarHBondContact CG-O 3.48Å; M416-K446 HydrophobicContact CE-CG 4.1Å
417	I	96.8	Very high	93.1	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-64.2	-45.2	179.5	-66.5	169.2	0	0	0	109.8	L385 A401 L402 A405 I413 V414 K419 A420 E421	L385-I417 HydrophobicContact CD1-CG1 4.4Å; L385-I417 HydrophobicContact CD2-CG1 4.38Å; A401-I417 HydrophobicContact CB-CD1 4.35Å; L402-I417 HydrophobicContact CB-CG2 3.95Å; L402-I417 HydrophobicContact CD1-CB 4.22Å; L402-I417 HydrophobicContact CD1-CG2 4.11Å; A405-I417 HydrophobicContact CB-CD1 4.13Å; I413-I417 HydrophobicContact CG2-CD1 3.76Å; I413-I417 HydrophobicContact CG2-CG1 4.27Å; I413-I417 VanDerWaalsContact O-CG1 3.32Å; I413-I417 WeakPolarHBondContact O-CG1 3.43Å; I413-I417 PolarHBondContact O-N 3.18Å; V414-I417 PolarHBondContact O-N 3.47Å; I417-K419 PolarHBondContact O-N 2.83Å; I417-A420 PolarHBondContact O-N 3.13Å; I417-A420 VanDerWaalsContact O-N 3.12Å; I417-E421 HydrophobicContact CG2-CG 4.35Å; I417-E421 WeakPolarHBondContact O-CG 3.45Å; I417-E421 PolarHBondContact O-N 3.26Å
418	I	96.4	Very high	92.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62	-43.5	178.3	-60.3	172.8	0	0	0	110.8	L402 V414 A420 E421 R422 F482 Q486 I490 I510	L402-I418 HydrophobicContact CD1-CD1 4.22Å; L402-I418 HydrophobicContact CD1-CG1 3.72Å; L402-I418 HydrophobicContact CD2-CG1 4.37Å; V414-I418 HydrophobicContact CG1-CD1 3.8Å; V414-I418 HydrophobicContact CG1-CG1 4.48Å; V414-I418 VanDerWaalsContact O-CG1 3.26Å; V414-I418 WeakPolarHBondContact O-CG1 3.34Å; V414-I418 PolarHBondContact O-N 3.32Å; I418-A420 VanDerWaalsContact C-N 3.29Å; I418-A420 PolarHBondContact O-N 2.51Å; I418-E421 PolarHBondContact O-N 3.16Å; I418-R422 HydrophobicContact CG2-CG 4.46Å; I418-R422 WeakPolarHBondContact O-CB 3.46Å; I418-R422 VanDerWaalsContact O-CG 3.28Å; I418-R422 WeakPolarHBondContact O-CG 3.44Å; I418-R422 PolarHBondContact O-N 3.41Å; I418-F482 HydrophobicContact CG2-CD1 4.16Å; I418-F482 HydrophobicContact CG2-CE1 3.93Å; I418-Q486 HydrophobicContact CD1-CB 4.13Å; I418-Q486 HydrophobicContact CD1-CG 4.47Å; I418-Q486 HydrophobicContact CG1-CB 4.26Å; I418-Q486 HydrophobicContact CG1-CG 4.05Å; I418-Q486 HydrophobicContact CG2-CB 4.19Å; I418-Q486 HydrophobicContact CG2-CG 3.93Å; I418-I490 HydrophobicContact CD1-CD1 3.97Å; I418-I490 HydrophobicContact CD1-CG1 3.73Å; I418-I510 HydrophobicContact CB-CD1 4.26Å; I418-I510 HydrophobicContact CB-CG2 4.28Å; I418-I510 HydrophobicContact CD1-CD1 4.09Å; I418-I510 HydrophobicContact CG2-CD1 4.29Å; I418-I510 HydrophobicContact CG2-CG2 3.66Å
419	K	95.4	Very high	92.5	Very high	10 Å²	10	45.3 Å²	45.3	4%	0.043	22%	0.218	C	C	.	.	H	α-helix	trans	-58	-43.1	174.4	-74.5	168.7	-175.7	171.5	0	111.6	D415 M416 I417 Y423 F445 K446 I510 H513	D415-K419 WeakPolarHBondContact O-CB 3.24Å; D415-K419 WeakPolarHBondContact O-CG 3.34Å; D415-K419 PolarHBondContact O-N 2.6Å; M416-K419 PolarHBondContact O-N 3.15Å; I417-K419 PolarHBondContact O-N 2.83Å; K419-Y423 VanDerWaalsContact O-CB 3.27Å; K419-Y423 WeakPolarHBondContact O-CB 3.45Å; K419-Y423 PolarHBondContact O-N 3.22Å; K419-F445 HydrophobicContact CB-CD1 3.88Å; K419-F445 VanDerWaalsContact CD-O 3.25Å; K419-F445 WeakPolarHBondContact CD-O 3.46Å; K419-F445 PolarHBondContact NZ-O 3.02Å; K419-F445 VanDerWaalsContact NZ-O 3.07Å; K419-K446 PolarHBondContact NZ-O 3.1Å; K419-I510 HydrophobicContact CG-CB 4.34Å; K419-I510 HydrophobicContact CG-CG1 4.29Å; K419-I510 HydrophobicContact CG-CG2 3.99Å; K419-H513 HydrophobicContact CD-CB 4.1Å; K419-H513 HydrophobicContact CG-CB 4.13Å
420	A	95.1	Very high	92.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-66.2	-47.4	178.3	0	0	0	0	0	112.6	L385 L391 M416 I417 I418 R422 Y423 F424 F445	L385-A420 HydrophobicContact CB-CB 4.09Å; L385-A420 HydrophobicContact CD1-CB 3.97Å; L385-A420 HydrophobicContact CD2-CB 3.78Å; L385-A420 HydrophobicContact CG-CB 4.16Å; L391-A420 HydrophobicContact CD1-CB 4.04Å; M416-A420 PolarHBondContact O-N 2.92Å; I417-A420 PolarHBondContact O-N 3.13Å; I417-A420 VanDerWaalsContact O-N 3.12Å; I418-A420 VanDerWaalsContact C-N 3.29Å; I418-A420 PolarHBondContact O-N 2.51Å; A420-R422 VanDerWaalsContact C-N 3.26Å; A420-R422 PolarHBondContact O-N 3.22Å; A420-Y423 PolarHBondContact O-N 3.25Å; A420-Y423 VanDerWaalsContact O-N 3.17Å; A420-F424 HydrophobicContact CB-CD2 4.36Å; A420-F424 HydrophobicContact CB-CE2 4.27Å; A420-F424 WeakPolarHBondContact O-CD2 3.21Å; A420-F424 PolarHBondContact O-N 3.07Å; A420-F445 VanDerWaalsContact CA-CE1 3.47Å; A420-F445 HydrophobicContact CB-CD1 3.96Å; A420-F445 HydrophobicContact CB-CD2 4.26Å; A420-F445 HydrophobicContact CB-CE1 3.84Å; A420-F445 HydrophobicContact CB-CE2 4.12Å; A420-F445 HydrophobicContact CB-CG 4.16Å; A420-F445 HydrophobicContact CB-CZ 3.91Å
421	E	94.7	Very high	91.1	Very high	32 Å²	32	45.1 Å²	45.1	15%	0.15	22%	0.223	C	C	.	.	H	α-helix	trans	-53.6	-46.1	175.5	-73.1	-179.4	166.7	0	0	111.5	L391 I417 I418 T425 Q486	L391-E421 HydrophobicContact CB-CG 4.05Å; L391-E421 HydrophobicContact CD1-CB 4.21Å; L391-E421 HydrophobicContact CD1-CG 3.44Å; L391-E421 VanDerWaalsContact CD1-CG 3.44Å; L391-E421 HydrophobicContact CG-CG 4.37Å; I417-E421 HydrophobicContact CG2-CG 4.35Å; I417-E421 WeakPolarHBondContact O-CG 3.45Å; I417-E421 PolarHBondContact O-N 3.26Å; I418-E421 PolarHBondContact O-N 3.16Å; E421-T425 VanDerWaalsContact O-CB 3.27Å; E421-T425 WeakPolarHBondContact O-CB 3.37Å; E421-T425 PolarHBondContact O-N 3.35Å; E421-T425 PolarHBondContact O-OG1 3.45Å; E421-Q486 WeakPolarHBondContact OE2-CG 3.27Å; E421-Q486 PolarHBondContact OE2-NE2 3.44Å
422	R	92.4	Very high	89.7	Confident	54 Å²	54	52.7 Å²	52.7	20%	0.204	26%	0.256	C	S	.	.	H	α-helix	trans	-65.6	-46.2	178	-71.5	-174	66.9	133.5	15.4	111.9	I418 A420 T425 W426 W480	I418-R422 HydrophobicContact CG2-CG 4.46Å; I418-R422 WeakPolarHBondContact O-CB 3.46Å; I418-R422 VanDerWaalsContact O-CG 3.28Å; I418-R422 WeakPolarHBondContact O-CG 3.44Å; I418-R422 PolarHBondContact O-N 3.41Å; A420-R422 VanDerWaalsContact C-N 3.26Å; A420-R422 PolarHBondContact O-N 3.22Å; R422-T425 PolarHBondContact O-N 3.33Å; R422-W426 WeakPolarHBondContact O-CB 3.28Å; R422-W426 PolarHBondContact O-N 3.04Å; R422-W480 PolarHBondContact NH2-O 2.99Å
423	Y	90.9	Very high	88	Confident	33 Å²	33	54.6 Å²	54.6	13%	0.129	27%	0.266	C	S	.	.	H	α-helix	trans	-58.9	-49.6	178.3	170.7	-106.1	0	0	0	111.8	K419 A420 T425 W426 R427 L443 F445 L517	K419-Y423 VanDerWaalsContact O-CB 3.27Å; K419-Y423 WeakPolarHBondContact O-CB 3.45Å; K419-Y423 PolarHBondContact O-N 3.22Å; A420-Y423 PolarHBondContact O-N 3.25Å; A420-Y423 VanDerWaalsContact O-N 3.17Å; Y423-T425 PolarHBondContact O-N 3.43Å; Y423-W426 HydrophobicContact CE2-CZ3 4.5Å; Y423-W426 PolarHBondContact O-N 3.3Å; Y423-R427 VanDerWaalsContact O-CB 3.32Å; Y423-R427 WeakPolarHBondContact O-CB 3.24Å; Y423-R427 PolarHBondContact O-N 3.42Å; Y423-L443 HydrophobicContact CD2-CD1 4.49Å; Y423-L443 HydrophobicContact CE1-CD1 4.21Å; Y423-L443 HydrophobicContact CE1-CD2 3.77Å; Y423-L443 HydrophobicContact CE2-CD1 4.19Å; Y423-F445 HydrophobicContact CD1-CE1 4.06Å; Y423-F445 AromaticContact CD1-CZ 3.78Å; Y423-F445 HydrophobicContact CD1-CZ 3.78Å; Y423-F445 HydrophobicContact CE1-CZ 4.41Å; Y423-F445 HydrophobicContact CG-CE1 4.09Å; Y423-F445 HydrophobicContact CG-CZ 4.28Å; Y423-L517 HydrophobicContact CD2-CD1 3.54Å; Y423-L517 HydrophobicContact CE2-CD1 4.06Å; Y423-L517 HydrophobicContact CG-CD1 4.25Å
424	F	88.9	Confident	86	Confident	36 Å²	36	56.7 Å²	56.7	16%	0.158	28%	0.277	C	S	.	.	H	α-helix	trans	-71.1	-30.3	-179.5	-70.7	-64.6	0	0	0	113	L385 A420 R428 F445	L385-F424 WeakPolarHBondContact O-CE2 3.35Å; L385-F424 VanDerWaalsContact O-CZ 3.24Å; L385-F424 WeakPolarHBondContact O-CZ 3.22Å; A420-F424 HydrophobicContact CB-CD2 4.36Å; A420-F424 HydrophobicContact CB-CE2 4.27Å; A420-F424 WeakPolarHBondContact O-CD2 3.21Å; A420-F424 PolarHBondContact O-N 3.07Å; F424-R428 WeakPolarHBondContact O-CB 3.2Å; F424-R428 VanDerWaalsContact O-CG 3.31Å; F424-R428 WeakPolarHBondContact O-CG 3.36Å; F424-R428 PolarHBondContact O-N 3.4Å; F424-R428 PolarHBondContact O-NE 3.43Å; F424-F445 HydrophobicContact CE2-CZ 4.25Å
425	T	89.7	Confident	83.7	Confident	77 Å²	77	65 Å²	65	47%	0.472	32%	0.316	S	S	.	.	H	α-helix	trans	-66.2	-46.3	171.9	-60.1	0	0	0	0	111.1	E421 R422 Y423 R428 A429	E421-T425 VanDerWaalsContact O-CB 3.27Å; E421-T425 WeakPolarHBondContact O-CB 3.37Å; E421-T425 PolarHBondContact O-N 3.35Å; E421-T425 PolarHBondContact O-OG1 3.45Å; R422-T425 PolarHBondContact O-N 3.33Å; Y423-T425 PolarHBondContact O-N 3.43Å; T425-R428 PolarHBondContact O-N 3.12Å; T425-R428 PolarHBondContact OG1-NH2 3.42Å; T425-A429 PolarHBondContact O-N 3.05Å
426	W	87.8	Confident	81.3	Confident	70 Å²	70	71.3 Å²	71.3	27%	0.265	35%	0.35	S	S	.	.	H	α-helix	trans	-61.4	-44.6	174.3	174	84.8	0	0	0	111.8	R422 Y423 R428 A429 N430 L437 A518	R422-W426 WeakPolarHBondContact O-CB 3.28Å; R422-W426 PolarHBondContact O-N 3.04Å; Y423-W426 HydrophobicContact CE2-CZ3 4.5Å; Y423-W426 PolarHBondContact O-N 3.3Å; W426-R428 VanDerWaalsContact C-N 3.34Å; W426-R428 PolarHBondContact O-N 2.98Å; W426-A429 PolarHBondContact O-N 3.27Å; W426-A429 VanDerWaalsContact O-N 3.1Å; W426-N430 VanDerWaalsContact CD1-ND2 3.31Å; W426-N430 HydrophobicContact CZ2-CB 4.45Å; W426-N430 PolarHBondContact NE1-ND2 2.86Å; W426-N430 PolarHBondContact O-N 3Å; W426-N430 PolarHBondContact O-ND2 2.73Å; W426-L437 HydrophobicContact CH2-CD1 3.97Å; W426-L437 HydrophobicContact CZ3-CD1 4.35Å; W426-A518 HydrophobicContact CZ2-CB 3.93Å
427	R	84.4	Confident	79	Confident	110 Å²	110	74.1 Å²	74.1	42%	0.415	37%	0.365	S	S	.	.	H	α-helix	trans	-61.3	-39.6	-179.7	-171.5	177.9	177.6	-174.7	-2.9	112.6	Y423 A429 N430 N434	Y423-R427 VanDerWaalsContact O-CB 3.32Å; Y423-R427 WeakPolarHBondContact O-CB 3.24Å; Y423-R427 PolarHBondContact O-N 3.42Å; R427-A429 VanDerWaalsContact C-N 3.34Å; R427-N430 PolarHBondContact O-N 3.33Å; R427-N434 PolarHBondContact O-ND2 2.87Å
428	R	86.3	Confident	76.5	Confident	184 Å²	184	82.8 Å²	82.8	69%	0.694	41%	0.405	S	S	*	.	H	α-helix	trans	-67.8	-31.5	175.1	-74.5	-177.4	-64.5	174.4	1.2	113	F424 T425 W426 T431	F424-R428 WeakPolarHBondContact O-CB 3.2Å; F424-R428 VanDerWaalsContact O-CG 3.31Å; F424-R428 WeakPolarHBondContact O-CG 3.36Å; F424-R428 PolarHBondContact O-N 3.4Å; F424-R428 PolarHBondContact O-NE 3.43Å; T425-R428 PolarHBondContact O-N 3.12Å; T425-R428 PolarHBondContact OG1-NH2 3.42Å; W426-R428 VanDerWaalsContact C-N 3.34Å; W426-R428 PolarHBondContact O-N 2.98Å; R428-T431 PolarHBondContact O-OG1 3.05Å
429	A	86.1	Confident	74.3	Confident	79 Å²	79	85.8 Å²	85.8	65%	0.653	43%	0.426	S	S	*	.	H	α-helix	trans	-80.4	-18.5	177.7	0	0	0	0	0	113.4	T425 W426 R427	T425-A429 PolarHBondContact O-N 3.05Å; W426-A429 PolarHBondContact O-N 3.27Å; W426-A429 VanDerWaalsContact O-N 3.1Å; R427-A429 VanDerWaalsContact C-N 3.34Å
430	N	82.3	Confident	72.1	Confident	52 Å²	52	95.1 Å²	95.1	28%	0.278	47%	0.469	S	S	.	.			trans	-124.3	52.9	-172.7	-64.6	-88.1	0	0	0	112.1	W426 R427 E432 L433 N434	W426-N430 VanDerWaalsContact CD1-ND2 3.31Å; W426-N430 HydrophobicContact CZ2-CB 4.45Å; W426-N430 PolarHBondContact NE1-ND2 2.86Å; W426-N430 PolarHBondContact O-N 3Å; W426-N430 PolarHBondContact O-ND2 2.73Å; R427-N430 PolarHBondContact O-N 3.33Å; N430-E432 VanDerWaalsContact C-N 3.34Å; N430-E432 PolarHBondContact O-N 2.87Å; N430-L433 HydrophobicContact CB-CD1 4.25Å; N430-L433 PolarHBondContact O-N 3.33Å; N430-N434 PolarHBondContact O-ND2 3.22Å
431	T	72.6	Confident	70.3	Confident	100 Å²	100	97.4 Å²	97.4	61%	0.613	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-61.3	-35.5	-171.6	-42.4	0	0	0	0	114	R428 N434	R428-T431 PolarHBondContact O-OG1 3.05Å; T431-N434 WeakPolarHBondContact CA-ND2 3.29Å; T431-N434 WeakPolarHBondContact O-CB 3.2Å; T431-N434 PolarHBondContact O-N 3.33Å; T431-N434 PolarHBondContact O-ND2 3.23Å
