A0A096NKB5_PAPAN Loading...

X-ray repair cross-complementing protein 6

AlphaFold DB (A0A2K6P5Y3), UniProt , Accession A0A096NKB5, Species PAPAN (Papio anubis, Olive baboon), Gene XRCC6, Length 609 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40	Very low	32.8	Very low	245 Å²	245	168.9 Å²	168.9	100%	1.207	84%	0.842	S	S	*	*				0	64.6	0	-74.9	-125	-76.2	0	0	109.1
2	S	40.8	Very low	32.3	Very low	127 Å²	127	159.8 Å²	159.8	89%	0.888	82%	0.822	S	S	*	*			trans	-153.6	57.5	-170	59.7	0	0	0	0	110.9
3	G	33.3	Very low	32.2	Very low	58 Å²	58	160.7 Å²	160.7	60%	0.598	83%	0.83	S	S	*	*			trans	-154.3	32.6	-177.8	0	0	0	0	0	113.7
4	W	32.3	Very low	32.3	Very low	241 Å²	241	158 Å²	158	91%	0.913	81%	0.812	S	S	*	*	S	Bend	trans	-119.9	-2.9	-175.6	-89	49	0	0	0	114
5	E	31.3	Very low	32.1	Very low	185 Å²	185	156.3 Å²	156.3	86%	0.864	80%	0.799	S	S	*	*	S	Bend	trans	-99.1	-8.7	-176.8	-78.9	176.7	158.5	0	0	114.7
6	S	28.3	Very low	32	Very low	110 Å²	110	150.5 Å²	150.5	77%	0.769	78%	0.782	S	S	*	*	S	Bend	trans	-94.7	8.8	-168.4	67.7	0	0	0	0	116.2
7	Y	28.6	Very low	31.8	Very low	210 Å²	210	146.6 Å²	146.6	82%	0.824	76%	0.759	S	S	*	*	S	Bend	trans	-118.9	-3.3	-179.9	-120.8	-87.5	0	0	0	115.2
8	Y	33	Very low	31.6	Very low	201 Å²	201	142.4 Å²	142.4	79%	0.788	74%	0.735	S	S	*	*			trans	-116.1	98.4	-178.1	-67.9	-73.9	0	0	0	110.4	T10	Y8-T10 PolarHBondContact O-N 2.95Å
9	K	27.6	Very low	31.3	Very low	174 Å²	174	143.5 Å²	143.5	76%	0.757	74%	0.737	S	S	*	*			trans	-63.9	122.4	151.7	-88.8	179.4	170.9	-177.4	0	107.1	E11	K9-E11 VanDerWaalsContact C-N 3.29Å; K9-E11 HydrophobicContact CB-CG 4.48Å; K9-E11 PolarHBondContact O-N 3.42Å
10	T	35.3	Very low	31.1	Very low	149 Å²	149	145.2 Å²	145.2	91%	0.914	74%	0.741	S	S	*	*			trans	-61	91.9	159.5	30.9	0	0	0	0	108.6	Y8	Y8-T10 PolarHBondContact O-N 2.95Å
11	E	30.2	Very low	31	Very low	158 Å²	158	142.9 Å²	142.9	74%	0.738	73%	0.727	S	S	*	*			trans	-103.2	120.4	162.5	-78.7	174.3	-175.8	0	0	107.2	K9	K9-E11 VanDerWaalsContact C-N 3.29Å; K9-E11 HydrophobicContact CB-CG 4.48Å; K9-E11 PolarHBondContact O-N 3.42Å
12	G	27.2	Very low	30.4	Very low	59 Å²	59	136.6 Å²	136.6	61%	0.608	70%	0.695	S	S	*	*			trans	-81.7	160.5	-175.9	0	0	0	0	0	113	E14	G12-E14 VanDerWaalsContact C-N 3.26Å; G12-E14 PolarHBondContact O-N 3.36Å
13	D	30.8	Very low	29.9	Very low	172 Å²	172	135 Å²	135	92%	0.92	68%	0.676	S	S	*	*	S	Bend	trans	49.2	-1.7	155.6	-73.6	-11.4	0	0	0	122.3
14	E	32.9	Very low	29.8	Very low	123 Å²	123	137.5 Å²	137.5	58%	0.575	68%	0.676	S	S	*	*			trans	-93.6	-24.4	-175.5	-66.4	-163.6	154.4	0	0	115.6	G12 A16 K31	G12-E14 VanDerWaalsContact C-N 3.26Å; G12-E14 PolarHBondContact O-N 3.36Å; E14-A16 VanDerWaalsContact C-N 3.25Å; E14-A16 PolarHBondContact O-N 3.38Å; E14-K31 VanDerWaalsContact CD-NZ 3.26Å; E14-K31 IonicContact OE1-NZ 3.31Å; E14-K31 PolarHBondContact OE1-NZ 3.47Å; E14-K31 VanDerWaalsContact OE1-NZ 3.12Å; E14-K31 IonicContact OE2-NZ 3.34Å; E14-K31 PolarHBondContact OE2-NZ 3.46Å
15	E	29.9	Very low	29.6	Very low	132 Å²	132	133 Å²	133	62%	0.617	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	20.6	-167.7	-60.2	-179.6	162.9	0	0	115.2	K297	E15-K297 PolarHBondContact O-NZ 3.28Å
16	A	30	Very low	29.6	Very low	64 Å²	64	126.3 Å²	126.3	53%	0.529	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100	-21.2	-177.8	0	0	0	0	0	114.8	E14 K297	E14-A16 VanDerWaalsContact C-N 3.25Å; E14-A16 PolarHBondContact O-N 3.38Å; A16-K297 HydrophobicContact CB-CD 3.84Å
17	E	29.5	Very low	29.7	Very low	84 Å²	84	123.6 Å²	123.6	39%	0.393	62%	0.622	S	S	.	*	S	Bend	trans	-98.5	-6.3	-175.4	-54.2	-157.6	122.2	0	0	112.1	E19 Q20 E21 R80	E17-E19 PolarHBondContact O-N 3.05Å; E17-Q20 PolarHBondContact O-N 3Å; E17-Q20 VanDerWaalsContact O-N 3.17Å; E17-E21 HydrophobicContact CB-CG 4.1Å; E17-E21 VanDerWaalsContact CB-OE2 3.26Å; E17-E21 WeakPolarHBondContact CB-OE2 3.41Å; E17-E21 WeakPolarHBondContact O-CB 3.36Å; E17-E21 WeakPolarHBondContact O-CG 3.41Å; E17-E21 PolarHBondContact O-N 3.25Å; E17-R80 IonicContact OE1-CZ 3.55Å; E17-R80 IonicContact OE1-NH1 3Å; E17-R80 IonicContact OE1-NH2 3.69Å; E17-R80 PolarHBondContact OE1-NH2 3.26Å; E17-R80 IonicContact OE2-CZ 2.83Å; E17-R80 IonicContact OE2-NH1 3.76Å; E17-R80 PolarHBondContact OE2-NH1 2.96Å; E17-R80 IonicContact OE2-NH2 3.7Å; E17-R80 PolarHBondContact OE2-NH2 3.28Å
18	E	28.5	Very low	29.8	Very low	72 Å²	72	116.5 Å²	116.5	34%	0.336	61%	0.613	S	S	.	*	H	α-helix	trans	-59.9	-29.5	-172.1	-79	175.5	-179.4	0	0	115.3	Q20 E21 E22	E18-Q20 VanDerWaalsContact C-N 3.29Å; E18-Q20 PolarHBondContact O-N 3.08Å; E18-E21 PolarHBondContact O-N 3.15Å; E18-E22 HydrophobicContact CB-CG 4.14Å; E18-E22 WeakPolarHBondContact O-CA 3.17Å; E18-E22 WeakPolarHBondContact O-CB 3.28Å; E18-E22 VanDerWaalsContact O-CG 3.28Å; E18-E22 WeakPolarHBondContact O-CG 3.21Å; E18-E22 PolarHBondContact O-N 2.87Å
19	E	26.2	Very low	29.7	Very low	162 Å²	162	114.1 Å²	114.1	76%	0.757	61%	0.614	S	S	*	*	H	α-helix	trans	-77.1	-11.6	-179.8	-74.7	-173.7	175.4	0	0	114.3	E17	E17-E19 PolarHBondContact O-N 3.05Å
20	Q	27.3	Very low	30.2	Very low	178 Å²	178	113.3 Å²	113.3	83%	0.832	61%	0.607	S	S	*	*	H	α-helix	trans	-107.8	-17.8	163	-78.5	-175.2	9.6	0	0	113.1	E17 E18	E17-Q20 PolarHBondContact O-N 3Å; E17-Q20 VanDerWaalsContact O-N 3.17Å; E18-Q20 VanDerWaalsContact C-N 3.29Å; E18-Q20 PolarHBondContact O-N 3.08Å