432	E	63.8	Low	69.4	Low	187 Å²	187	101.5 Å²	101.5	87%	0.874	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-74.3	-25.6	-175.2	-63.1	179.2	178	0	0	114.3	N430 N434	N430-E432 VanDerWaalsContact C-N 3.34Å; N430-E432 PolarHBondContact O-N 2.87Å; E432-N434 VanDerWaalsContact C-N 3.26Å; E432-N434 PolarHBondContact O-N 3.43Å
433	L	58.4	Low	69.1	Low	110 Å²	110	101.1 Å²	101.1	58%	0.576	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-78.9	-8.9	177.8	-80.2	129.3	0	0	0	113.1	N430	N430-L433 HydrophobicContact CB-CD1 4.25Å; N430-L433 PolarHBondContact O-N 3.33Å
434	N	53.9	Low	69.1	Low	44 Å²	44	102.1 Å²	102.1	24%	0.235	53%	0.526	C	S	.	.	G	3₁₀ helix	trans	-80.6	-21	-169.1	-70	-35.2	0	0	0	115	R427 N430 T431 E432 N436	R427-N434 PolarHBondContact O-ND2 2.87Å; N430-N434 PolarHBondContact O-ND2 3.22Å; T431-N434 WeakPolarHBondContact CA-ND2 3.29Å; T431-N434 WeakPolarHBondContact O-CB 3.2Å; T431-N434 PolarHBondContact O-N 3.33Å; T431-N434 PolarHBondContact O-ND2 3.23Å; E432-N434 VanDerWaalsContact C-N 3.26Å; E432-N434 PolarHBondContact O-N 3.43Å; N434-N436 PolarHBondContact O-N 2.92Å
435	E	48.1	Very low	69.3	Low	175 Å²	175	100.4 Å²	100.4	82%	0.818	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-69.1	-21	180	-69.2	-172.1	166.9	0	0	112.8
436	N	45	Very low	69.4	Low	143 Å²	143	99.9 Å²	99.9	77%	0.765	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-110.8	4.9	-173.4	-71.7	-40.3	0	0	0	114.7	N434 H438	N434-N436 PolarHBondContact O-N 2.92Å; N436-H438 PolarHBondContact O-N 2.89Å
437	L	49.4	Very low	69.5	Low	60 Å²	60	99.7 Å²	99.7	31%	0.314	51%	0.514	S	S	.	.			trans	-81.5	60.7	-179.2	-86.6	156.9	0	0	0	111.9	W426 S439	W426-L437 HydrophobicContact CH2-CD1 3.97Å; W426-L437 HydrophobicContact CZ3-CD1 4.35Å; L437-S439 PolarHBondContact O-N 2.88Å
438	H	43.8	Very low	69.6	Low	182 Å²	182	96 Å²	96	84%	0.843	50%	0.503	S	S	*	.			trans	-80.4	75.8	154.3	-69.2	-48	0	0	0	108.2	N436	N436-H438 PolarHBondContact O-N 2.89Å
439	S	50.1	Low	69.5	Low	63 Å²	63	94.4 Å²	94.4	44%	0.441	50%	0.502	S	S	.	.			trans	-63.6	139.9	172.9	55.8	0	0	0	0	110.1	L437 S441	L437-S439 PolarHBondContact O-N 2.88Å; S439-S441 PolarHBondContact O-N 3.31Å; S439-S441 PolarHBondContact OG-O 3.29Å
440	Q	49.6	Very low	69.5	Low	206 Å²	206	95.2 Å²	95.2	96%	0.963	49%	0.489	S	S	*	.	S	Bend	trans	-61	-6.8	175.5	-64.8	176.4	-1.7	0	0	113.6
441	S	57.9	Low	69.5	Low	49 Å²	49	96.4 Å²	96.4	34%	0.343	51%	0.506	S	S	.	.	S	Bend	trans	-126.2	141.3	177.5	-63.1	0	0	0	0	111.4	S439	S439-S441 PolarHBondContact O-N 3.31Å; S439-S441 PolarHBondContact OG-O 3.29Å
442	P	76.2	Confident	70	Confident	117 Å²	117	99.1 Å²	99.1	76%	0.76	51%	0.512	S	S	*	.			trans	-68.6	141.6	175.8	27.9	-33.1	0	0	0	111.3	T444	P442-T444 PolarHBondContact O-N 3.38Å
443	L	86.6	Confident	70.9	Confident	46 Å²	46	90.4 Å²	90.4	24%	0.241	47%	0.471	C	S	.	.			trans	-56.2	131.6	174.7	179.2	65.4	0	0	0	110.2	K386 Y423 F445 L517	K386-L443 WeakPolarHBondContact CE-O 3.44Å; K386-L443 HydrophobicContact CG-CD2 4.36Å; K386-L443 HydrophobicContact CG-CG 4.49Å; K386-L443 PolarHBondContact NZ-O 3.17Å; Y423-L443 HydrophobicContact CD2-CD1 4.49Å; Y423-L443 HydrophobicContact CE1-CD1 4.21Å; Y423-L443 HydrophobicContact CE1-CD2 3.77Å; Y423-L443 HydrophobicContact CE2-CD1 4.19Å; L443-F445 HydrophobicContact CD1-CE1 4.18Å; L443-F445 HydrophobicContact CD1-CZ 4.01Å; L443-F445 HydrophobicContact CD2-CE2 4.31Å; L443-F445 HydrophobicContact CD2-CZ 4.08Å; L443-F445 HydrophobicContact CG-CE2 4.35Å; L443-F445 HydrophobicContact CG-CZ 4.17Å; L443-L517 HydrophobicContact CD1-CD1 4.08Å; L443-L517 HydrophobicContact CD1-CD2 4.34Å
444	T	89.3	Confident	72.3	Confident	54 Å²	54	92.2 Å²	92.2	33%	0.331	47%	0.474	S	S	.	.			trans	-152.2	148.2	170	-177.5	0	0	0	0	110	D382 P442 K446 H513	D382-T444 PolarHBondContact OD1-OG1 2.87Å; D382-T444 PolarHBondContact OD2-OG1 3.12Å; P442-T444 PolarHBondContact O-N 3.38Å; T444-K446 WeakPolarHBondContact OG1-CG 3.42Å; T444-K446 PolarHBondContact OG1-N 2.98Å; T444-H513 PolarHBondContact O-NE2 2.99Å
445	F	93.4	Very high	73.8	Confident	0 Å²	0	95.4 Å²	95.4	0%	0	49%	0.488	C	S	.	.			trans	-103.1	-6.5	176.2	-59	-69	0	0	0	112.4	D382 L385 K386 M416 K419 A420 Y423 F424 L443 H513	D382-F445 PolarHBondContact OD1-N 2.92Å; L385-F445 HydrophobicContact CB-CD2 3.55Å; L385-F445 HydrophobicContact CB-CE2 3.76Å; L385-F445 HydrophobicContact CB-CG 4.46Å; L385-F445 HydrophobicContact CD1-CB 4.23Å; L385-F445 HydrophobicContact CD1-CD2 4.17Å; L385-F445 HydrophobicContact CD1-CG 4.34Å; K386-F445 HydrophobicContact CG-CD2 4.45Å; K386-F445 HydrophobicContact CG-CE2 4.13Å; M416-F445 HydrophobicContact CB-CB 4.11Å; M416-F445 HydrophobicContact CE-CB 4.48Å; M416-F445 HydrophobicContact CG-CB 4.28Å; M416-F445 VanDerWaalsContact CG-O 3.24Å; M416-F445 WeakPolarHBondContact CG-O 3.48Å; K419-F445 HydrophobicContact CB-CD1 3.88Å; K419-F445 VanDerWaalsContact CD-O 3.25Å; K419-F445 WeakPolarHBondContact CD-O 3.46Å; K419-F445 PolarHBondContact NZ-O 3.02Å; K419-F445 VanDerWaalsContact NZ-O 3.07Å; A420-F445 VanDerWaalsContact CA-CE1 3.47Å; A420-F445 HydrophobicContact CB-CD1 3.96Å; A420-F445 HydrophobicContact CB-CD2 4.26Å; A420-F445 HydrophobicContact CB-CE1 3.84Å; A420-F445 HydrophobicContact CB-CE2 4.12Å; A420-F445 HydrophobicContact CB-CG 4.16Å; A420-F445 HydrophobicContact CB-CZ 3.91Å; Y423-F445 HydrophobicContact CD1-CE1 4.06Å; Y423-F445 AromaticContact CD1-CZ 3.78Å; Y423-F445 HydrophobicContact CD1-CZ 3.78Å; Y423-F445 HydrophobicContact CE1-CZ 4.41Å; Y423-F445 HydrophobicContact CG-CE1 4.09Å; Y423-F445 HydrophobicContact CG-CZ 4.28Å; F424-F445 HydrophobicContact CE2-CZ 4.25Å; L443-F445 HydrophobicContact CD1-CE1 4.18Å; L443-F445 HydrophobicContact CD1-CZ 4.01Å; L443-F445 HydrophobicContact CD2-CE2 4.31Å; L443-F445 HydrophobicContact CD2-CZ 4.08Å; L443-F445 HydrophobicContact CG-CE2 4.35Å; L443-F445 HydrophobicContact CG-CZ 4.17Å; F445-H513 AromaticContact CD1-CE1 3.68Å; F445-H513 AromaticContact CE1-CE1 3.99Å
446	K	92.9	Very high	75.6	Confident	67 Å²	67	89.1 Å²	89.1	29%	0.291	46%	0.461	S	S	.	.	S	Bend	trans	-57.7	170.6	177.1	-62.2	-175.8	-170.1	-177.3	0	112	V378 D379 D382 M416 K419 T444 D448	V378-K446 HydrophobicContact CG1-CD 4.42Å; V378-K446 HydrophobicContact CG1-CG 4.27Å; D379-K446 WeakPolarHBondContact OD1-CE 3.2Å; D379-K446 IonicContact OD1-NZ 3.9Å; D379-K446 PolarHBondContact OD1-NZ 2.84Å; D382-K446 HydrophobicContact CB-CD 4.41Å; D382-K446 VanDerWaalsContact CB-CE 3.48Å; D382-K446 HydrophobicContact CB-CG 4.05Å; D382-K446 VanDerWaalsContact OD2-CE 3.31Å; D382-K446 WeakPolarHBondContact OD2-CE 3.43Å; M416-K446 HydrophobicContact CE-CG 4.1Å; K419-K446 PolarHBondContact NZ-O 3.1Å; T444-K446 WeakPolarHBondContact OG1-CG 3.42Å; T444-K446 PolarHBondContact OG1-N 2.98Å; K446-D448 PolarHBondContact O-N 2.97Å
447	L	88.6	Confident	77.7	Confident	66 Å²	66	85.1 Å²	85.1	35%	0.346	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-60.6	135.4	172.8	-76.6	103.4	0	0	0	110.6	I412 H449	I412-L447 HydrophobicContact CB-CD1 4.18Å; I412-L447 HydrophobicContact CD1-CD1 3.93Å; I412-L447 HydrophobicContact CG1-CD1 3.81Å; I412-L447 HydrophobicContact CG2-CD1 3.52Å; L447-H449 PolarHBondContact O-CD2 3.48Å; L447-H449 VanDerWaalsContact O-CD2 3.27Å; L447-H449 PolarHBondContact O-N 3.11Å
448	D	86.8	Confident	79.5	Confident	33 Å²	33	84.2 Å²	84.2	18%	0.176	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-79.5	119.3	178.1	-172.3	12.1	0	0	0	110.3	K446 R450 S453 R457	K446-D448 PolarHBondContact O-N 2.97Å; D448-R450 WeakPolarHBondContact OD1-CB 3.22Å; D448-R450 WeakPolarHBondContact OD1-CG 3.21Å; D448-R450 IonicContact OD1-CZ 3.88Å; D448-R450 PolarHBondContact OD1-N 3.38Å; D448-R450 IonicContact OD1-NE 3.74Å; D448-R450 PolarHBondContact OD1-NE 2.93Å; D448-R450 IonicContact OD1-NH2 3.87Å; D448-R450 IonicContact OD2-CZ 3.19Å; D448-R450 IonicContact OD2-NE 3.64Å; D448-R450 PolarHBondContact OD2-NE 3.09Å; D448-R450 IonicContact OD2-NH2 3.59Å; D448-R450 PolarHBondContact OD2-NH2 2.97Å; D448-S453 VanDerWaalsContact CG-OG 3.31Å; D448-S453 WeakPolarHBondContact OD2-CB 3.43Å; D448-S453 PolarHBondContact OD2-OG 3.41Å; D448-R457 PolarHBondContact O-NE 2.98Å; D448-R457 PolarHBondContact O-NH1 2.89Å
449	H	85.4	Confident	81.6	Confident	149 Å²	149	76.8 Å²	76.8	69%	0.69	41%	0.408	S	S	*	.			trans	-113.4	7	176	-63.8	-69.7	0	0	0	113	L447	L447-H449 PolarHBondContact O-CD2 3.48Å; L447-H449 VanDerWaalsContact O-CD2 3.27Å; L447-H449 PolarHBondContact O-N 3.11Å
450	R	84.9	Confident	83.5	Confident	96 Å²	96	74 Å²	74	36%	0.362	39%	0.389	S	S	.	.			trans	-58.2	146.1	179.7	-73	179.5	-63.2	-177.5	8.5	112.1	D448 E452 S453 R457 E516	D448-R450 WeakPolarHBondContact OD1-CB 3.22Å; D448-R450 WeakPolarHBondContact OD1-CG 3.21Å; D448-R450 IonicContact OD1-CZ 3.88Å; D448-R450 PolarHBondContact OD1-N 3.38Å; D448-R450 IonicContact OD1-NE 3.74Å; D448-R450 PolarHBondContact OD1-NE 2.93Å; D448-R450 IonicContact OD1-NH2 3.87Å; D448-R450 IonicContact OD2-CZ 3.19Å; D448-R450 IonicContact OD2-NE 3.64Å; D448-R450 PolarHBondContact OD2-NE 3.09Å; D448-R450 IonicContact OD2-NH2 3.59Å; D448-R450 PolarHBondContact OD2-NH2 2.97Å; R450-E452 VanDerWaalsContact C-N 3.33Å; R450-E452 WeakPolarHBondContact CB-OE2 3.25Å; R450-S453 PolarHBondContact O-OG 2.92Å; R450-R457 PolarHBondContact O-NH2 2.95Å; R450-E516 IonicContact CZ-OE2 2.96Å; R450-E516 IonicContact NH2-OE2 3.56Å; R450-E516 PolarHBondContact NH2-OE2 3.45Å
451	A	83	Confident	85.6	Confident	77 Å²	77	69.7 Å²	69.7	64%	0.636	36%	0.364	S	S	*	.	S	Bend	trans	-73.4	-32.8	-178.9	0	0	0	0	0	110.9	S453 K454	A451-S453 PolarHBondContact O-N 3.49Å; A451-K454 WeakPolarHBondContact O-CB 3.47Å; A451-K454 PolarHBondContact O-N 2.91Å
452	E	82.1	Confident	87.1	Confident	158 Å²	158	70.8 Å²	70.8	74%	0.738	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-41.6	-179.4	-59.4	76.8	-167.1	0	0	111.3	R450 K454	R450-E452 VanDerWaalsContact C-N 3.33Å; R450-E452 WeakPolarHBondContact CB-OE2 3.25Å; E452-K454 VanDerWaalsContact C-N 3.32Å; E452-K454 PolarHBondContact O-N 3.11Å
453	S	84.3	Confident	87.8	Confident	3 Å²	3	65.2 Å²	65.2	2%	0.021	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-4.4	179.5	69	0	0	0	0	113.8	D448 R450 A451 H455 V456 R457 E516	D448-S453 VanDerWaalsContact CG-OG 3.31Å; D448-S453 WeakPolarHBondContact OD2-CB 3.43Å; D448-S453 PolarHBondContact OD2-OG 3.41Å; R450-S453 PolarHBondContact O-OG 2.92Å; A451-S453 PolarHBondContact O-N 3.49Å; S453-H455 VanDerWaalsContact C-N 3.31Å; S453-H455 PolarHBondContact O-N 3.36Å; S453-V456 PolarHBondContact O-N 3Å; S453-R457 WeakPolarHBondContact O-CB 3.35Å; S453-R457 WeakPolarHBondContact O-CG 3.5Å; S453-R457 PolarHBondContact O-N 2.91Å; S453-R457 PolarHBondContact OG-NE 3.43Å; S453-R457 VanDerWaalsContact OG-NE 3.11Å; S453-E516 WeakPolarHBondContact CB-OE1 3.2Å
454	K	86.8	Confident	88	Confident	149 Å²	149	63 Å²	63	65%	0.648	32%	0.316	S	S	*	.	H	α-helix	trans	-56.8	-41.5	-173.3	-174.9	-179.2	179.3	-179.1	0	113	A451 E452 G458	A451-K454 WeakPolarHBondContact O-CB 3.47Å; A451-K454 PolarHBondContact O-N 2.91Å; E452-K454 VanDerWaalsContact C-N 3.32Å; E452-K454 PolarHBondContact O-N 3.11Å; K454-G458 PolarHBondContact O-N 3.27Å
455	H	85.9	Confident	88.1	Confident	111 Å²	111	63.1 Å²	63.1	51%	0.514	31%	0.31	S	S	.	.	H	α-helix	trans	-65.4	-48.8	-179.8	-178.9	61.6	0	0	0	111.2	S453 R457 G458 T459	S453-H455 VanDerWaalsContact C-N 3.31Å; S453-H455 PolarHBondContact O-N 3.36Å; H455-R457 VanDerWaalsContact C-N 3.35Å; H455-R457 PolarHBondContact O-N 2.98Å; H455-G458 WeakPolarHBondContact O-CA 3.24Å; H455-G458 PolarHBondContact O-N 3.01Å; H455-G458 VanDerWaalsContact O-N 3.07Å; H455-T459 PolarHBondContact O-N 3.46Å; H455-T459 PolarHBondContact O-OG1 3.02Å
456	V	85.3	Confident	88	Confident	42 Å²	42	71.5 Å²	71.5	26%	0.255	34%	0.342	S	S	.	.	H	α-helix	trans	-65.1	-38.8	-179.7	-171.5	0	0	0	0	111.4	S453 G458 T459 A460 L512 P522	S453-V456 PolarHBondContact O-N 3Å; V456-G458 VanDerWaalsContact C-N 3.32Å; V456-G458 PolarHBondContact O-N 3.07Å; V456-T459 PolarHBondContact O-N 3.27Å; V456-A460 PolarHBondContact O-N 3.39Å; V456-L512 HydrophobicContact CB-CD1 4.4Å; V456-L512 HydrophobicContact CB-CD2 4.29Å; V456-L512 HydrophobicContact CG1-CD1 3.54Å; V456-L512 HydrophobicContact CG1-CD2 3.94Å; V456-L512 HydrophobicContact CG1-CG 4.4Å; V456-P522 HydrophobicContact CG1-CB 3.89Å
457	R	88.9	Confident	87.8	Confident	59 Å²	59	69.7 Å²	69.7	22%	0.223	34%	0.335	C	S	.	.	H	α-helix	trans	-62.2	-38.3	172	-69.8	-171.1	-68.1	134.6	-1.7	112.2	D448 R450 S453 H455 A460 W461 L509 L512	D448-R457 PolarHBondContact O-NE 2.98Å; D448-R457 PolarHBondContact O-NH1 2.89Å; R450-R457 PolarHBondContact O-NH2 2.95Å; S453-R457 WeakPolarHBondContact O-CB 3.35Å; S453-R457 WeakPolarHBondContact O-CG 3.5Å; S453-R457 PolarHBondContact O-N 2.91Å; S453-R457 PolarHBondContact OG-NE 3.43Å; S453-R457 VanDerWaalsContact OG-NE 3.11Å; H455-R457 VanDerWaalsContact C-N 3.35Å; H455-R457 PolarHBondContact O-N 2.98Å; R457-A460 PolarHBondContact O-N 3.33Å; R457-W461 WeakPolarHBondContact O-CB 3.31Å; R457-W461 PolarHBondContact O-N 3.38Å; R457-L509 HydrophobicContact CB-CD2 4.31Å; R457-L509 HydrophobicContact CG-CD2 3.84Å; R457-L512 HydrophobicContact CG-CD2 3.84Å
458	G	88.3	Confident	87.8	Confident	41 Å²	41	67 Å²	67	42%	0.423	32%	0.321	S	S	.	.	H	α-helix	trans	-62.4	-42.6	173.2	0	0	0	0	0	112.6	K454 H455 V456 W461 H462	K454-G458 PolarHBondContact O-N 3.27Å; H455-G458 WeakPolarHBondContact O-CA 3.24Å; H455-G458 PolarHBondContact O-N 3.01Å; H455-G458 VanDerWaalsContact O-N 3.07Å; V456-G458 VanDerWaalsContact C-N 3.32Å; V456-G458 PolarHBondContact O-N 3.07Å; G458-W461 PolarHBondContact O-N 2.73Å; G458-H462 WeakPolarHBondContact O-CB 3.49Å; G458-H462 PolarHBondContact O-N 3.48Å
459	T	88.3	Confident	87.9	Confident	26 Å²	26	71.8 Å²	71.8	16%	0.16	34%	0.342	C	S	.	.	H	α-helix	trans	-64.5	-43.3	174.9	-54	0	0	0	0	111.7	H455 V456 W461 H462 L463 L526 I542	H455-T459 PolarHBondContact O-N 3.46Å; H455-T459 PolarHBondContact O-OG1 3.02Å; V456-T459 PolarHBondContact O-N 3.27Å; T459-W461 VanDerWaalsContact C-N 3.34Å; T459-W461 PolarHBondContact O-N 2.99Å; T459-H462 PolarHBondContact O-N 3.38Å; T459-L463 WeakPolarHBondContact O-CB 3.32Å; T459-L463 PolarHBondContact O-N 3.5Å; T459-L526 HydrophobicContact CG2-CD2 4.18Å; T459-I542 HydrophobicContact CG2-CG2 3.79Å
460	A	89.6	Confident	88.1	Confident	5 Å²	5	69.3 Å²	69.3	4%	0.041	34%	0.34	C	S	.	.	H	α-helix	trans	-59.3	-43.9	174.9	0	0	0	0	0	112	V456 R457 L463 A464 L508	V456-A460 PolarHBondContact O-N 3.39Å; R457-A460 PolarHBondContact O-N 3.33Å; A460-L463 PolarHBondContact O-N 3.45Å; A460-A464 WeakPolarHBondContact O-CB 3.48Å; A460-A464 PolarHBondContact O-N 2.95Å; A460-L508 HydrophobicContact CB-CB 3.94Å; A460-L508 HydrophobicContact CB-CD1 4.27Å; A460-L508 WeakPolarHBondContact O-CD1 3.25Å
461	W	92.5	Very high	88.2	Confident	116 Å²	116	66 Å²	66	44%	0.439	34%	0.336	S	S	.	.	H	α-helix	trans	-62.6	-47.1	174.8	-175.2	92.2	0	0	0	111.7	R457 G458 T459 L463 A464 Y465	R457-W461 WeakPolarHBondContact O-CB 3.31Å; R457-W461 PolarHBondContact O-N 3.38Å; G458-W461 PolarHBondContact O-N 2.73Å; T459-W461 VanDerWaalsContact C-N 3.34Å; T459-W461 PolarHBondContact O-N 2.99Å; W461-L463 VanDerWaalsContact C-N 3.31Å; W461-L463 PolarHBondContact O-N 3.22Å; W461-A464 PolarHBondContact O-N 3.43Å; W461-Y465 AromaticContact CD1-CD2 3.62Å; W461-Y465 AromaticContact CD1-CE2 3.44Å; W461-Y465 VanDerWaalsContact CD1-CE2 3.44Å; W461-Y465 AromaticContact CD2-CD2 3.89Å; W461-Y465 HydrophobicContact CD2-CD2 3.89Å; W461-Y465 HydrophobicContact CD2-CE2 4.45Å; W461-Y465 AromaticContact CE2-CD2 3.52Å; W461-Y465 AromaticContact CE2-CE2 3.87Å; W461-Y465 AromaticContact CE2-CG 3.98Å; W461-Y465 AromaticContact CG-CD2 3.95Å; W461-Y465 HydrophobicContact CG-CD2 3.95Å; W461-Y465 HydrophobicContact CG-CE2 4.21Å; W461-Y465 HydrophobicContact CZ2-CD2 4.06Å; W461-Y465 HydrophobicContact CZ2-CG 4.03Å; W461-Y465 AromaticContact NE1-CD2 3.35Å; W461-Y465 VanDerWaalsContact NE1-CD2 3.35Å; W461-Y465 AromaticContact NE1-CE2 3.2Å; W461-Y465 AromaticContact NE1-CZ 3.91Å; W461-Y465 WeakPolarHBondContact O-CD2 3.43Å; W461-Y465 PolarHBondContact O-N 3.12Å
462	H	91.3	Very high	88.6	Confident	72 Å²	72	62.9 Å²	62.9	33%	0.333	31%	0.308	S	S	.	.	H	α-helix	trans	-59.8	-44.8	179	-175.3	72.5	0	0	0	111.3	G458 T459 R466	G458-H462 WeakPolarHBondContact O-CB 3.49Å; G458-H462 PolarHBondContact O-N 3.48Å; T459-H462 PolarHBondContact O-N 3.38Å; H462-R466 WeakPolarHBondContact O-CA 3.37Å; H462-R466 VanDerWaalsContact O-CB 3.24Å; H462-R466 WeakPolarHBondContact O-CB 3.4Å; H462-R466 PolarHBondContact O-N 2.9Å
463	L	89.8	Confident	89.1	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.273	C	S	.	.	I	π-helix	trans	-56.1	-54.1	175.6	178.7	54	0	0	0	111.1	T459 A460 W461 Y465 L467 L468 L508 L526 L530 V538 I542	T459-L463 WeakPolarHBondContact O-CB 3.32Å; T459-L463 PolarHBondContact O-N 3.5Å; A460-L463 PolarHBondContact O-N 3.45Å; W461-L463 VanDerWaalsContact C-N 3.31Å; W461-L463 PolarHBondContact O-N 3.22Å; L463-Y465 PolarHBondContact O-N 3.29Å; L463-L467 HydrophobicContact CD1-CB 3.83Å; L463-L467 HydrophobicContact CD1-CD1 4.36Å; L463-L467 PolarHBondContact O-N 3.18Å; L463-L468 HydrophobicContact CD1-CD2 3.61Å; L463-L468 HydrophobicContact CD1-CG 3.86Å; L463-L468 HydrophobicContact CG-CD1 4.27Å; L463-L468 HydrophobicContact CG-CD2 4.01Å; L463-L468 HydrophobicContact CG-CG 3.92Å; L463-L468 WeakPolarHBondContact O-CG 3.27Å; L463-L468 PolarHBondContact O-N 3.29Å; L463-L508 HydrophobicContact CB-CD1 4.27Å; L463-L508 HydrophobicContact CD2-CD1 3.94Å; L463-L508 HydrophobicContact CD2-CD2 4.13Å; L463-L508 HydrophobicContact CG-CD1 4.13Å; L463-L526 HydrophobicContact CD2-CD1 3.68Å; L463-L526 HydrophobicContact CD2-CD2 4.22Å; L463-L526 HydrophobicContact CD2-CG 4.25Å; L463-L530 HydrophobicContact CD1-CD1 4.47Å; L463-L530 HydrophobicContact CD1-CD2 4.17Å; L463-L530 HydrophobicContact CD2-CD1 4.39Å; L463-L530 HydrophobicContact CD2-CD2 4.39Å; L463-V538 HydrophobicContact CD1-CG1 3.57Å; L463-I542 HydrophobicContact CB-CD1 4.24Å; L463-I542 HydrophobicContact CD1-CD1 3.66Å; L463-I542 HydrophobicContact CD2-CD1 3.97Å; L463-I542 HydrophobicContact CG-CD1 4.16Å
464	A	91.4	Very high	89.5	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.289	C	S	.	.	I	π-helix	trans	-61.9	-44.2	-176.2	0	0	0	0	0	114	A460 W461 N505 L508	A460-A464 WeakPolarHBondContact O-CB 3.48Å; A460-A464 PolarHBondContact O-N 2.95Å; W461-A464 PolarHBondContact O-N 3.43Å; A464-N505 HydrophobicContact CB-CB 3.7Å; A464-L508 HydrophobicContact CB-CD1 4.16Å
465	Y	91.6	Very high	89.9	Confident	56 Å²	56	59.4 Å²	59.4	22%	0.22	29%	0.286	C	S	.	.	I	π-helix	trans	-92.4	-21.1	-173.1	-74.2	-91.6	0	0	0	114.4	W461 L463 Q501 D502 N505	W461-Y465 AromaticContact CD1-CD2 3.62Å; W461-Y465 AromaticContact CD1-CE2 3.44Å; W461-Y465 VanDerWaalsContact CD1-CE2 3.44Å; W461-Y465 AromaticContact CD2-CD2 3.89Å; W461-Y465 HydrophobicContact CD2-CD2 3.89Å; W461-Y465 HydrophobicContact CD2-CE2 4.45Å; W461-Y465 AromaticContact CE2-CD2 3.52Å; W461-Y465 AromaticContact CE2-CE2 3.87Å; W461-Y465 AromaticContact CE2-CG 3.98Å; W461-Y465 AromaticContact CG-CD2 3.95Å; W461-Y465 HydrophobicContact CG-CD2 3.95Å; W461-Y465 HydrophobicContact CG-CE2 4.21Å; W461-Y465 HydrophobicContact CZ2-CD2 4.06Å; W461-Y465 HydrophobicContact CZ2-CG 4.03Å; W461-Y465 AromaticContact NE1-CD2 3.35Å; W461-Y465 VanDerWaalsContact NE1-CD2 3.35Å; W461-Y465 AromaticContact NE1-CE2 3.2Å; W461-Y465 AromaticContact NE1-CZ 3.91Å; W461-Y465 WeakPolarHBondContact O-CD2 3.43Å; W461-Y465 PolarHBondContact O-N 3.12Å; L463-Y465 PolarHBondContact O-N 3.29Å; Y465-Q501 HydrophobicContact CD1-CB 3.7Å; Y465-Q501 HydrophobicContact CD1-CG 4.42Å; Y465-Q501 HydrophobicContact CE1-CB 3.86Å; Y465-Q501 HydrophobicContact CG-CB 4.23Å; Y465-Q501 PolarHBondContact O-NE2 3.33Å; Y465-D502 PolarHBondContact OH-OD1 3.5Å; Y465-N505 HydrophobicContact CE2-CB 3.85Å
466	R	90.1	Very high	90.2	Very high	176 Å²	176	54.1 Å²	54.1	66%	0.664	26%	0.261	S	S	*	.	I	π-helix	trans	-117.6	-25.9	-173.1	-57	-62.5	-171.1	166.9	1.5	114.5	H462	H462-R466 WeakPolarHBondContact O-CA 3.37Å; H462-R466 VanDerWaalsContact O-CB 3.24Å; H462-R466 WeakPolarHBondContact O-CB 3.4Å; H462-R466 PolarHBondContact O-N 2.9Å
467	L	88.3	Confident	90.6	Very high	29 Å²	29	52.1 Å²	52.1	15%	0.152	25%	0.249	C	C	.	.	I	π-helix	trans	-119.8	-30.1	-167.2	-58.7	177.3	0	0	0	114.1	L463 V538 K541 I542	L463-L467 HydrophobicContact CD1-CB 3.83Å; L463-L467 HydrophobicContact CD1-CD1 4.36Å; L463-L467 PolarHBondContact O-N 3.18Å; L467-V538 HydrophobicContact CB-CG1 3.75Å; L467-V538 HydrophobicContact CB-CG2 4.1Å; L467-V538 HydrophobicContact CD1-CG1 4.02Å; L467-V538 HydrophobicContact CG-CG1 4.43Å; L467-K541 HydrophobicContact CD2-CD 4.46Å; L467-I542 HydrophobicContact CD1-CD1 4.38Å; L467-I542 HydrophobicContact CD1-CG1 4.06Å
468	L	89.4	Confident	90.8	Very high	8 Å²	8	55.4 Å²	55.4	4%	0.042	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-77.3	142.4	177.6	-64.6	-174.8	0	0	0	112.6	L463 D472 W473 L476 Y500 L530	L463-L468 HydrophobicContact CD1-CD2 3.61Å; L463-L468 HydrophobicContact CD1-CG 3.86Å; L463-L468 HydrophobicContact CG-CD1 4.27Å; L463-L468 HydrophobicContact CG-CD2 4.01Å; L463-L468 HydrophobicContact CG-CG 3.92Å; L463-L468 WeakPolarHBondContact O-CG 3.27Å; L463-L468 PolarHBondContact O-N 3.29Å; L468-D472 HydrophobicContact CB-CB 4.29Å; L468-D472 HydrophobicContact CD2-CB 3.97Å; L468-W473 HydrophobicContact CD1-CB 4.23Å; L468-L476 HydrophobicContact CD1-CD1 4.18Å; L468-L476 HydrophobicContact CD2-CD1 3.94Å; L468-Y500 WeakPolarHBondContact O-CE2 3.31Å; L468-L530 HydrophobicContact CD2-CD2 4.32Å
469	E	89.9	Confident	91	Very high	134 Å²	134	57.2 Å²	57.2	63%	0.626	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-94.8	162.9	170.6	-64.6	-170.4	172.3	0	0	112	G471 D472	E469-G471 PolarHBondContact O-N 2.93Å; E469-G471 VanDerWaalsContact O-N 3.11Å; E469-D472 WeakPolarHBondContact CB-OD2 3.14Å; E469-D472 PolarHBondContact N-OD2 3.37Å; E469-D472 WeakPolarHBondContact O-CB 3.42Å; E469-D472 PolarHBondContact O-N 2.89Å; E469-D472 VanDerWaalsContact O-N 3.09Å
470	P	88.4	Confident	91.2	Very high	98 Å²	98	56.7 Å²	56.7	64%	0.636	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	118.8	174.5	-24.4	33.8	0	0	0	112	Y500	P470-Y500 HydrophobicContact CB-CD1 4.34Å; P470-Y500 HydrophobicContact CB-CG 4.41Å; P470-Y500 HydrophobicContact CG-CD1 4.07Å; P470-Y500 HydrophobicContact CG-CE1 3.8Å; P470-Y500 HydrophobicContact CG-CE2 4.35Å; P470-Y500 HydrophobicContact CG-CG 4.45Å
471	G	87.2	Confident	91.4	Very high	27 Å²	27	64.3 Å²	64.3	28%	0.278	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.7	-18.6	179.9	0	0	0	0	0	114.8	E469 W473 K474 R475	E469-G471 PolarHBondContact O-N 2.93Å; E469-G471 VanDerWaalsContact O-N 3.11Å; G471-W473 VanDerWaalsContact C-N 3.31Å; G471-W473 PolarHBondContact O-N 2.9Å; G471-K474 PolarHBondContact O-N 3.3Å; G471-R475 PolarHBondContact O-N 3.43Å