21	E	29	Very low	30.3	Very low	96 Å²	96	112.7 Å²	112.7	45%	0.449	59%	0.592	S	S	.	*	H	α-helix	trans	-96.9	-20.5	-179.4	-68.8	-169.6	150.8	0	0	115.7	E17 E18 N23 L24	E17-E21 HydrophobicContact CB-CG 4.1Å; E17-E21 VanDerWaalsContact CB-OE2 3.26Å; E17-E21 WeakPolarHBondContact CB-OE2 3.41Å; E17-E21 WeakPolarHBondContact O-CB 3.36Å; E17-E21 WeakPolarHBondContact O-CG 3.41Å; E17-E21 PolarHBondContact O-N 3.25Å; E18-E21 PolarHBondContact O-N 3.15Å; E21-N23 PolarHBondContact O-N 2.97Å; E21-L24 PolarHBondContact O-N 2.99Å
22	E	25.7	Very low	31.1	Very low	113 Å²	113	111.1 Å²	111.1	53%	0.528	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.1	-15.6	175.5	-90.5	-170.5	162.8	0	0	112.4	E18 L24	E18-E22 HydrophobicContact CB-CG 4.14Å; E18-E22 WeakPolarHBondContact O-CA 3.17Å; E18-E22 WeakPolarHBondContact O-CB 3.28Å; E18-E22 VanDerWaalsContact O-CG 3.28Å; E18-E22 WeakPolarHBondContact O-CG 3.21Å; E18-E22 PolarHBondContact O-N 2.87Å; E22-L24 VanDerWaalsContact C-N 3.26Å; E22-L24 PolarHBondContact O-N 2.78Å
23	N	30.6	Very low	32.3	Very low	93 Å²	93	112.5 Å²	112.5	50%	0.497	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.1	-2	176.2	-99.9	-42.6	0	0	0	113.2	E21 R403	E21-N23 PolarHBondContact O-N 2.97Å; N23-R403 VanDerWaalsContact CB-NH1 3.28Å; N23-R403 WeakPolarHBondContact O-CD 3.34Å; N23-R403 PolarHBondContact O-NE 2.76Å; N23-R403 PolarHBondContact O-NH1 2.86Å; N23-R403 PolarHBondContact OD1-NH1 3.1Å; N23-R403 PolarHBondContact OD1-NH2 3.32Å
24	L	31.7	Very low	34	Very low	112 Å²	112	105.4 Å²	105.4	59%	0.586	55%	0.548	S	S	*	.	S	Bend	trans	-113.4	-4.9	-178	-78.2	151.7	0	0	0	114.3	E21 E22 A26	E21-L24 PolarHBondContact O-N 2.99Å; E22-L24 VanDerWaalsContact C-N 3.26Å; E22-L24 PolarHBondContact O-N 2.78Å; L24-A26 PolarHBondContact O-N 3.08Å
25	E	28	Very low	36.4	Very low	146 Å²	146	102.7 Å²	102.7	68%	0.682	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-1.5	-170.1	-64.8	-171	156.8	0	0	116.3
26	A	30.5	Very low	39.1	Very low	45 Å²	45	98 Å²	98	37%	0.372	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	15	-174.4	0	0	0	0	0	115.4	L24 R404	L24-A26 PolarHBondContact O-N 3.08Å; A26-R404 HydrophobicContact CB-CB 3.86Å; A26-R404 HydrophobicContact CB-CG 4.02Å
27	S	31.3	Very low	42	Very low	53 Å²	53	95.1 Å²	95.1	37%	0.371	49%	0.487	S	S	.	.	S	Bend	trans	-138.2	94.7	175.1	171.4	0	0	0	0	110.5
28	G	30.9	Very low	45.1	Very low	61 Å²	61	91.6 Å²	91.6	63%	0.629	47%	0.471	S	S	*	.			trans	35.3	104.9	161.3	0	0	0	0	0	117	Y30	G28-Y30 PolarHBondContact O-N 3.06Å
29	D	30.7	Very low	48.3	Very low	150 Å²	150	88.1 Å²	88.1	80%	0.802	46%	0.455	S	S	*	.			trans	-39.3	102	175	-81.4	-35.1	0	0	0	113.7
30	Y	38	Very low	51.7	Low	158 Å²	158	80.4 Å²	80.4	62%	0.62	42%	0.419	S	S	*	.			trans	-128.8	76.6	152.3	-73.9	-81.4	0	0	0	106.8	G28 Y32	G28-Y30 PolarHBondContact O-N 3.06Å; Y30-Y32 PolarHBondContact O-N 3.05Å
31	K	37.3	Very low	55.1	Low	136 Å²	136	72 Å²	72	59%	0.591	38%	0.379	S	S	*	.			trans	-60.8	102.8	164.7	-77.4	-174.1	172.6	-176.3	0	107.4	E14 S33	E14-K31 VanDerWaalsContact CD-NZ 3.26Å; E14-K31 IonicContact OE1-NZ 3.31Å; E14-K31 PolarHBondContact OE1-NZ 3.47Å; E14-K31 VanDerWaalsContact OE1-NZ 3.12Å; E14-K31 IonicContact OE2-NZ 3.34Å; E14-K31 PolarHBondContact OE2-NZ 3.46Å; K31-S33 PolarHBondContact O-N 2.97Å
32	Y	47.5	Very low	58.4	Low	125 Å²	125	67.4 Å²	67.4	49%	0.49	36%	0.358	S	S	.	.			trans	-70.9	77.4	165.5	-120.6	-88.2	0	0	0	107.1	Y30 H163	Y30-Y32 PolarHBondContact O-N 3.05Å; Y32-H163 PolarHBondContact OH-NE2 3.19Å
33	S	51.4	Low	61.8	Low	88 Å²	88	62 Å²	62	62%	0.615	33%	0.333	S	S	*	.			trans	-97.8	10.3	-167.6	103.6	0	0	0	0	114.4	K31	K31-S33 PolarHBondContact O-N 2.97Å
34	G	67.4	Low	65	Low	22 Å²	22	57.6 Å²	57.6	23%	0.227	31%	0.309	C	S	.	.	S	Bend	trans	-111.7	152.9	-178.4	0	0	0	0	0	112.8	K160 S162	G34-K160 WeakPolarHBondContact CA-O 3.35Å; G34-S162 WeakPolarHBondContact CA-OG 3.34Å; G34-S162 PolarHBondContact N-OG 3.47Å; G34-S162 PolarHBondContact O-OG 2.84Å
35	R	83.6	Confident	68	Low	67 Å²	67	53.1 Å²	53.1	25%	0.253	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	136.5	175.3	-61.7	-178.6	-177.3	-167.9	7.2	109.7	R80 L82 N110 K160 M161 S162	R35-R80 WeakPolarHBondContact CB-O 3.06Å; R35-R80 WeakPolarHBondContact CD-O 3.32Å; R35-R80 WeakPolarHBondContact CG-O 3.19Å; R35-L82 HydrophobicContact CB-CD1 4.45Å; R35-L82 HydrophobicContact CB-CG 4.32Å; R35-N110 PolarHBondContact NH1-OD1 3.03Å; R35-K160 PolarHBondContact N-O 3.24Å; R35-M161 CarbonylContact O-C 3.53Å; R35-M161 VanDerWaalsContact O-CA 3.24Å; R35-M161 WeakPolarHBondContact O-CA 3.31Å; R35-S162 PolarHBondContact O-N 3.47Å
36	D	85.6	Confident	71.2	Confident	34 Å²	34	52.6 Å²	52.6	18%	0.182	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	139.2	172	-73.6	-14	0	0	0	109.2	D81 L82 S162 H163	D36-D81 PolarHBondContact N-OD1 3.15Å; D36-D81 WeakPolarHBondContact O-CA 3.33Å; D36-L82 PolarHBondContact O-N 3.1Å; D36-S162 VanDerWaalsContact OD1-CB 3.24Å; D36-S162 WeakPolarHBondContact OD1-CB 3.45Å; D36-H163 WeakPolarHBondContact OD1-CB 3.14Å; D36-H163 IonicContact OD1-CD2 3.55Å; D36-H163 PolarHBondContact OD1-CD2 3.47Å; D36-H163 IonicContact OD1-CG 2.9Å; D36-H163 IonicContact OD2-CD2 3.66Å