472	D	91.1	Very high	91.5	Very high	10 Å²	10	59.2 Å²	59.2	5%	0.053	28%	0.278	C	S	.	.	H	α-helix	trans	-61.7	-40.6	178.5	-75.6	-13.9	0	0	0	112	L468 E469 K474 R475 L476 I533 N535	L468-D472 HydrophobicContact CB-CB 4.29Å; L468-D472 HydrophobicContact CD2-CB 3.97Å; E469-D472 WeakPolarHBondContact CB-OD2 3.14Å; E469-D472 PolarHBondContact N-OD2 3.37Å; E469-D472 WeakPolarHBondContact O-CB 3.42Å; E469-D472 PolarHBondContact O-N 2.89Å; E469-D472 VanDerWaalsContact O-N 3.09Å; D472-K474 VanDerWaalsContact C-N 3.25Å; D472-K474 PolarHBondContact O-N 2.93Å; D472-R475 WeakPolarHBondContact O-CB 3.44Å; D472-R475 PolarHBondContact O-N 2.86Å; D472-R475 VanDerWaalsContact O-N 3.11Å; D472-L476 PolarHBondContact O-N 3.4Å; D472-I533 HydrophobicContact CB-CD1 4.23Å; D472-N535 PolarHBondContact OD2-ND2 3.17Å
473	W	93.1	Very high	91.7	Very high	4 Å²	4	58.9 Å²	58.9	2%	0.015	28%	0.281	C	S	.	.	H	α-helix	trans	-62.5	-32.5	179.2	77.8	-90.8	0	0	0	112.4	L468 G471 A477 V487 I490 E491 H503 M507	L468-W473 HydrophobicContact CD1-CB 4.23Å; G471-W473 VanDerWaalsContact C-N 3.31Å; G471-W473 PolarHBondContact O-N 2.9Å; W473-A477 VanDerWaalsContact O-CB 3.29Å; W473-A477 WeakPolarHBondContact O-CB 3.47Å; W473-A477 PolarHBondContact O-N 3.43Å; W473-V487 HydrophobicContact CH2-CG1 3.65Å; W473-V487 HydrophobicContact CZ3-CG1 3.93Å; W473-I490 HydrophobicContact CH2-CG2 4.32Å; W473-I490 HydrophobicContact CZ3-CG2 4.22Å; W473-E491 HydrophobicContact CH2-CG 3.44Å; W473-E491 VanDerWaalsContact CH2-CG 3.44Å; W473-E491 HydrophobicContact CZ2-CG 3.46Å; W473-E491 VanDerWaalsContact CZ2-CG 3.46Å; W473-E491 WeakPolarHBondContact CZ2-OE1 3.49Å; W473-H503 HydrophobicContact CD2-CB 4Å; W473-H503 HydrophobicContact CE3-CB 4.26Å; W473-H503 HydrophobicContact CH2-CB 4.02Å; W473-H503 HydrophobicContact CZ2-CB 3.76Å; W473-H503 AromaticContact CZ2-ND1 3.86Å; W473-H503 HydrophobicContact CZ3-CB 4.27Å; W473-M507 HydrophobicContact CB-CE 4.13Å; W473-M507 HydrophobicContact CE3-CB 4.22Å; W473-M507 HydrophobicContact CE3-CG 4.31Å; W473-M507 WeakPolarHBondContact O-CE 3.31Å
474	K	93.3	Very high	91.8	Very high	82 Å²	82	67.3 Å²	67.3	36%	0.357	32%	0.321	S	S	.	.	H	α-helix	trans	-70.1	-39.7	174.5	-65.9	-170.4	-180	-168.5	0	111.6	G471 D472 L476 A477 L478 V487 E491	G471-K474 PolarHBondContact O-N 3.3Å; D472-K474 VanDerWaalsContact C-N 3.25Å; D472-K474 PolarHBondContact O-N 2.93Å; K474-L476 VanDerWaalsContact C-N 3.34Å; K474-A477 PolarHBondContact O-N 3.5Å; K474-L478 WeakPolarHBondContact O-CB 3.26Å; K474-L478 PolarHBondContact O-N 3.43Å; K474-V487 HydrophobicContact CG-CG1 4.27Å; K474-E491 WeakPolarHBondContact CE-OE1 3.27Å; K474-E491 VanDerWaalsContact CE-OE2 3.32Å; K474-E491 WeakPolarHBondContact CE-OE2 3.38Å; K474-E491 IonicContact NZ-OE1 3.86Å; K474-E491 PolarHBondContact NZ-OE1 3.11Å; K474-E491 IonicContact NZ-OE2 3.72Å; K474-E491 PolarHBondContact NZ-OE2 3.24Å
475	R	93.4	Very high	91.9	Very high	152 Å²	152	73.5 Å²	73.5	57%	0.574	35%	0.35	S	S	*	.	H	α-helix	trans	-63.3	-42.7	175.9	-64.5	177	178.2	175.2	-0.1	110.7	G471 D472 L478 H479 I533	G471-R475 PolarHBondContact O-N 3.43Å; D472-R475 WeakPolarHBondContact O-CB 3.44Å; D472-R475 PolarHBondContact O-N 2.86Å; D472-R475 VanDerWaalsContact O-N 3.11Å; R475-L478 PolarHBondContact O-N 2.9Å; R475-H479 WeakPolarHBondContact O-CB 3.47Å; R475-H479 PolarHBondContact O-N 3.36Å; R475-I533 HydrophobicContact CB-CB 4.2Å; R475-I533 HydrophobicContact CB-CG2 3.62Å
476	L	93.3	Very high	92.1	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-62.5	-45.2	172.6	-74.7	171.7	0	0	0	111.9	L468 D472 K474 L478 H479 W480 M507 G529 L530 I533	L468-L476 HydrophobicContact CD1-CD1 4.18Å; L468-L476 HydrophobicContact CD2-CD1 3.94Å; D472-L476 PolarHBondContact O-N 3.4Å; K474-L476 VanDerWaalsContact C-N 3.34Å; L476-L478 VanDerWaalsContact C-N 3.33Å; L476-L478 PolarHBondContact O-N 2.72Å; L476-H479 WeakPolarHBondContact O-CB 3.49Å; L476-H479 PolarHBondContact O-N 3.49Å; L476-W480 HydrophobicContact CB-CE3 4.15Å; L476-W480 HydrophobicContact CB-CH2 4.46Å; L476-W480 HydrophobicContact CB-CZ3 3.9Å; L476-W480 HydrophobicContact CD2-CH2 4.02Å; L476-W480 HydrophobicContact CD2-CZ2 4.3Å; L476-W480 HydrophobicContact CD2-CZ3 4.3Å; L476-W480 HydrophobicContact CG-CZ3 4.46Å; L476-W480 PolarHBondContact O-N 3.23Å; L476-M507 HydrophobicContact CB-CE 3.72Å; L476-M507 HydrophobicContact CD1-CE 4.27Å; L476-G529 WeakPolarHBondContact CD2-O 3.17Å; L476-L530 HydrophobicContact CD1-CD2 4.34Å; L476-L530 HydrophobicContact CD2-CD2 4.45Å; L476-I533 HydrophobicContact CD1-CD1 4.15Å; L476-I533 HydrophobicContact CD2-CD1 3.88Å; L476-I533 HydrophobicContact CD2-CG1 4.24Å; L476-I533 HydrophobicContact CD2-CG2 3.89Å; L476-I533 HydrophobicContact CG-CD1 3.76Å; L476-I533 HydrophobicContact CG-CG2 4.1Å
477	A	93.8	Very high	92.3	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-59	-45.5	177.4	0	0	0	0	0	111.3	W473 K474 H479 W480 H481 F482 V487 M507	W473-A477 VanDerWaalsContact O-CB 3.29Å; W473-A477 WeakPolarHBondContact O-CB 3.47Å; W473-A477 PolarHBondContact O-N 3.43Å; K474-A477 PolarHBondContact O-N 3.5Å; A477-H479 PolarHBondContact O-N 3.45Å; A477-W480 CarbonylContact O-C 3.46Å; A477-W480 PolarHBondContact O-N 2.8Å; A477-H481 PolarHBondContact O-N 3.39Å; A477-F482 HydrophobicContact CB-CB 3.94Å; A477-F482 HydrophobicContact CB-CD2 3.77Å; A477-F482 HydrophobicContact CB-CE2 4.38Å; A477-F482 HydrophobicContact CB-CG 3.98Å; A477-F482 WeakPolarHBondContact O-CB 2.92Å; A477-F482 VanDerWaalsContact O-CD2 3.31Å; A477-F482 WeakPolarHBondContact O-CD2 3.5Å; A477-F482 PolarHBondContact O-N 2.93Å; A477-V487 HydrophobicContact CB-CG2 3.9Å; A477-M507 HydrophobicContact CB-CG 3.92Å; A477-M507 HydrophobicContact CB-SD 4.37Å
478	L	92.8	Very high	92.6	Very high	127 Å²	127	64.7 Å²	64.7	67%	0.665	33%	0.327	S	S	*	.	H	α-helix	trans	-62.8	-42.5	176.4	-174.3	67	0	0	0	111.9	K474 R475 L476 W480 H481	K474-L478 WeakPolarHBondContact O-CB 3.26Å; K474-L478 PolarHBondContact O-N 3.43Å; R475-L478 PolarHBondContact O-N 2.9Å; L476-L478 VanDerWaalsContact C-N 3.33Å; L476-L478 PolarHBondContact O-N 2.72Å; L478-W480 VanDerWaalsContact C-N 3.31Å; L478-W480 PolarHBondContact O-N 3.32Å; L478-H481 PolarHBondContact O-N 2.9Å; L478-H481 VanDerWaalsContact O-N 3.12Å
479	H	92.9	Very high	92.8	Very high	79 Å²	79	64.6 Å²	64.6	37%	0.366	33%	0.327	S	S	.	.	H	α-helix	trans	-60	-40.6	176.1	178.8	68	0	0	0	112.1	R475 L476 A477 H481 A532	R475-H479 WeakPolarHBondContact O-CB 3.47Å; R475-H479 PolarHBondContact O-N 3.36Å; L476-H479 WeakPolarHBondContact O-CB 3.49Å; L476-H479 PolarHBondContact O-N 3.49Å; A477-H479 PolarHBondContact O-N 3.45Å; H479-H481 PolarHBondContact O-N 2.85Å; H479-A532 WeakPolarHBondContact CE1-CB 3.48Å; H479-A532 WeakPolarHBondContact ND1-CB 3.25Å
480	W	92.7	Very high	93	Very high	16 Å²	16	58.2 Å²	58.2	6%	0.061	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	22.4	176.1	-64.1	-42.1	0	0	0	114.3	R422 L476 A477 L478 F482 M507 L508 W511 L526	R422-W480 PolarHBondContact NH2-O 2.99Å; L476-W480 HydrophobicContact CB-CE3 4.15Å; L476-W480 HydrophobicContact CB-CH2 4.46Å; L476-W480 HydrophobicContact CB-CZ3 3.9Å; L476-W480 HydrophobicContact CD2-CH2 4.02Å; L476-W480 HydrophobicContact CD2-CZ2 4.3Å; L476-W480 HydrophobicContact CD2-CZ3 4.3Å; L476-W480 HydrophobicContact CG-CZ3 4.46Å; L476-W480 PolarHBondContact O-N 3.23Å; A477-W480 CarbonylContact O-C 3.46Å; A477-W480 PolarHBondContact O-N 2.8Å; L478-W480 VanDerWaalsContact C-N 3.31Å; L478-W480 PolarHBondContact O-N 3.32Å; W480-F482 VanDerWaalsContact C-N 3.31Å; W480-F482 HydrophobicContact CB-CD2 4.36Å; W480-F482 HydrophobicContact CB-CE2 4.45Å; W480-F482 PolarHBondContact O-N 3.42Å; W480-M507 HydrophobicContact CE3-CE 4.47Å; W480-M507 HydrophobicContact CE3-SD 3.74Å; W480-M507 HydrophobicContact CZ3-CE 3.99Å; W480-M507 HydrophobicContact CZ3-SD 3.7Å; W480-L508 HydrophobicContact CH2-CD2 3.78Å; W480-L508 HydrophobicContact CZ3-CD2 3.73Å; W480-W511 AromaticContact CD1-NE1 3.66Å; W480-W511 AromaticContact CD2-CD1 3.38Å; W480-W511 HydrophobicContact CD2-CD2 4.32Å; W480-W511 AromaticContact CD2-CG 3.92Å; W480-W511 HydrophobicContact CD2-CG 3.92Å; W480-W511 AromaticContact CD2-NE1 3.45Å; W480-W511 AromaticContact CE2-CD1 3.81Å; W480-W511 AromaticContact CE2-CE2 3.66Å; W480-W511 AromaticContact CE2-NE1 3.34Å; W480-W511 VanDerWaalsContact CE2-NE1 3.34Å; W480-W511 HydrophobicContact CE3-CB 4.17Å; W480-W511 AromaticContact CE3-CD1 3.66Å; W480-W511 HydrophobicContact CE3-CD2 4.21Å; W480-W511 AromaticContact CE3-CG 3.73Å; W480-W511 HydrophobicContact CE3-CG 3.73Å; W480-W511 AromaticContact CG-CD1 3.54Å; W480-W511 HydrophobicContact CG-CG 4.46Å; W480-W511 AromaticContact CG-NE1 3.65Å; W480-W511 HydrophobicContact CH2-CD2 4.02Å; W480-W511 HydrophobicContact CH2-CE3 4.32Å; W480-W511 HydrophobicContact CH2-CG 4.4Å; W480-W511 HydrophobicContact CH2-CZ2 4.32Å; W480-W511 HydrophobicContact CZ2-CD2 4.14Å; W480-W511 AromaticContact CZ2-CE2 3.66Å; W480-W511 HydrophobicContact CZ2-CH2 4.43Å; W480-W511 AromaticContact CZ2-CZ2 3.81Å; W480-W511 HydrophobicContact CZ2-CZ2 3.81Å; W480-W511 AromaticContact CZ2-NE1 3.85Å; W480-W511 HydrophobicContact CZ3-CB 4.42Å; W480-W511 HydrophobicContact CZ3-CD2 4.05Å; W480-W511 AromaticContact CZ3-CG 3.99Å; W480-W511 HydrophobicContact CZ3-CG 3.99Å; W480-W511 AromaticContact NE1-NE1 3.46Å; W480-L526 HydrophobicContact CH2-CD1 3.85Å; W480-L526 HydrophobicContact CZ2-CD1 4.27Å
481	H	92.1	Very high	93.1	Very high	165 Å²	165	56.7 Å²	56.7	76%	0.764	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	33	172	-50.8	-64	0	0	0	115.2	A477 L478 H479	A477-H481 PolarHBondContact O-N 3.39Å; L478-H481 PolarHBondContact O-N 2.9Å; L478-H481 VanDerWaalsContact O-N 3.12Å; H479-H481 PolarHBondContact O-N 2.85Å
482	F	95.4	Very high	93.1	Very high	9 Å²	9	60.8 Å²	60.8	4%	0.039	29%	0.294	C	S	.	.			trans	-65.4	139.3	163.5	-76	-102.5	0	0	0	109.7	I418 A477 W480 Q486 V487 I490 M507 I510 W511	I418-F482 HydrophobicContact CG2-CD1 4.16Å; I418-F482 HydrophobicContact CG2-CE1 3.93Å; A477-F482 HydrophobicContact CB-CB 3.94Å; A477-F482 HydrophobicContact CB-CD2 3.77Å; A477-F482 HydrophobicContact CB-CE2 4.38Å; A477-F482 HydrophobicContact CB-CG 3.98Å; A477-F482 WeakPolarHBondContact O-CB 2.92Å; A477-F482 VanDerWaalsContact O-CD2 3.31Å; A477-F482 WeakPolarHBondContact O-CD2 3.5Å; A477-F482 PolarHBondContact O-N 2.93Å; W480-F482 VanDerWaalsContact C-N 3.31Å; W480-F482 HydrophobicContact CB-CD2 4.36Å; W480-F482 HydrophobicContact CB-CE2 4.45Å; W480-F482 PolarHBondContact O-N 3.42Å; F482-Q486 VanDerWaalsContact CA-OE1 3.31Å; F482-Q486 HydrophobicContact CD1-CB 4.17Å; F482-V487 HydrophobicContact CB-CG2 3.91Å; F482-I490 HydrophobicContact CD1-CD1 4.49Å; F482-I490 HydrophobicContact CE1-CD1 4.21Å; F482-M507 HydrophobicContact CD2-CG 4.33Å; F482-M507 HydrophobicContact CE1-CG 4.19Å; F482-M507 HydrophobicContact CE2-CG 3.63Å; F482-M507 HydrophobicContact CE2-SD 3.66Å; F482-M507 HydrophobicContact CZ-CB 4.44Å; F482-M507 HydrophobicContact CZ-CG 3.59Å; F482-M507 WeakPolarHBondContact CZ-O 3.02Å; F482-M507 HydrophobicContact CZ-SD 4.05Å; F482-I510 HydrophobicContact CE1-CB 4.25Å; F482-I510 HydrophobicContact CE1-CG2 3.74Å; F482-I510 HydrophobicContact CZ-CB 4.17Å; F482-I510 HydrophobicContact CZ-CG2 3.89Å; F482-W511 HydrophobicContact CE2-CB 4.31Å; F482-W511 HydrophobicContact CZ-CB 4.37Å
483	T	94.7	Very high	92.5	Very high	65 Å²	65	60.9 Å²	60.9	40%	0.399	29%	0.294	S	S	.	.			trans	-75.9	157.7	175.9	73.6	0	0	0	0	110.8	Q485 Q486 V487	T483-Q485 PolarHBondContact O-N 2.94Å; T483-Q486 PolarHBondContact O-N 2.99Å; T483-Q486 VanDerWaalsContact O-N 3.11Å; T483-Q486 VanDerWaalsContact OG1-CG 3.24Å; T483-Q486 WeakPolarHBondContact OG1-CG 3.45Å; T483-Q486 PolarHBondContact OG1-N 3.45Å; T483-Q486 VanDerWaalsContact OG1-N 3.16Å; T483-V487 WeakPolarHBondContact O-CG2 3.46Å; T483-V487 PolarHBondContact O-N 2.88Å
484	E	93.9	Very high	92	Very high	177 Å²	177	65.1 Å²	65.1	83%	0.827	31%	0.31	S	S	*	.	H	α-helix	trans	-56.7	-35.9	174.7	-66	-173.5	165.9	0	0	112	V487 A488	E484-V487 PolarHBondContact O-N 3.41Å; E484-A488 VanDerWaalsContact O-CB 3.26Å; E484-A488 WeakPolarHBondContact O-CB 3.34Å; E484-A488 PolarHBondContact O-N 3.43Å
485	Q	93.3	Very high	91.3	Very high	129 Å²	129	68 Å²	68	60%	0.603	34%	0.335	S	S	*	.	H	α-helix	trans	-66.3	-41.6	177	-65	179.6	-1.6	0	0	112.1	T483 A488 A489	T483-Q485 PolarHBondContact O-N 2.94Å; Q485-A488 PolarHBondContact O-N 3.06Å; Q485-A489 WeakPolarHBondContact O-CB 3.37Å; Q485-A489 PolarHBondContact O-N 3.28Å
486	Q	95.3	Very high	90.6	Very high	7 Å²	7	63.2 Å²	63.2	3%	0.033	33%	0.333	C	S	.	.	H	α-helix	trans	-65.3	-43.7	175.9	-68.1	169.9	-11.2	0	0	111.5	L402 I418 E421 F482 T483 A489 I490	L402-Q486 HydrophobicContact CD2-CG 4.24Å; I418-Q486 HydrophobicContact CD1-CB 4.13Å; I418-Q486 HydrophobicContact CD1-CG 4.47Å; I418-Q486 HydrophobicContact CG1-CB 4.26Å; I418-Q486 HydrophobicContact CG1-CG 4.05Å; I418-Q486 HydrophobicContact CG2-CB 4.19Å; I418-Q486 HydrophobicContact CG2-CG 3.93Å; E421-Q486 WeakPolarHBondContact OE2-CG 3.27Å; E421-Q486 PolarHBondContact OE2-NE2 3.44Å; F482-Q486 VanDerWaalsContact CA-OE1 3.31Å; F482-Q486 HydrophobicContact CD1-CB 4.17Å; T483-Q486 PolarHBondContact O-N 2.99Å; T483-Q486 VanDerWaalsContact O-N 3.11Å; T483-Q486 VanDerWaalsContact OG1-CG 3.24Å; T483-Q486 WeakPolarHBondContact OG1-CG 3.45Å; T483-Q486 PolarHBondContact OG1-N 3.45Å; T483-Q486 VanDerWaalsContact OG1-N 3.16Å; Q486-A489 PolarHBondContact O-N 3.4Å; Q486-I490 WeakPolarHBondContact O-CG1 3.36Å; Q486-I490 PolarHBondContact O-N 2.9Å
487	V	95	Very high	89.8	Confident	20 Å²	20	73 Å²	73	12%	0.121	38%	0.375	C	S	.	.	H	α-helix	trans	-62.2	-46.9	176.5	175.2	0	0	0	0	110.2	W473 K474 A477 F482 T483 E484 A489 I490 E491	W473-V487 HydrophobicContact CH2-CG1 3.65Å; W473-V487 HydrophobicContact CZ3-CG1 3.93Å; K474-V487 HydrophobicContact CG-CG1 4.27Å; A477-V487 HydrophobicContact CB-CG2 3.9Å; F482-V487 HydrophobicContact CB-CG2 3.91Å; T483-V487 WeakPolarHBondContact O-CG2 3.46Å; T483-V487 PolarHBondContact O-N 2.88Å; E484-V487 PolarHBondContact O-N 3.41Å; V487-A489 PolarHBondContact O-N 3.26Å; V487-I490 PolarHBondContact O-N 3.45Å; V487-E491 WeakPolarHBondContact O-CG 3.35Å; V487-E491 PolarHBondContact O-N 2.97Å
488	A	93.6	Very high	89.3	Confident	50 Å²	50	81.9 Å²	81.9	41%	0.413	41%	0.409	S	S	.	.	H	α-helix	trans	-60.4	-43	177.2	0	0	0	0	0	112.2	E484 Q485 I490 E491 E492	E484-A488 VanDerWaalsContact O-CB 3.26Å; E484-A488 WeakPolarHBondContact O-CB 3.34Å; E484-A488 PolarHBondContact O-N 3.43Å; Q485-A488 PolarHBondContact O-N 3.06Å; A488-I490 VanDerWaalsContact C-N 3.32Å; A488-I490 PolarHBondContact O-N 2.93Å; A488-E491 PolarHBondContact O-N 2.86Å; A488-E491 VanDerWaalsContact O-N 3.12Å; A488-E492 WeakPolarHBondContact O-CB 3.24Å; A488-E492 PolarHBondContact O-N 3.41Å
489	A	94.1	Very high	89.1	Confident	5 Å²	5	76.8 Å²	76.8	4%	0.041	38%	0.384	C	S	.	.	H	α-helix	trans	-63	-35.8	177.1	0	0	0	0	0	112.8	L402 A406 V414 Q485 Q486 V487	L402-A489 HydrophobicContact CD1-CB 3.95Å; L402-A489 HydrophobicContact CD2-CB 4.19Å; L402-A489 HydrophobicContact CG-CB 3.93Å; A406-A489 HydrophobicContact CB-CB 4.04Å; V414-A489 HydrophobicContact CG1-CB 4.04Å; Q485-A489 WeakPolarHBondContact O-CB 3.37Å; Q485-A489 PolarHBondContact O-N 3.28Å; Q486-A489 PolarHBondContact O-N 3.4Å; V487-A489 PolarHBondContact O-N 3.26Å
490	I	93.9	Very high	88.9	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-66.5	-42.1	172.9	-67.1	167.5	0	0	0	110.4	I418 W473 F482 Q486 V487 A488 H503 R506 M507 I510	I418-I490 HydrophobicContact CD1-CD1 3.97Å; I418-I490 HydrophobicContact CD1-CG1 3.73Å; W473-I490 HydrophobicContact CH2-CG2 4.32Å; W473-I490 HydrophobicContact CZ3-CG2 4.22Å; F482-I490 HydrophobicContact CD1-CD1 4.49Å; F482-I490 HydrophobicContact CE1-CD1 4.21Å; Q486-I490 WeakPolarHBondContact O-CG1 3.36Å; Q486-I490 PolarHBondContact O-N 2.9Å; V487-I490 PolarHBondContact O-N 3.45Å; A488-I490 VanDerWaalsContact C-N 3.32Å; A488-I490 PolarHBondContact O-N 2.93Å; I490-H503 HydrophobicContact CG2-CB 3.87Å; I490-H503 PolarHBondContact O-CD2 3.38Å; I490-H503 VanDerWaalsContact O-CD2 3.32Å; I490-H503 PolarHBondContact O-NE2 3.34Å; I490-R506 PolarHBondContact O-NH1 3.38Å; I490-R506 VanDerWaalsContact O-NH1 3.11Å; I490-M507 HydrophobicContact CD1-CB 4.34Å; I490-I510 HydrophobicContact CD1-CD1 3.93Å; I490-I510 HydrophobicContact CG1-CD1 4.41Å
491	E	91.3	Very high	88.9	Confident	66 Å²	66	76 Å²	76	31%	0.308	38%	0.379	S	S	.	.	H	α-helix	trans	-69.6	-33.8	-179.1	-68.6	-157.2	115.6	0	0	114.9	W473 K474 V487 A488 Q493 W494	W473-E491 HydrophobicContact CH2-CG 3.44Å; W473-E491 VanDerWaalsContact CH2-CG 3.44Å; W473-E491 HydrophobicContact CZ2-CG 3.46Å; W473-E491 VanDerWaalsContact CZ2-CG 3.46Å; W473-E491 WeakPolarHBondContact CZ2-OE1 3.49Å; K474-E491 WeakPolarHBondContact CE-OE1 3.27Å; K474-E491 VanDerWaalsContact CE-OE2 3.32Å; K474-E491 WeakPolarHBondContact CE-OE2 3.38Å; K474-E491 IonicContact NZ-OE1 3.86Å; K474-E491 PolarHBondContact NZ-OE1 3.11Å; K474-E491 IonicContact NZ-OE2 3.72Å; K474-E491 PolarHBondContact NZ-OE2 3.24Å; V487-E491 WeakPolarHBondContact O-CG 3.35Å; V487-E491 PolarHBondContact O-N 2.97Å; A488-E491 PolarHBondContact O-N 2.86Å; A488-E491 VanDerWaalsContact O-N 3.12Å; E491-Q493 PolarHBondContact O-N 2.88Å; E491-Q493 VanDerWaalsContact O-N 3.14Å; E491-W494 PolarHBondContact O-N 3.1Å
492	E	87.3	Confident	88.9	Confident	113 Å²	113	70.4 Å²	70.4	53%	0.528	36%	0.355	S	S	.	.	H	α-helix	trans	-62.7	-22.1	-173.8	-169.6	167.6	-179.1	0	0	112.4	A488	A488-E492 WeakPolarHBondContact O-CB 3.24Å; A488-E492 PolarHBondContact O-N 3.41Å
493	Q	77.8	Confident	88.8	Confident	13 Å²	13	70.2 Å²	70.2	6%	0.061	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-35.1	-176.4	-55.9	-59.5	-92.8	0	0	114.1	A406 D409 V411 E491 R506	A406-Q493 PolarHBondContact O-NE2 3.22Å; D409-Q493 VanDerWaalsContact CA-OE1 3.29Å; D409-Q493 PolarHBondContact OD1-OE1 3.42Å; V411-Q493 HydrophobicContact CG2-CB 4.06Å; V411-Q493 HydrophobicContact CG2-CG 3.99Å; E491-Q493 PolarHBondContact O-N 2.88Å; E491-Q493 VanDerWaalsContact O-N 3.14Å; Q493-R506 VanDerWaalsContact CG-NH1 3.31Å
494	W	82.6	Confident	88.7	Confident	93 Å²	93	67.1 Å²	67.1	35%	0.352	34%	0.335	S	S	.	.			trans	-134	123.7	-175.8	-63	-49.6	0	0	0	113.9	V411 E491 S499 D502 H503 R506	V411-W494 HydrophobicContact CG1-CH2 3.95Å; V411-W494 HydrophobicContact CG1-CZ2 4.12Å; V411-W494 HydrophobicContact CG2-CZ2 4.16Å; E491-W494 PolarHBondContact O-N 3.1Å; W494-S499 WeakPolarHBondContact O-CB 3.48Å; W494-S499 PolarHBondContact O-OG 3.2Å; W494-D502 HydrophobicContact CD2-CB 4.15Å; W494-D502 HydrophobicContact CE3-CB 3.32Å; W494-D502 HydrophobicContact CH2-CB 4.1Å; W494-D502 HydrophobicContact CZ3-CB 3.27Å; W494-H503 AromaticContact CE3-CD2 3.77Å; W494-H503 PolarHBondContact O-CE1 3.42Å; W494-H503 VanDerWaalsContact O-CE1 3.24Å; W494-H503 PolarHBondContact O-NE2 3.39Å; W494-R506 VanDerWaalsContact CH2-CD 3.43Å; W494-R506 HydrophobicContact CH2-CG 4.26Å; W494-R506 HydrophobicContact CZ3-CG 4.05Å
495	T	77.3	Confident	88.7	Confident	142 Å²	142	59.9 Å²	59.9	87%	0.871	30%	0.302	S	S	*	.			trans	-105.3	128.2	176.1	64.7	0	0	0	0	111.3
496	G	79.9	Confident	88.8	Confident	52 Å²	52	54.1 Å²	54.1	54%	0.536	28%	0.275	S	S	.	.	S	Bend	trans	159.2	168.8	173	0	0	0	0	0	114	R498 S499	G496-R498 PolarHBondContact O-N 2.84Å; G496-R498 VanDerWaalsContact O-N 3.16Å; G496-S499 PolarHBondContact O-N 3.45Å; G496-S499 PolarHBondContact O-OG 3.07Å
497	K	76.6	Confident	88.8	Confident	206 Å²	206	53.8 Å²	53.8	90%	0.896	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-19	-178.4	-66.9	-173.7	-179.9	-178.2	0	114
498	R	83.3	Confident	88.7	Confident	185 Å²	185	52.9 Å²	52.9	70%	0.698	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	1.9	179.5	-69.2	-172	-178.5	173.3	1	114.1	G496 Y500 Q501	G496-R498 PolarHBondContact O-N 2.84Å; G496-R498 VanDerWaalsContact O-N 3.16Å; R498-Y500 PolarHBondContact O-N 3.36Å; R498-Y500 VanDerWaalsContact O-N 3.1Å; R498-Q501 WeakPolarHBondContact O-CB 3.5Å; R498-Q501 WeakPolarHBondContact O-CG 3.49Å; R498-Q501 PolarHBondContact O-N 2.91Å
499	S	88.1	Confident	88.7	Confident	21 Å²	21	52.5 Å²	52.5	15%	0.147	26%	0.259	C	S	.	.	H	α-helix	trans	-62.7	-23	-176.9	60.9	0	0	0	0	113.3	W494 G496 Q501 D502 H503	W494-S499 WeakPolarHBondContact O-CB 3.48Å; W494-S499 PolarHBondContact O-OG 3.2Å; G496-S499 PolarHBondContact O-N 3.45Å; G496-S499 PolarHBondContact O-OG 3.07Å; S499-Q501 PolarHBondContact O-N 2.95Å; S499-Q501 VanDerWaalsContact O-N 3.15Å; S499-D502 PolarHBondContact O-N 2.86Å; S499-D502 VanDerWaalsContact O-N 3.13Å; S499-H503 PolarHBondContact O-CD2 3.25Å; S499-H503 PolarHBondContact O-N 3.06Å; S499-H503 PolarHBondContact O-ND1 2.97Å; S499-H503 PolarHBondContact OG-CE1 3.23Å
500	Y	89.7	Confident	88.8	Confident	48 Å²	48	52.3 Å²	52.3	19%	0.188	26%	0.257	C	S	.	.	H	α-helix	trans	-57.7	-26.2	173.5	78.6	-89.7	0	0	0	113.6	L468 P470 R498 G504	L468-Y500 WeakPolarHBondContact O-CE2 3.31Å; P470-Y500 HydrophobicContact CB-CD1 4.34Å; P470-Y500 HydrophobicContact CB-CG 4.41Å; P470-Y500 HydrophobicContact CG-CD1 4.07Å; P470-Y500 HydrophobicContact CG-CE1 3.8Å; P470-Y500 HydrophobicContact CG-CE2 4.35Å; P470-Y500 HydrophobicContact CG-CG 4.45Å; R498-Y500 PolarHBondContact O-N 3.36Å; R498-Y500 VanDerWaalsContact O-N 3.1Å; Y500-G504 PolarHBondContact O-N 3.12Å
501	Q	92.9	Very high	88.8	Confident	30 Å²	30	52.8 Å²	52.8	14%	0.14	26%	0.259	C	S	.	.	H	α-helix	trans	-70.2	-46.8	176.6	-59.3	-178.4	-53.9	0	0	110.3	Y465 R498 S499 G504 N505	Y465-Q501 HydrophobicContact CD1-CB 3.7Å; Y465-Q501 HydrophobicContact CD1-CG 4.42Å; Y465-Q501 HydrophobicContact CE1-CB 3.86Å; Y465-Q501 HydrophobicContact CG-CB 4.23Å; Y465-Q501 PolarHBondContact O-NE2 3.33Å; R498-Q501 WeakPolarHBondContact O-CB 3.5Å; R498-Q501 WeakPolarHBondContact O-CG 3.49Å; R498-Q501 PolarHBondContact O-N 2.91Å; S499-Q501 PolarHBondContact O-N 2.95Å; S499-Q501 VanDerWaalsContact O-N 3.15Å; Q501-G504 PolarHBondContact O-N 3.02Å; Q501-N505 WeakPolarHBondContact O-CB 3.49Å; Q501-N505 PolarHBondContact O-N 3.42Å
502	D	91.5	Very high	88.8	Confident	48 Å²	48	49.9 Å²	49.9	26%	0.257	25%	0.245	S	C	.	.	H	α-helix	trans	-69.6	-40.7	178.1	-54.8	-71.3	0	0	0	111.7	Y465 W494 S499 G504 N505 R506	Y465-D502 PolarHBondContact OH-OD1 3.5Å; W494-D502 HydrophobicContact CD2-CB 4.15Å; W494-D502 HydrophobicContact CE3-CB 3.32Å; W494-D502 HydrophobicContact CH2-CB 4.1Å; W494-D502 HydrophobicContact CZ3-CB 3.27Å; S499-D502 PolarHBondContact O-N 2.86Å; S499-D502 VanDerWaalsContact O-N 3.13Å; D502-G504 VanDerWaalsContact C-N 3.35Å; D502-G504 PolarHBondContact O-N 3.38Å; D502-N505 PolarHBondContact O-N 3.09Å; D502-R506 PolarHBondContact O-N 3.5Å
503	H	93.1	Very high	89	Confident	4 Å²	4	45.4 Å²	45.4	2%	0.019	23%	0.225	C	C	.	.	H	α-helix	trans	-59.5	-45.3	172.7	-59.6	160.5	0	0	0	111.4	W473 I490 W494 S499 R506 M507	W473-H503 HydrophobicContact CD2-CB 4Å; W473-H503 HydrophobicContact CE3-CB 4.26Å; W473-H503 HydrophobicContact CH2-CB 4.02Å; W473-H503 HydrophobicContact CZ2-CB 3.76Å; W473-H503 AromaticContact CZ2-ND1 3.86Å; W473-H503 HydrophobicContact CZ3-CB 4.27Å; I490-H503 HydrophobicContact CG2-CB 3.87Å; I490-H503 PolarHBondContact O-CD2 3.38Å; I490-H503 VanDerWaalsContact O-CD2 3.32Å; I490-H503 PolarHBondContact O-NE2 3.34Å; W494-H503 AromaticContact CE3-CD2 3.77Å; W494-H503 PolarHBondContact O-CE1 3.42Å; W494-H503 VanDerWaalsContact O-CE1 3.24Å; W494-H503 PolarHBondContact O-NE2 3.39Å; S499-H503 PolarHBondContact O-CD2 3.25Å; S499-H503 PolarHBondContact O-N 3.06Å; S499-H503 PolarHBondContact O-ND1 2.97Å; S499-H503 PolarHBondContact OG-CE1 3.23Å; H503-R506 PolarHBondContact O-N 3.31Å; H503-M507 VanDerWaalsContact O-CB 3.25Å; H503-M507 WeakPolarHBondContact O-CB 3.44Å; H503-M507 PolarHBondContact O-N 3.02Å