37	S	91.1	Very high	74.2	Confident	2 Å²	2	52 Å²	52	1%	0.014	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	122.6	180	-61.7	0	0	0	0	110.2	L82 M161 H163 R165	S37-L82 WeakPolarHBondContact CA-O 3.37Å; S37-M161 WeakPolarHBondContact OG-CG 3.38Å; S37-H163 PolarHBondContact N-O 2.99Å; S37-R165 PolarHBondContact O-N 3.36Å
38	L	94.3	Very high	77.2	Confident	10 Å²	10	49.5 Å²	49.5	5%	0.052	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	122.3	-175.2	179.7	61.7	0	0	0	110.4	F40 L82 L83 A84 R165 M167 E250	L38-F40 HydrophobicContact CD2-CE1 3.8Å; L38-F40 HydrophobicContact CD2-CE2 4.16Å; L38-F40 HydrophobicContact CD2-CZ 3.45Å; L38-F40 VanDerWaalsContact CD2-CZ 3.45Å; L38-F40 HydrophobicContact CG-CE1 4.24Å; L38-F40 HydrophobicContact CG-CE2 4.34Å; L38-F40 HydrophobicContact CG-CZ 4.01Å; L38-L82 PolarHBondContact N-O 2.88Å; L38-L83 HydrophobicContact CB-CD2 3.93Å; L38-L83 HydrophobicContact CD2-CD2 4.25Å; L38-L83 HydrophobicContact CG-CD2 4.48Å; L38-L83 WeakPolarHBondContact O-CA 3.45Å; L38-A84 PolarHBondContact O-N 2.94Å; L38-R165 WeakPolarHBondContact CA-O 3.34Å; L38-R165 HydrophobicContact CD1-CB 3.91Å; L38-R165 HydrophobicContact CD1-CG 3.96Å; L38-M167 HydrophobicContact CD1-CB 4.48Å; L38-M167 HydrophobicContact CD1-CE 4.05Å; L38-M167 HydrophobicContact CD1-CG 3.85Å; L38-M167 HydrophobicContact CD1-SD 3.98Å; L38-M167 HydrophobicContact CD2-CE 4.36Å; L38-M167 HydrophobicContact CD2-SD 4.31Å; L38-E250 HydrophobicContact CD2-CG 4.19Å
39	I	97.1	Very high	80.1	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	122.6	174.7	-55.1	-178.9	0	0	0	108.5	A84 V86 L108 C150 L153 F154 R165 I166 M167	I39-A84 HydrophobicContact CB-CB 4.46Å; I39-A84 HydrophobicContact CG1-CB 4.1Å; I39-A84 HydrophobicContact CG2-CB 4.3Å; I39-V86 HydrophobicContact CG2-CB 4.46Å; I39-V86 HydrophobicContact CG2-CG2 3.82Å; I39-L108 HydrophobicContact CD1-CD1 4.45Å; I39-L108 HydrophobicContact CG1-CD1 4.43Å; I39-L108 HydrophobicContact CG1-CD2 4.07Å; I39-L108 HydrophobicContact CG1-CG 4.36Å; I39-C150 HydrophobicContact CD1-CB 4.03Å; I39-C150 WeakPolarHBondContact CD1-O 3.33Å; I39-L153 HydrophobicContact CD1-CB 3.97Å; I39-L153 HydrophobicContact CD1-CD1 4.16Å; I39-F154 HydrophobicContact CD1-CD1 4.44Å; I39-F154 HydrophobicContact CD1-CD2 3.94Å; I39-F154 HydrophobicContact CD1-CE1 3.97Å; I39-F154 HydrophobicContact CD1-CE2 3.42Å; I39-F154 VanDerWaalsContact CD1-CE2 3.42Å; I39-F154 HydrophobicContact CD1-CG 4.41Å; I39-F154 HydrophobicContact CD1-CZ 3.44Å; I39-F154 VanDerWaalsContact CD1-CZ 3.44Å; I39-F154 HydrophobicContact CG1-CE1 3.98Å; I39-F154 HydrophobicContact CG1-CE2 4.11Å; I39-F154 HydrophobicContact CG1-CZ 3.59Å; I39-R165 PolarHBondContact N-O 3.1Å; I39-I166 HydrophobicContact CB-CG1 4.34Å; I39-I166 HydrophobicContact CD1-CG1 4.46Å; I39-I166 WeakPolarHBondContact O-CA 3.39Å; I39-M167 PolarHBondContact O-N 2.94Å