504	G	92.9	Very high	89.4	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.2	-43.6	177	0	0	0	0	0	112.5	Y500 Q501 D502 M507 L508	Y500-G504 PolarHBondContact O-N 3.12Å; Q501-G504 PolarHBondContact O-N 3.02Å; D502-G504 VanDerWaalsContact C-N 3.35Å; D502-G504 PolarHBondContact O-N 3.38Å; G504-M507 PolarHBondContact O-N 3.46Å; G504-L508 WeakPolarHBondContact O-CB 3.49Å; G504-L508 WeakPolarHBondContact O-CD1 3.4Å; G504-L508 WeakPolarHBondContact O-CG 3.32Å; G504-L508 PolarHBondContact O-N 3.5Å
505	N	93.9	Very high	89.6	Confident	25 Å²	25	41.8 Å²	41.8	13%	0.134	22%	0.218	C	C	.	.	H	α-helix	trans	-62.5	-47.3	177.2	-177.9	58.2	0	0	0	111.6	A464 Y465 Q501 D502 L508 L509	A464-N505 HydrophobicContact CB-CB 3.7Å; Y465-N505 HydrophobicContact CE2-CB 3.85Å; Q501-N505 WeakPolarHBondContact O-CB 3.49Å; Q501-N505 PolarHBondContact O-N 3.42Å; D502-N505 PolarHBondContact O-N 3.09Å; N505-L508 PolarHBondContact O-N 3.32Å; N505-L509 WeakPolarHBondContact O-CG 3.3Å; N505-L509 PolarHBondContact O-N 2.9Å
506	R	93.9	Very high	89.9	Confident	8 Å²	8	37.5 Å²	37.5	3%	0.03	19%	0.188	C	C	.	.	H	α-helix	trans	-60.4	-48.5	176.8	-76.3	176.1	62	-158.6	4.5	112.4	V411 D415 I490 Q493 W494 D502 H503 L508 L509 I510	V411-R506 VanDerWaalsContact CG1-CZ 3.45Å; V411-R506 PolarHBondContact O-NH2 2.9Å; D415-R506 IonicContact OD1-CZ 3.96Å; D415-R506 IonicContact OD1-NE 3.76Å; D415-R506 PolarHBondContact OD1-NE 3.36Å; D415-R506 IonicContact OD1-NH2 3.97Å; D415-R506 PolarHBondContact OD1-NH2 2.69Å; D415-R506 IonicContact OD2-NE 2.92Å; D415-R506 PolarHBondContact OD2-NE 3.05Å; I490-R506 PolarHBondContact O-NH1 3.38Å; I490-R506 VanDerWaalsContact O-NH1 3.11Å; Q493-R506 VanDerWaalsContact CG-NH1 3.31Å; W494-R506 VanDerWaalsContact CH2-CD 3.43Å; W494-R506 HydrophobicContact CH2-CG 4.26Å; W494-R506 HydrophobicContact CZ3-CG 4.05Å; D502-R506 PolarHBondContact O-N 3.5Å; H503-R506 PolarHBondContact O-N 3.31Å; R506-L508 VanDerWaalsContact C-N 3.29Å; R506-L508 PolarHBondContact O-N 3.27Å; R506-L509 PolarHBondContact O-N 2.96Å; R506-L509 VanDerWaalsContact O-N 3.11Å; R506-I510 WeakPolarHBondContact O-CG1 3.41Å; R506-I510 PolarHBondContact O-N 3.16Å
507	M	95.3	Very high	90	Very high	0 Å²	0	37 Å²	37	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-56	-45.1	177.3	-179.5	-77.6	-66.4	0	0	111.2	W473 L476 A477 W480 F482 I490 H503 G504 L509 I510 W511	W473-M507 HydrophobicContact CB-CE 4.13Å; W473-M507 HydrophobicContact CE3-CB 4.22Å; W473-M507 HydrophobicContact CE3-CG 4.31Å; W473-M507 WeakPolarHBondContact O-CE 3.31Å; L476-M507 HydrophobicContact CB-CE 3.72Å; L476-M507 HydrophobicContact CD1-CE 4.27Å; A477-M507 HydrophobicContact CB-CG 3.92Å; A477-M507 HydrophobicContact CB-SD 4.37Å; W480-M507 HydrophobicContact CE3-CE 4.47Å; W480-M507 HydrophobicContact CE3-SD 3.74Å; W480-M507 HydrophobicContact CZ3-CE 3.99Å; W480-M507 HydrophobicContact CZ3-SD 3.7Å; F482-M507 HydrophobicContact CD2-CG 4.33Å; F482-M507 HydrophobicContact CE1-CG 4.19Å; F482-M507 HydrophobicContact CE2-CG 3.63Å; F482-M507 HydrophobicContact CE2-SD 3.66Å; F482-M507 HydrophobicContact CZ-CB 4.44Å; F482-M507 HydrophobicContact CZ-CG 3.59Å; F482-M507 WeakPolarHBondContact CZ-O 3.02Å; F482-M507 HydrophobicContact CZ-SD 4.05Å; I490-M507 HydrophobicContact CD1-CB 4.34Å; H503-M507 VanDerWaalsContact O-CB 3.25Å; H503-M507 WeakPolarHBondContact O-CB 3.44Å; H503-M507 PolarHBondContact O-N 3.02Å; G504-M507 PolarHBondContact O-N 3.46Å; M507-L509 PolarHBondContact O-N 3.28Å; M507-I510 PolarHBondContact O-N 3.48Å; M507-W511 WeakPolarHBondContact O-CB 3.37Å; M507-W511 PolarHBondContact O-N 3.03Å
508	L	94.2	Very high	90.3	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-64.2	-38.9	176.6	-71.9	166.2	0	0	0	112.5	A460 L463 A464 W480 G504 N505 R506 W511 L512 L526	A460-L508 HydrophobicContact CB-CB 3.94Å; A460-L508 HydrophobicContact CB-CD1 4.27Å; A460-L508 WeakPolarHBondContact O-CD1 3.25Å; L463-L508 HydrophobicContact CB-CD1 4.27Å; L463-L508 HydrophobicContact CD2-CD1 3.94Å; L463-L508 HydrophobicContact CD2-CD2 4.13Å; L463-L508 HydrophobicContact CG-CD1 4.13Å; A464-L508 HydrophobicContact CB-CD1 4.16Å; W480-L508 HydrophobicContact CH2-CD2 3.78Å; W480-L508 HydrophobicContact CZ3-CD2 3.73Å; G504-L508 WeakPolarHBondContact O-CB 3.49Å; G504-L508 WeakPolarHBondContact O-CD1 3.4Å; G504-L508 WeakPolarHBondContact O-CG 3.32Å; G504-L508 PolarHBondContact O-N 3.5Å; N505-L508 PolarHBondContact O-N 3.32Å; R506-L508 VanDerWaalsContact C-N 3.29Å; R506-L508 PolarHBondContact O-N 3.27Å; L508-W511 HydrophobicContact CD2-CE3 4.47Å; L508-W511 PolarHBondContact O-N 3.37Å; L508-L512 VanDerWaalsContact O-CB 3.27Å; L508-L512 WeakPolarHBondContact O-CB 3.39Å; L508-L512 PolarHBondContact O-N 3.46Å; L508-L526 HydrophobicContact CD2-CD1 3.99Å
509	L	94	Very high	90.2	Very high	43 Å²	43	26.8 Å²	26.8	23%	0.225	14%	0.141	C	C	.	.	H	α-helix	trans	-68.8	-37.1	177	-68.2	175.2	0	0	0	112.6	R457 N505 R506 M507 H513	R457-L509 HydrophobicContact CB-CD2 4.31Å; R457-L509 HydrophobicContact CG-CD2 3.84Å; N505-L509 WeakPolarHBondContact O-CG 3.3Å; N505-L509 PolarHBondContact O-N 2.9Å; R506-L509 PolarHBondContact O-N 2.96Å; R506-L509 VanDerWaalsContact O-N 3.11Å; M507-L509 PolarHBondContact O-N 3.28Å; L509-H513 PolarHBondContact O-N 3.24Å
510	I	94.6	Very high	89.9	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-65	-46.2	173.2	-67.7	164.2	0	0	0	110.2	D415 I418 K419 F482 I490 R506 M507 H513 G514	D415-I510 HydrophobicContact CB-CD1 4.15Å; D415-I510 HydrophobicContact CB-CG1 4.09Å; I418-I510 HydrophobicContact CB-CD1 4.26Å; I418-I510 HydrophobicContact CB-CG2 4.28Å; I418-I510 HydrophobicContact CD1-CD1 4.09Å; I418-I510 HydrophobicContact CG2-CD1 4.29Å; I418-I510 HydrophobicContact CG2-CG2 3.66Å; K419-I510 HydrophobicContact CG-CB 4.34Å; K419-I510 HydrophobicContact CG-CG1 4.29Å; K419-I510 HydrophobicContact CG-CG2 3.99Å; F482-I510 HydrophobicContact CE1-CB 4.25Å; F482-I510 HydrophobicContact CE1-CG2 3.74Å; F482-I510 HydrophobicContact CZ-CB 4.17Å; F482-I510 HydrophobicContact CZ-CG2 3.89Å; I490-I510 HydrophobicContact CD1-CD1 3.93Å; I490-I510 HydrophobicContact CG1-CD1 4.41Å; R506-I510 WeakPolarHBondContact O-CG1 3.41Å; R506-I510 PolarHBondContact O-N 3.16Å; M507-I510 PolarHBondContact O-N 3.48Å; I510-H513 PolarHBondContact O-N 2.61Å; I510-G514 PolarHBondContact O-N 3.11Å
511	W	93.9	Very high	89.7	Confident	11 Å²	11	32.1 Å²	32.1	4%	0.042	17%	0.17	C	C	.	.	H	α-helix	trans	-61.2	-45	176.8	164	80.8	0	0	0	111.8	W480 F482 M507 L508 H513 G514 S515 P522 E525 L526	W480-W511 AromaticContact CD1-NE1 3.66Å; W480-W511 AromaticContact CD2-CD1 3.38Å; W480-W511 HydrophobicContact CD2-CD2 4.32Å; W480-W511 AromaticContact CD2-CG 3.92Å; W480-W511 HydrophobicContact CD2-CG 3.92Å; W480-W511 AromaticContact CD2-NE1 3.45Å; W480-W511 AromaticContact CE2-CD1 3.81Å; W480-W511 AromaticContact CE2-CE2 3.66Å; W480-W511 AromaticContact CE2-NE1 3.34Å; W480-W511 VanDerWaalsContact CE2-NE1 3.34Å; W480-W511 HydrophobicContact CE3-CB 4.17Å; W480-W511 AromaticContact CE3-CD1 3.66Å; W480-W511 HydrophobicContact CE3-CD2 4.21Å; W480-W511 AromaticContact CE3-CG 3.73Å; W480-W511 HydrophobicContact CE3-CG 3.73Å; W480-W511 AromaticContact CG-CD1 3.54Å; W480-W511 HydrophobicContact CG-CG 4.46Å; W480-W511 AromaticContact CG-NE1 3.65Å; W480-W511 HydrophobicContact CH2-CD2 4.02Å; W480-W511 HydrophobicContact CH2-CE3 4.32Å; W480-W511 HydrophobicContact CH2-CG 4.4Å; W480-W511 HydrophobicContact CH2-CZ2 4.32Å; W480-W511 HydrophobicContact CZ2-CD2 4.14Å; W480-W511 AromaticContact CZ2-CE2 3.66Å; W480-W511 HydrophobicContact CZ2-CH2 4.43Å; W480-W511 AromaticContact CZ2-CZ2 3.81Å; W480-W511 HydrophobicContact CZ2-CZ2 3.81Å; W480-W511 AromaticContact CZ2-NE1 3.85Å; W480-W511 HydrophobicContact CZ3-CB 4.42Å; W480-W511 HydrophobicContact CZ3-CD2 4.05Å; W480-W511 AromaticContact CZ3-CG 3.99Å; W480-W511 HydrophobicContact CZ3-CG 3.99Å; W480-W511 AromaticContact NE1-NE1 3.46Å; F482-W511 HydrophobicContact CE2-CB 4.31Å; F482-W511 HydrophobicContact CZ-CB 4.37Å; M507-W511 WeakPolarHBondContact O-CB 3.37Å; M507-W511 PolarHBondContact O-N 3.03Å; L508-W511 HydrophobicContact CD2-CE3 4.47Å; L508-W511 PolarHBondContact O-N 3.37Å; W511-H513 VanDerWaalsContact C-N 3.29Å; W511-H513 PolarHBondContact O-N 3.35Å; W511-G514 PolarHBondContact O-N 2.96Å; W511-G514 VanDerWaalsContact O-N 3.12Å; W511-S515 PolarHBondContact NE1-OG 2.9Å; W511-S515 PolarHBondContact O-N 3.22Å; W511-S515 PolarHBondContact O-OG 3.31Å; W511-P522 HydrophobicContact CH2-CB 4.35Å; W511-P522 WeakPolarHBondContact CH2-O 3.44Å; W511-E525 HydrophobicContact CH2-CB 4.28Å; W511-E525 HydrophobicContact CZ2-CB 3.59Å; W511-L526 HydrophobicContact CH2-CB 3.92Å; W511-L526 HydrophobicContact CH2-CD1 4.17Å; W511-L526 HydrophobicContact CZ3-CD1 4.16Å
512	L	91.6	Very high	89.4	Confident	5 Å²	5	31.8 Å²	31.8	3%	0.026	17%	0.171	C	C	.	.	H	α-helix	trans	-57.3	-43.4	179.7	177.9	60.8	0	0	0	111.6	V456 R457 L508 G514 S515 E516 P522	V456-L512 HydrophobicContact CB-CD1 4.4Å; V456-L512 HydrophobicContact CB-CD2 4.29Å; V456-L512 HydrophobicContact CG1-CD1 3.54Å; V456-L512 HydrophobicContact CG1-CD2 3.94Å; V456-L512 HydrophobicContact CG1-CG 4.4Å; R457-L512 HydrophobicContact CG-CD2 3.84Å; L508-L512 VanDerWaalsContact O-CB 3.27Å; L508-L512 WeakPolarHBondContact O-CB 3.39Å; L508-L512 PolarHBondContact O-N 3.46Å; L512-G514 VanDerWaalsContact C-N 3.34Å; L512-G514 PolarHBondContact O-N 3.44Å; L512-S515 PolarHBondContact O-N 3.47Å; L512-E516 HydrophobicContact CD1-CG 4.08Å; L512-E516 HydrophobicContact CG-CG 4.38Å; L512-E516 WeakPolarHBondContact O-CB 3.37Å; L512-E516 WeakPolarHBondContact O-CG 3.5Å; L512-E516 PolarHBondContact O-N 3.24Å; L512-P522 HydrophobicContact CD1-CB 3.74Å; L512-P522 HydrophobicContact CD1-CG 3.85Å
513	H	90.9	Very high	89	Confident	19 Å²	19	31.7 Å²	31.7	9%	0.088	18%	0.176	C	C	.	.	H	α-helix	trans	-56.9	-45.7	176.3	174.5	-92.8	0	0	0	112.4	K419 T444 F445 L509 I510 W511 E516 L517	K419-H513 HydrophobicContact CD-CB 4.1Å; K419-H513 HydrophobicContact CG-CB 4.13Å; T444-H513 PolarHBondContact O-NE2 2.99Å; F445-H513 AromaticContact CD1-CE1 3.68Å; F445-H513 AromaticContact CE1-CE1 3.99Å; L509-H513 PolarHBondContact O-N 3.24Å; I510-H513 PolarHBondContact O-N 2.61Å; W511-H513 VanDerWaalsContact C-N 3.29Å; W511-H513 PolarHBondContact O-N 3.35Å; H513-E516 PolarHBondContact O-N 2.98Å; H513-L517 WeakPolarHBondContact CE1-CD1 3.32Å; H513-L517 WeakPolarHBondContact O-CG 3.15Å; H513-L517 PolarHBondContact O-N 3.07Å; H513-L517 VanDerWaalsContact O-N 3.09Å
514	G	86.6	Confident	88.6	Confident	23 Å²	23	37.4 Å²	37.4	24%	0.237	20%	0.201	C	C	.	.	H	α-helix	trans	-64.5	-43	175.9	0	0	0	0	0	113	I510 W511 L512 E516 L517 A518	I510-G514 PolarHBondContact O-N 3.11Å; W511-G514 PolarHBondContact O-N 2.96Å; W511-G514 VanDerWaalsContact O-N 3.12Å; L512-G514 VanDerWaalsContact C-N 3.34Å; L512-G514 PolarHBondContact O-N 3.44Å; G514-E516 PolarHBondContact O-N 2.91Å; G514-L517 PolarHBondContact O-N 3.21Å; G514-A518 WeakPolarHBondContact O-CB 3.36Å; G514-A518 PolarHBondContact O-N 3.24Å
515	S	86.6	Confident	88.3	Confident	7 Å²	7	39.6 Å²	39.6	5%	0.049	21%	0.211	C	C	.	.	H	α-helix	trans	-62.3	-41.5	177.7	-63.9	0	0	0	0	112.4	W511 L512 A518 Q519 L520	W511-S515 PolarHBondContact NE1-OG 2.9Å; W511-S515 PolarHBondContact O-N 3.22Å; W511-S515 PolarHBondContact O-OG 3.31Å; L512-S515 PolarHBondContact O-N 3.47Å; S515-A518 CarbonylContact O-C 3.58Å; S515-A518 PolarHBondContact O-N 3.24Å; S515-Q519 PolarHBondContact O-N 3.27Å; S515-L520 PolarHBondContact O-N 3.49Å
516	E	84.9	Confident	88	Confident	51 Å²	51	38.8 Å²	38.8	24%	0.238	21%	0.207	C	C	.	.	H	α-helix	trans	-66.6	-42.3	176.7	-74	-179.6	163.9	0	0	112.3	R450 S453 L512 H513 G514 A518 Q519	R450-E516 IonicContact CZ-OE2 2.96Å; R450-E516 IonicContact NH2-OE2 3.56Å; R450-E516 PolarHBondContact NH2-OE2 3.45Å; S453-E516 WeakPolarHBondContact CB-OE1 3.2Å; L512-E516 HydrophobicContact CD1-CG 4.08Å; L512-E516 HydrophobicContact CG-CG 4.38Å; L512-E516 WeakPolarHBondContact O-CB 3.37Å; L512-E516 WeakPolarHBondContact O-CG 3.5Å; L512-E516 PolarHBondContact O-N 3.24Å; H513-E516 PolarHBondContact O-N 2.98Å; G514-E516 PolarHBondContact O-N 2.91Å; E516-A518 VanDerWaalsContact C-N 3.28Å; E516-A518 PolarHBondContact O-N 3.42Å; E516-Q519 PolarHBondContact O-N 3.48Å
517	L	81.9	Confident	87.6	Confident	42 Å²	42	41.5 Å²	41.5	22%	0.22	22%	0.218	C	C	.	.	H	α-helix	trans	-64.8	-33.2	176.2	-72.8	178.1	0	0	0	112.4	Y423 L443 H513 G514 Q519	Y423-L517 HydrophobicContact CD2-CD1 3.54Å; Y423-L517 HydrophobicContact CE2-CD1 4.06Å; Y423-L517 HydrophobicContact CG-CD1 4.25Å; L443-L517 HydrophobicContact CD1-CD1 4.08Å; L443-L517 HydrophobicContact CD1-CD2 4.34Å; H513-L517 WeakPolarHBondContact CE1-CD1 3.32Å; H513-L517 WeakPolarHBondContact O-CG 3.15Å; H513-L517 PolarHBondContact O-N 3.07Å; H513-L517 VanDerWaalsContact O-N 3.09Å; G514-L517 PolarHBondContact O-N 3.21Å; L517-Q519 PolarHBondContact O-N 3.44Å
518	A	81.6	Confident	87.2	Confident	23 Å²	23	45.6 Å²	45.6	19%	0.19	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	2.1	172.7	0	0	0	0	0	113.6	W426 G514 S515 E516 L520	W426-A518 HydrophobicContact CZ2-CB 3.93Å; G514-A518 WeakPolarHBondContact O-CB 3.36Å; G514-A518 PolarHBondContact O-N 3.24Å; S515-A518 CarbonylContact O-C 3.58Å; S515-A518 PolarHBondContact O-N 3.24Å; E516-A518 VanDerWaalsContact C-N 3.28Å; E516-A518 PolarHBondContact O-N 3.42Å; A518-L520 HydrophobicContact CB-CD1 4.03Å; A518-L520 HydrophobicContact CB-CG 3.87Å; A518-L520 PolarHBondContact O-N 3.33Å
519	Q	81.3	Confident	86.9	Confident	154 Å²	154	45.6 Å²	45.6	72%	0.72	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	54	29.5	-176.5	-56.5	-177.7	6.7	0	0	113.9	S515 E516 L517	S515-Q519 PolarHBondContact O-N 3.27Å; E516-Q519 PolarHBondContact O-N 3.48Å; L517-Q519 PolarHBondContact O-N 3.44Å
520	L	82.9	Confident	86.6	Confident	80 Å²	80	43.5 Å²	43.5	42%	0.419	23%	0.226	S	C	.	.			trans	-80.1	153.4	176.4	-61	176.2	0	0	0	110.3	S515 A518 P522 E525	S515-L520 PolarHBondContact O-N 3.49Å; A518-L520 HydrophobicContact CB-CD1 4.03Å; A518-L520 HydrophobicContact CB-CG 3.87Å; A518-L520 PolarHBondContact O-N 3.33Å; L520-P522 WeakPolarHBondContact O-CD 3.22Å; L520-E525 HydrophobicContact CB-CG 4.14Å; L520-E525 HydrophobicContact CD1-CG 4.43Å
521	N	85.3	Confident	86.4	Confident	100 Å²	100	46.3 Å²	46.3	54%	0.535	24%	0.241	S	C	.	.			trans	-78.1	109.2	174.1	-177.8	-30.6	0	0	0	109.8	A523 K524 E525	N521-A523 VanDerWaalsContact C-N 3.3Å; N521-A523 PolarHBondContact O-N 3.17Å; N521-A523 PolarHBondContact OD1-N 2.99Å; N521-A523 VanDerWaalsContact OD1-N 3.08Å; N521-K524 HydrophobicContact CB-CB 4.16Å; N521-K524 PolarHBondContact O-N 3.26Å; N521-K524 PolarHBondContact OD1-N 3.08Å; N521-E525 WeakPolarHBondContact O-CG 3.15Å; N521-E525 PolarHBondContact O-N 3.3Å; N521-E525 VanDerWaalsContact O-N 3.16Å
522	P	86.1	Confident	86.1	Confident	23 Å²	23	48.3 Å²	48.3	15%	0.149	26%	0.26	C	S	.	.	H	α-helix	trans	-64.4	-32.8	-172.8	-22.2	35.5	0	0	0	113.2	V456 W511 L512 L520 L526	V456-P522 HydrophobicContact CG1-CB 3.89Å; W511-P522 HydrophobicContact CH2-CB 4.35Å; W511-P522 WeakPolarHBondContact CH2-O 3.44Å; L512-P522 HydrophobicContact CD1-CB 3.74Å; L512-P522 HydrophobicContact CD1-CG 3.85Å; L520-P522 WeakPolarHBondContact O-CD 3.22Å; P522-L526 WeakPolarHBondContact O-CB 3.35Å; P522-L526 PolarHBondContact O-N 3.43Å
523	A	83.3	Confident	86	Confident	46 Å²	46	48.7 Å²	48.7	38%	0.38	26%	0.262	S	S	.	.	H	α-helix	trans	-66.4	-40.5	179.7	0	0	0	0	0	111.7	N521 Y527	N521-A523 VanDerWaalsContact C-N 3.3Å; N521-A523 PolarHBondContact O-N 3.17Å; N521-A523 PolarHBondContact OD1-N 2.99Å; N521-A523 VanDerWaalsContact OD1-N 3.08Å; A523-Y527 PolarHBondContact O-N 3Å; A523-Y527 VanDerWaalsContact O-N 3.14Å
524	K	84.6	Confident	85.7	Confident	124 Å²	124	54.3 Å²	54.3	54%	0.539	29%	0.292	S	S	.	.	H	α-helix	trans	-66	-47.8	177.2	-175.9	-175.6	174.8	-170.3	0	111.5	N521 L526 Y527 Q528	N521-K524 HydrophobicContact CB-CB 4.16Å; N521-K524 PolarHBondContact O-N 3.26Å; N521-K524 PolarHBondContact OD1-N 3.08Å; K524-L526 VanDerWaalsContact C-N 3.32Å; K524-L526 PolarHBondContact O-N 3.42Å; K524-Y527 PolarHBondContact O-N 3.21Å; K524-Q528 WeakPolarHBondContact O-CG 3.44Å; K524-Q528 PolarHBondContact O-N 3.42Å; K524-Q528 VanDerWaalsContact O-N 3.08Å
525	E	87.3	Confident	85.6	Confident	46 Å²	46	54.2 Å²	54.2	22%	0.215	29%	0.286	C	S	.	.	H	α-helix	trans	-65.4	-37	-179.5	-66.2	-64.4	135.5	0	0	111.7	W511 L520 N521 Q528 G529	W511-E525 HydrophobicContact CH2-CB 4.28Å; W511-E525 HydrophobicContact CZ2-CB 3.59Å; L520-E525 HydrophobicContact CB-CG 4.14Å; L520-E525 HydrophobicContact CD1-CG 4.43Å; N521-E525 WeakPolarHBondContact O-CG 3.15Å; N521-E525 PolarHBondContact O-N 3.3Å; N521-E525 VanDerWaalsContact O-N 3.16Å; E525-Q528 PolarHBondContact O-N 3.4Å; E525-G529 PolarHBondContact O-N 2.95Å
526	L	86.9	Confident	85.4	Confident	9 Å²	9	59.9 Å²	59.9	5%	0.047	31%	0.31	C	S	.	.	H	α-helix	trans	-63.3	-43.5	175.2	-169.2	63.3	0	0	0	111.8	T459 L463 W480 L508 W511 P522 K524 G529 L530 I542	T459-L526 HydrophobicContact CG2-CD2 4.18Å; L463-L526 HydrophobicContact CD2-CD1 3.68Å; L463-L526 HydrophobicContact CD2-CD2 4.22Å; L463-L526 HydrophobicContact CD2-CG 4.25Å; W480-L526 HydrophobicContact CH2-CD1 3.85Å; W480-L526 HydrophobicContact CZ2-CD1 4.27Å; L508-L526 HydrophobicContact CD2-CD1 3.99Å; W511-L526 HydrophobicContact CH2-CB 3.92Å; W511-L526 HydrophobicContact CH2-CD1 4.17Å; W511-L526 HydrophobicContact CZ3-CD1 4.16Å; P522-L526 WeakPolarHBondContact O-CB 3.35Å; P522-L526 PolarHBondContact O-N 3.43Å; K524-L526 VanDerWaalsContact C-N 3.32Å; K524-L526 PolarHBondContact O-N 3.42Å; L526-G529 PolarHBondContact O-N 3.08Å; L526-L530 HydrophobicContact CG-CD1 4.32Å; L526-L530 WeakPolarHBondContact O-CG 3.47Å; L526-L530 PolarHBondContact O-N 3.39Å; L526-I542 HydrophobicContact CD2-CD1 4.22Å; L526-I542 HydrophobicContact CD2-CG2 4.1Å
527	Y	85.3	Confident	85.3	Confident	65 Å²	65	62.1 Å²	62.1	26%	0.255	33%	0.327	S	S	.	.	H	α-helix	trans	-61.1	-45.1	176.2	-177.2	-101.8	0	0	0	111.6	A523 K524 L530 L531 A539 D540 R543	A523-Y527 PolarHBondContact O-N 3Å; A523-Y527 VanDerWaalsContact O-N 3.14Å; K524-Y527 PolarHBondContact O-N 3.21Å; Y527-L530 PolarHBondContact O-N 2.93Å; Y527-L531 HydrophobicContact CD1-CD1 3.9Å; Y527-L531 HydrophobicContact CD1-CG 4.43Å; Y527-L531 HydrophobicContact CE1-CD1 3.38Å; Y527-L531 HydrophobicContact CE1-CG 4.11Å; Y527-L531 WeakPolarHBondContact O-CG 3.41Å; Y527-L531 PolarHBondContact O-N 3.37Å; Y527-L531 VanDerWaalsContact O-N 3.08Å; Y527-A539 HydrophobicContact CD2-CB 3.79Å; Y527-A539 WeakPolarHBondContact CD2-O 3.32Å; Y527-A539 HydrophobicContact CE2-CB 3.71Å; Y527-D540 PolarHBondContact OH-OD1 3.02Å; Y527-R543 HydrophobicContact CD2-CB 4.29Å; Y527-R543 HydrophobicContact CE2-CB 4.38Å; Y527-R543 PolarHBondContact OH-NH1 3.21Å
528	Q	87.2	Confident	85.3	Confident	86 Å²	86	60.5 Å²	60.5	40%	0.402	32%	0.319	S	S	.	.	H	α-helix	trans	-63.1	-43.1	177.4	-71	-178.9	-10.6	0	0	112.2	K524 E525 L530 L531 A532	K524-Q528 WeakPolarHBondContact O-CG 3.44Å; K524-Q528 PolarHBondContact O-N 3.42Å; K524-Q528 VanDerWaalsContact O-N 3.08Å; E525-Q528 PolarHBondContact O-N 3.4Å; Q528-L530 VanDerWaalsContact C-N 3.34Å; Q528-L530 PolarHBondContact O-N 2.95Å; Q528-L531 PolarHBondContact O-N 2.78Å; Q528-A532 WeakPolarHBondContact O-CB 3.44Å; Q528-A532 PolarHBondContact O-N 3.31Å
529	G	87.8	Confident	85.3	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-61.1	-40.6	176.6	0	0	0	0	0	113	L476 E525 L526 A532 I533	L476-G529 WeakPolarHBondContact CD2-O 3.17Å; E525-G529 PolarHBondContact O-N 2.95Å; L526-G529 PolarHBondContact O-N 3.08Å; G529-A532 PolarHBondContact O-N 3.14Å; G529-I533 PolarHBondContact O-N 2.93Å
530	L	88.6	Confident	85.3	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-69.1	-35.5	177.9	-70.8	167.7	0	0	0	113.2	L463 L468 L476 L526 Y527 Q528 A532 I533 N535 V538 A539 I542	L463-L530 HydrophobicContact CD1-CD1 4.47Å; L463-L530 HydrophobicContact CD1-CD2 4.17Å; L463-L530 HydrophobicContact CD2-CD1 4.39Å; L463-L530 HydrophobicContact CD2-CD2 4.39Å; L468-L530 HydrophobicContact CD2-CD2 4.32Å; L476-L530 HydrophobicContact CD1-CD2 4.34Å; L476-L530 HydrophobicContact CD2-CD2 4.45Å; L526-L530 HydrophobicContact CG-CD1 4.32Å; L526-L530 WeakPolarHBondContact O-CG 3.47Å; L526-L530 PolarHBondContact O-N 3.39Å; Y527-L530 PolarHBondContact O-N 2.93Å; Q528-L530 VanDerWaalsContact C-N 3.34Å; Q528-L530 PolarHBondContact O-N 2.95Å; L530-A532 VanDerWaalsContact C-N 3.33Å; L530-I533 HydrophobicContact CD2-CD1 4.1Å; L530-I533 VanDerWaalsContact O-CG1 3.25Å; L530-I533 WeakPolarHBondContact O-CG1 3.21Å; L530-I533 PolarHBondContact O-N 3.48Å; L530-N535 PolarHBondContact O-N 3.33Å; L530-V538 HydrophobicContact CD1-CG1 4.12Å; L530-V538 HydrophobicContact CD2-CG1 4.15Å; L530-A539 HydrophobicContact CB-CB 3.74Å; L530-A539 HydrophobicContact CD1-CB 4.43Å; L530-I542 HydrophobicContact CD1-CD1 3.43Å; L530-I542 VanDerWaalsContact CD1-CD1 3.43Å
531	L	89	Confident	85.1	Confident	58 Å²	58	56.6 Å²	56.6	30%	0.304	30%	0.295	S	S	.	.	H	α-helix	trans	-65.5	-38	171.4	-71.1	-178.6	0	0	0	111.9	Y527 Q528 I533 D534 K536 A539	Y527-L531 HydrophobicContact CD1-CD1 3.9Å; Y527-L531 HydrophobicContact CD1-CG 4.43Å; Y527-L531 HydrophobicContact CE1-CD1 3.38Å; Y527-L531 HydrophobicContact CE1-CG 4.11Å; Y527-L531 WeakPolarHBondContact O-CG 3.41Å; Y527-L531 PolarHBondContact O-N 3.37Å; Y527-L531 VanDerWaalsContact O-N 3.08Å; Q528-L531 PolarHBondContact O-N 2.78Å; L531-I533 PolarHBondContact O-N 3.16Å; L531-D534 PolarHBondContact O-N 3.08Å; L531-D534 VanDerWaalsContact O-N 3.08Å; L531-K536 HydrophobicContact CD2-CB 4.41Å; L531-K536 HydrophobicContact CD2-CG 3.81Å; L531-A539 HydrophobicContact CD2-CB 4.17Å; L531-A539 HydrophobicContact CG-CB 4.41Å
532	A	88.1	Confident	84.8	Confident	53 Å²	53	52.4 Å²	52.4	44%	0.438	27%	0.272	S	S	.	.	H	α-helix	trans	-67.7	-21.9	-179	0	0	0	0	0	113.8	H479 Q528 G529 L530	H479-A532 WeakPolarHBondContact CE1-CB 3.48Å; H479-A532 WeakPolarHBondContact ND1-CB 3.25Å; Q528-A532 WeakPolarHBondContact O-CB 3.44Å; Q528-A532 PolarHBondContact O-N 3.31Å; G529-A532 PolarHBondContact O-N 3.14Å; L530-A532 VanDerWaalsContact C-N 3.33Å
533	I	89.7	Confident	84.3	Confident	14 Å²	14	56.1 Å²	56.1	7%	0.072	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	13.9	173.3	68.3	165	0	0	0	113.1	D472 R475 L476 G529 L530 L531 N535	D472-I533 HydrophobicContact CB-CD1 4.23Å; R475-I533 HydrophobicContact CB-CB 4.2Å; R475-I533 HydrophobicContact CB-CG2 3.62Å; L476-I533 HydrophobicContact CD1-CD1 4.15Å; L476-I533 HydrophobicContact CD2-CD1 3.88Å; L476-I533 HydrophobicContact CD2-CG1 4.24Å; L476-I533 HydrophobicContact CD2-CG2 3.89Å; L476-I533 HydrophobicContact CG-CD1 3.76Å; L476-I533 HydrophobicContact CG-CG2 4.1Å; G529-I533 PolarHBondContact O-N 2.93Å; L530-I533 HydrophobicContact CD2-CD1 4.1Å; L530-I533 VanDerWaalsContact O-CG1 3.25Å; L530-I533 WeakPolarHBondContact O-CG1 3.21Å; L530-I533 PolarHBondContact O-N 3.48Å; L531-I533 PolarHBondContact O-N 3.16Å; I533-N535 HydrophobicContact CD1-CB 3.92Å; I533-N535 HydrophobicContact CG1-CB 3.86Å; I533-N535 PolarHBondContact O-N 3.45Å
534	D	84.6	Confident	83.6	Confident	136 Å²	136	59.8 Å²	59.8	73%	0.727	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	18.6	-176.6	-68.3	-50.8	0	0	0	115.6	L531 K536	L531-D534 PolarHBondContact O-N 3.08Å; L531-D534 VanDerWaalsContact O-N 3.08Å; D534-K536 VanDerWaalsContact C-N 3.34Å; D534-K536 PolarHBondContact O-N 2.99Å; D534-K536 VanDerWaalsContact O-N 3.16Å