40	F	97.8	Very high	83	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	115.7	167.1	-58.2	-75.7	0	0	0	108.8	L38 I67 V70 Y71 L83 A84 V85 V86 M167 F169	L38-F40 HydrophobicContact CD2-CE1 3.8Å; L38-F40 HydrophobicContact CD2-CE2 4.16Å; L38-F40 HydrophobicContact CD2-CZ 3.45Å; L38-F40 VanDerWaalsContact CD2-CZ 3.45Å; L38-F40 HydrophobicContact CG-CE1 4.24Å; L38-F40 HydrophobicContact CG-CE2 4.34Å; L38-F40 HydrophobicContact CG-CZ 4.01Å; F40-I67 HydrophobicContact CB-CD1 3.75Å; F40-I67 HydrophobicContact CB-CG1 3.95Å; F40-I67 HydrophobicContact CB-CG2 4.44Å; F40-I67 HydrophobicContact CD1-CD1 4.46Å; F40-I67 HydrophobicContact CD1-CG1 3.77Å; F40-I67 HydrophobicContact CD2-CG1 4.38Å; F40-I67 HydrophobicContact CD2-CG2 3.74Å; F40-I67 HydrophobicContact CE1-CG1 4.37Å; F40-I67 HydrophobicContact CE2-CG2 4.08Å; F40-I67 HydrophobicContact CG-CB 4.49Å; F40-I67 HydrophobicContact CG-CD1 4.16Å; F40-I67 HydrophobicContact CG-CG1 3.77Å; F40-I67 HydrophobicContact CG-CG2 3.99Å; F40-V70 HydrophobicContact CE1-CG1 4.46Å; F40-V70 HydrophobicContact CE1-CG2 4.48Å; F40-V70 HydrophobicContact CE2-CG1 4.49Å; F40-V70 HydrophobicContact CZ-CB 3.92Å; F40-V70 HydrophobicContact CZ-CG1 3.63Å; F40-V70 HydrophobicContact CZ-CG2 4.35Å; F40-Y71 HydrophobicContact CD2-CE2 4.02Å; F40-Y71 HydrophobicContact CE2-CD2 4.19Å; F40-Y71 AromaticContact CE2-CE2 3.76Å; F40-Y71 HydrophobicContact CE2-CE2 3.76Å; F40-L83 HydrophobicContact CE2-CB 4.43Å; F40-L83 HydrophobicContact CE2-CD1 4.45Å; F40-L83 HydrophobicContact CE2-CD2 4.14Å; F40-A84 WeakPolarHBondContact CD2-O 3.46Å; F40-A84 PolarHBondContact N-O 2.78Å; F40-V85 HydrophobicContact CB-CG2 4.48Å; F40-V85 HydrophobicContact CD2-CG2 4.3Å; F40-V86 PolarHBondContact O-N 2.66Å; F40-M167 HydrophobicContact CD1-CB 4.45Å; F40-M167 HydrophobicContact CE1-SD 4.15Å; F40-F169 AromaticContact CD1-CE2 3.8Å; F40-F169 HydrophobicContact CD1-CE2 3.8Å; F40-F169 HydrophobicContact CD1-CZ 4.13Å