535	N	85.2	Confident	82.8	Confident	21 Å²	21	58.3 Å²	58.3	11%	0.112	29%	0.292	C	S	.	.			trans	-93.6	58.4	-178.9	-157.2	-15.8	0	0	0	112.5	D472 L530 I533 T537 V538 A539	D472-N535 PolarHBondContact OD2-ND2 3.17Å; L530-N535 PolarHBondContact O-N 3.33Å; I533-N535 HydrophobicContact CD1-CB 3.92Å; I533-N535 HydrophobicContact CG1-CB 3.86Å; I533-N535 PolarHBondContact O-N 3.45Å; N535-T537 VanDerWaalsContact C-N 3.3Å; N535-T537 PolarHBondContact O-N 3.15Å; N535-T537 PolarHBondContact OD1-OG1 3.08Å; N535-V538 PolarHBondContact O-N 3.37Å; N535-V538 VanDerWaalsContact OD1-CB 3.32Å; N535-V538 WeakPolarHBondContact OD1-CB 3.14Å; N535-V538 WeakPolarHBondContact OD1-CG2 3.42Å; N535-A539 PolarHBondContact O-N 3.48Å
536	K	81.5	Confident	81.5	Confident	126 Å²	126	57.8 Å²	57.8	55%	0.548	29%	0.292	S	S	.	.	H	α-helix	trans	-60	-36.9	-174.8	-63.1	-176.5	179.5	174.5	0	113.4	L531 D534 V538 A539 D540	L531-K536 HydrophobicContact CD2-CB 4.41Å; L531-K536 HydrophobicContact CD2-CG 3.81Å; D534-K536 VanDerWaalsContact C-N 3.34Å; D534-K536 PolarHBondContact O-N 2.99Å; D534-K536 VanDerWaalsContact O-N 3.16Å; K536-V538 VanDerWaalsContact C-N 3.35Å; K536-V538 PolarHBondContact O-N 3.12Å; K536-A539 PolarHBondContact O-N 3.27Å; K536-D540 PolarHBondContact O-N 3.06Å
537	T	82.3	Confident	80.1	Confident	98 Å²	98	62.3 Å²	62.3	60%	0.601	31%	0.313	S	S	*	.	H	α-helix	trans	-67.1	-36	-178.5	56.2	0	0	0	0	112.2	N535 K541	N535-T537 VanDerWaalsContact C-N 3.3Å; N535-T537 PolarHBondContact O-N 3.15Å; N535-T537 PolarHBondContact OD1-OG1 3.08Å; T537-K541 WeakPolarHBondContact O-CG 3.45Å; T537-K541 PolarHBondContact O-N 3.33Å
538	V	82.8	Confident	78.5	Confident	9 Å²	9	63 Å²	63	6%	0.055	32%	0.321	C	S	.	.	H	α-helix	trans	-76.7	-38.6	174.4	172	0	0	0	0	110.9	L463 L467 L530 N535 K536 D540 K541 I542	L463-V538 HydrophobicContact CD1-CG1 3.57Å; L467-V538 HydrophobicContact CB-CG1 3.75Å; L467-V538 HydrophobicContact CB-CG2 4.1Å; L467-V538 HydrophobicContact CD1-CG1 4.02Å; L467-V538 HydrophobicContact CG-CG1 4.43Å; L530-V538 HydrophobicContact CD1-CG1 4.12Å; L530-V538 HydrophobicContact CD2-CG1 4.15Å; N535-V538 PolarHBondContact O-N 3.37Å; N535-V538 VanDerWaalsContact OD1-CB 3.32Å; N535-V538 WeakPolarHBondContact OD1-CB 3.14Å; N535-V538 WeakPolarHBondContact OD1-CG2 3.42Å; K536-V538 VanDerWaalsContact C-N 3.35Å; K536-V538 PolarHBondContact O-N 3.12Å; V538-D540 PolarHBondContact O-N 3.1Å; V538-K541 PolarHBondContact O-N 3.46Å; V538-I542 HydrophobicContact CG1-CD1 4.11Å; V538-I542 WeakPolarHBondContact O-CG1 3.49Å; V538-I542 PolarHBondContact O-N 3.47Å
539	A	81.1	Confident	76.8	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-57.5	-46.9	175.7	0	0	0	0	0	112.2	Y527 L530 L531 N535 K536 I542 R543	Y527-A539 HydrophobicContact CD2-CB 3.79Å; Y527-A539 WeakPolarHBondContact CD2-O 3.32Å; Y527-A539 HydrophobicContact CE2-CB 3.71Å; L530-A539 HydrophobicContact CB-CB 3.74Å; L530-A539 HydrophobicContact CD1-CB 4.43Å; L531-A539 HydrophobicContact CD2-CB 4.17Å; L531-A539 HydrophobicContact CG-CB 4.41Å; N535-A539 PolarHBondContact O-N 3.48Å; K536-A539 PolarHBondContact O-N 3.27Å; A539-I542 PolarHBondContact O-N 3.48Å; A539-R543 PolarHBondContact O-N 3.31Å; A539-R543 VanDerWaalsContact O-N 3.15Å
540	D	80.6	Confident	74.8	Confident	59 Å²	59	65.3 Å²	65.3	32%	0.316	34%	0.343	S	S	.	.	H	α-helix	trans	-68.1	-35.7	178.8	-72.7	-34.8	0	0	0	112.4	Y527 K536 V538 R543 M544	Y527-D540 PolarHBondContact OH-OD1 3.02Å; K536-D540 PolarHBondContact O-N 3.06Å; V538-D540 PolarHBondContact O-N 3.1Å; D540-R543 PolarHBondContact O-N 3.02Å; D540-R543 IonicContact OD1-CZ 3.18Å; D540-R543 IonicContact OD1-NH1 2.7Å; D540-R543 IonicContact OD1-NH2 2.66Å; D540-R543 PolarHBondContact OD1-NH2 3.41Å; D540-M544 WeakPolarHBondContact O-CG 3.33Å; D540-M544 PolarHBondContact O-N 3.33Å; D540-M544 VanDerWaalsContact O-N 3.12Å
541	K	80.4	Confident	72.2	Confident	116 Å²	116	70.4 Å²	70.4	50%	0.504	37%	0.368	S	S	.	.	H	α-helix	trans	-61.9	-47	174.6	-78.3	174.9	-178.4	177.9	0	112.3	L467 T537 V538 R543 M544 D545	L467-K541 HydrophobicContact CD2-CD 4.46Å; T537-K541 WeakPolarHBondContact O-CG 3.45Å; T537-K541 PolarHBondContact O-N 3.33Å; V538-K541 PolarHBondContact O-N 3.46Å; K541-R543 VanDerWaalsContact C-N 3.35Å; K541-R543 PolarHBondContact O-N 3.22Å; K541-M544 PolarHBondContact O-N 3.44Å; K541-D545 PolarHBondContact O-N 3.4Å
542	I	77.7	Confident	69.7	Low	11 Å²	11	74 Å²	74	6%	0.056	38%	0.381	C	S	.	.	H	α-helix	trans	-65.5	-39.5	-179.9	-65.7	175.7	0	0	0	111.2	T459 L463 L467 L526 L530 V538 A539 M544 D545 T546	T459-I542 HydrophobicContact CG2-CG2 3.79Å; L463-I542 HydrophobicContact CB-CD1 4.24Å; L463-I542 HydrophobicContact CD1-CD1 3.66Å; L463-I542 HydrophobicContact CD2-CD1 3.97Å; L463-I542 HydrophobicContact CG-CD1 4.16Å; L467-I542 HydrophobicContact CD1-CD1 4.38Å; L467-I542 HydrophobicContact CD1-CG1 4.06Å; L526-I542 HydrophobicContact CD2-CD1 4.22Å; L526-I542 HydrophobicContact CD2-CG2 4.1Å; L530-I542 HydrophobicContact CD1-CD1 3.43Å; L530-I542 VanDerWaalsContact CD1-CD1 3.43Å; V538-I542 HydrophobicContact CG1-CD1 4.11Å; V538-I542 WeakPolarHBondContact O-CG1 3.49Å; V538-I542 PolarHBondContact O-N 3.47Å; A539-I542 PolarHBondContact O-N 3.48Å; I542-M544 VanDerWaalsContact C-N 3.35Å; I542-M544 PolarHBondContact O-N 3.31Å; I542-D545 PolarHBondContact O-N 3.44Å; I542-T546 PolarHBondContact O-N 2.92Å; I542-T546 PolarHBondContact O-OG1 3.17Å; I542-T546 VanDerWaalsContact O-OG1 3.1Å
543	R	76.5	Confident	67.3	Low	101 Å²	101	78.8 Å²	78.8	38%	0.381	39%	0.392	S	S	.	.	H	α-helix	trans	-59.1	-46.9	176.3	-173.7	-178.8	68.9	-150.7	-11	111.2	Y527 A539 D540 K541 D545 T546 E547	Y527-R543 HydrophobicContact CD2-CB 4.29Å; Y527-R543 HydrophobicContact CE2-CB 4.38Å; Y527-R543 PolarHBondContact OH-NH1 3.21Å; A539-R543 PolarHBondContact O-N 3.31Å; A539-R543 VanDerWaalsContact O-N 3.15Å; D540-R543 PolarHBondContact O-N 3.02Å; D540-R543 IonicContact OD1-CZ 3.18Å; D540-R543 IonicContact OD1-NH1 2.7Å; D540-R543 IonicContact OD1-NH2 2.66Å; D540-R543 PolarHBondContact OD1-NH2 3.41Å; K541-R543 VanDerWaalsContact C-N 3.35Å; K541-R543 PolarHBondContact O-N 3.22Å; R543-D545 PolarHBondContact O-N 3.44Å; R543-T546 WeakPolarHBondContact CA-OG1 3.41Å; R543-T546 PolarHBondContact O-N 2.77Å; R543-T546 PolarHBondContact O-OG1 3.27Å; R543-E547 WeakPolarHBondContact O-CG 3.48Å; R543-E547 PolarHBondContact O-N 3.19Å; R543-E547 VanDerWaalsContact O-N 3.1Å
544	M	67.8	Low	64.7	Low	124 Å²	124	83.1 Å²	83.1	61%	0.611	42%	0.423	S	S	*	.	H	α-helix	trans	-63.4	-40.8	178.4	-68.1	-172.4	79.6	0	0	112	D540 K541 I542 T546 E547 D548	D540-M544 WeakPolarHBondContact O-CG 3.33Å; D540-M544 PolarHBondContact O-N 3.33Å; D540-M544 VanDerWaalsContact O-N 3.12Å; K541-M544 PolarHBondContact O-N 3.44Å; I542-M544 VanDerWaalsContact C-N 3.35Å; I542-M544 PolarHBondContact O-N 3.31Å; M544-T546 VanDerWaalsContact C-N 3.33Å; M544-T546 PolarHBondContact O-N 3.34Å; M544-E547 PolarHBondContact O-N 3.08Å; M544-D548 WeakPolarHBondContact O-CB 3.47Å; M544-D548 PolarHBondContact O-N 3.49Å; M544-D548 VanDerWaalsContact O-N 3.08Å
545	D	67.5	Low	62.5	Low	93 Å²	93	83.1 Å²	83.1	50%	0.497	42%	0.421	S	S	.	.	H	α-helix	trans	-66.8	-32.1	178.4	-71.2	-20.4	0	0	0	112.9	K541 I542 R543 G549	K541-D545 PolarHBondContact O-N 3.4Å; I542-D545 PolarHBondContact O-N 3.44Å; R543-D545 PolarHBondContact O-N 3.44Å; D545-G549 PolarHBondContact O-N 3.1Å
546	T	61.6	Low	60.3	Low	34 Å²	34	89.8 Å²	89.8	21%	0.209	46%	0.456	C	S	.	.	H	α-helix	trans	-73.6	-36.8	174.6	48.3	0	0	0	0	113	I542 R543 M544 G549 D550	I542-T546 PolarHBondContact O-N 2.92Å; I542-T546 PolarHBondContact O-OG1 3.17Å; I542-T546 VanDerWaalsContact O-OG1 3.1Å; R543-T546 WeakPolarHBondContact CA-OG1 3.41Å; R543-T546 PolarHBondContact O-N 2.77Å; R543-T546 PolarHBondContact O-OG1 3.27Å; M544-T546 VanDerWaalsContact C-N 3.33Å; M544-T546 PolarHBondContact O-N 3.34Å; T546-G549 PolarHBondContact O-N 3.48Å; T546-D550 PolarHBondContact O-N 3.49Å
547	E	57.3	Low	58.1	Low	105 Å²	105	91.8 Å²	91.8	49%	0.491	49%	0.485	S	S	.	.	H	α-helix	trans	-69.3	-35.2	177.1	-72.1	172.7	-177.6	0	0	111.9	R543 M544 G549 M551	R543-E547 WeakPolarHBondContact O-CG 3.48Å; R543-E547 PolarHBondContact O-N 3.19Å; R543-E547 VanDerWaalsContact O-N 3.1Å; M544-E547 PolarHBondContact O-N 3.08Å; E547-G549 VanDerWaalsContact C-N 3.35Å; E547-M551 PolarHBondContact O-N 3.33Å
548	D	51.6	Low	56.9	Low	80 Å²	80	91.5 Å²	91.5	43%	0.428	48%	0.48	S	S	.	.	H	α-helix	trans	-74	-25	179.4	-143.6	36	0	0	0	113	M544 K552	M544-D548 WeakPolarHBondContact O-CB 3.47Å; M544-D548 PolarHBondContact O-N 3.49Å; M544-D548 VanDerWaalsContact O-N 3.08Å; D548-K552 PolarHBondContact O-N 3.23Å
549	G	51.8	Low	55.5	Low	27 Å²	27	95.8 Å²	95.8	28%	0.278	50%	0.502	S	S	.	.	H	α-helix	trans	-72.5	-38.6	173.9	0	0	0	0	0	113.9	D545 T546 E547 K552 K553	D545-G549 PolarHBondContact O-N 3.1Å; T546-G549 PolarHBondContact O-N 3.48Å; E547-G549 VanDerWaalsContact C-N 3.35Å; G549-K552 PolarHBondContact O-N 3.44Å; G549-K553 PolarHBondContact O-N 3.48Å
550	D	44.1	Very low	54.1	Low	107 Å²	107	101.1 Å²	101.1	57%	0.572	53%	0.53	S	S	*	.	H	α-helix	trans	-73.1	-34.7	175.3	-85.4	-20.9	0	0	0	111.9	T546 K552 K553 C554	T546-D550 PolarHBondContact O-N 3.49Å; D550-K552 VanDerWaalsContact C-N 3.32Å; D550-K552 PolarHBondContact O-N 3.47Å; D550-K553 PolarHBondContact O-N 3.28Å; D550-C554 PolarHBondContact O-N 3.24Å
551	M	34.3	Very low	52.5	Low	106 Å²	106	103.6 Å²	103.6	52%	0.522	54%	0.543	S	S	.	.	H	α-helix	trans	-61.4	-37.2	171.6	-82.4	-169.9	-76.1	0	0	112.8	E547 K553 C554 I555	E547-M551 PolarHBondContact O-N 3.33Å; M551-K553 PolarHBondContact O-N 3.4Å; M551-C554 PolarHBondContact O-N 3.4Å; M551-I555 WeakPolarHBondContact O-CD1 3.28Å; M551-I555 VanDerWaalsContact O-CG1 3.28Å; M551-I555 WeakPolarHBondContact O-CG1 3.33Å; M551-I555 PolarHBondContact O-N 3.46Å
552	K	37.1	Very low	50.8	Low	134 Å²	134	102.8 Å²	102.8	58%	0.583	55%	0.545	S	S	*	.	H	α-helix	trans	-70.7	-25.6	177	-77.1	174	-176.3	160.9	0	114	D548 G549 D550	D548-K552 PolarHBondContact O-N 3.23Å; G549-K552 PolarHBondContact O-N 3.44Å; D550-K552 VanDerWaalsContact C-N 3.32Å; D550-K552 PolarHBondContact O-N 3.47Å
553	K	37.7	Very low	49	Very low	153 Å²	153	108.9 Å²	108.9	67%	0.665	58%	0.578	S	S	*	*	H	α-helix	trans	-72.8	-34	171.8	-80.6	-179.8	178.7	171.4	0	112.4	G549 D550 M551 I555	G549-K553 PolarHBondContact O-N 3.48Å; D550-K553 PolarHBondContact O-N 3.28Å; M551-K553 PolarHBondContact O-N 3.4Å; K553-I555 VanDerWaalsContact C-N 3.31Å; K553-I555 PolarHBondContact O-N 3.32Å
554	C	34.4	Very low	47	Very low	106 Å²	106	109.5 Å²	109.5	72%	0.716	59%	0.592	S	S	*	*	H	α-helix	trans	-73.9	-16.5	176.7	-79.9	0	0	0	0	114.5	D550 M551	D550-C554 PolarHBondContact O-N 3.24Å; M551-C554 PolarHBondContact O-N 3.4Å
555	I	38.4	Very low	45.4	Very low	136 Å²	136	108.4 Å²	108.4	70%	0.697	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-13.1	-178.4	-61.6	162.5	0	0	0	112.4	M551 K553	M551-I555 WeakPolarHBondContact O-CD1 3.28Å; M551-I555 VanDerWaalsContact O-CG1 3.28Å; M551-I555 WeakPolarHBondContact O-CG1 3.33Å; M551-I555 PolarHBondContact O-N 3.46Å; K553-I555 VanDerWaalsContact C-N 3.31Å; K553-I555 PolarHBondContact O-N 3.32Å
556	L	39.7	Very low	43.6	Very low	160 Å²	160	109.7 Å²	109.7	84%	0.838	60%	0.598	S	S	*	*			trans	-111.1	35.8	178.6	-76.2	166.9	0	0	0	112.7
557	S	34.9	Very low	41.9	Very low	168 Å²	168	116.5 Å²	116.5	100%	1.175	63%	0.633	S	S	*	*			trans	-100.7	0	169.6	-58.6	0	0	0	0	111.5

Retrieved 557 of 557 residues in 4274.3 ms (Link to these results)

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