41	L	98	Very high	85.2	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	112.1	179.3	179.7	61.3	0	0	0	108.9	V86 Y88 V146 I166 M167 L168 F169	L41-V86 CarbonylContact C-O 3.54Å; L41-V86 WeakPolarHBondContact CA-O 3.24Å; L41-V86 HydrophobicContact CD1-CB 3.92Å; L41-V86 HydrophobicContact CD1-CG1 3.8Å; L41-Y88 HydrophobicContact CD1-CD1 3.67Å; L41-Y88 HydrophobicContact CD1-CE1 4.34Å; L41-Y88 HydrophobicContact CG-CD1 3.9Å; L41-Y88 HydrophobicContact CG-CE1 4.06Å; L41-V146 HydrophobicContact CD1-CG1 3.56Å; L41-V146 HydrophobicContact CD2-CG1 3.62Å; L41-V146 HydrophobicContact CG-CG1 4.16Å; L41-I166 HydrophobicContact CB-CG2 4Å; L41-I166 HydrophobicContact CD2-CG2 4.17Å; L41-M167 PolarHBondContact N-O 2.88Å; L41-L168 HydrophobicContact CB-CD1 4.36Å; L41-L168 HydrophobicContact CD2-CD1 3.81Å; L41-L168 HydrophobicContact CG-CD1 3.84Å; L41-L168 CarbonylContact O-C 3.37Å; L41-L168 WeakPolarHBondContact O-CA 3.41Å; L41-F169 PolarHBondContact O-N 2.74Å
42	V	98.1	Very high	86.9	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	130.7	-172.4	-176.9	0	0	0	0	111	M48 F60 I67 V86 F87 Y88 F169	V42-M48 HydrophobicContact CG1-CE 4.36Å; V42-F60 HydrophobicContact CG1-CD2 4.1Å; V42-F60 HydrophobicContact CG1-CE2 4.16Å; V42-I67 HydrophobicContact CG2-CD1 3.48Å; V42-I67 VanDerWaalsContact CG2-CD1 3.48Å; V42-V86 PolarHBondContact N-O 3.5Å; V42-F87 HydrophobicContact CB-CD1 3.67Å; V42-F87 HydrophobicContact CB-CE1 3.74Å; V42-F87 HydrophobicContact CG1-CD1 4.05Å; V42-F87 HydrophobicContact CG1-CE1 3.97Å; V42-F87 HydrophobicContact CG2-CE1 4.19Å; V42-F87 WeakPolarHBondContact O-CA 3.38Å; V42-Y88 WeakPolarHBondContact O-CD1 3.45Å; V42-Y88 PolarHBondContact O-N 2.9Å; V42-Y88 VanDerWaalsContact O-N 3.16Å; V42-F169 HydrophobicContact CG2-CB 4.4Å; V42-F169 HydrophobicContact CG2-CD2 4.35Å
43	D	97.9	Very high	87.9	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	128.9	174.3	-164.2	-18.4	0	0	0	111.6	S45 M48 Y88 F169 T170	D43-S45 WeakPolarHBondContact OD1-CA 3.16Å; D43-S45 WeakPolarHBondContact OD1-CB 3.03Å; D43-S45 PolarHBondContact OD1-N 3.32Å; D43-S45 PolarHBondContact OD1-OG 3.39Å; D43-M48 HydrophobicContact CB-CE 4.07Å; D43-M48 HydrophobicContact CB-CG 3.76Å; D43-M48 HydrophobicContact CB-SD 4.06Å; D43-M48 WeakPolarHBondContact O-CE 3.37Å; D43-M48 WeakPolarHBondContact O-CG 3.26Å; D43-Y88 VanDerWaalsContact CA-CE1 3.48Å; D43-Y88 HydrophobicContact CB-CE1 3.81Å; D43-Y88 HydrophobicContact CB-CE2 4.09Å; D43-Y88 VanDerWaalsContact CB-CZ 3.45Å; D43-Y88 WeakPolarHBondContact CB-OH 3.35Å; D43-Y88 VanDerWaalsContact CG-CZ 3.43Å; D43-Y88 PolarHBondContact OD2-OH 2.83Å; D43-F169 VanDerWaalsContact CB-O 3.28Å; D43-F169 WeakPolarHBondContact CB-O 3.29Å; D43-F169 PolarHBondContact N-O 2.92Å; D43-T170 WeakPolarHBondContact OD2-CB 3.31Å; D43-T170 PolarHBondContact OD2-OG1 2.99Å
44	A	96.8	Very high	88.3	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.203	C	C	.	.			trans	-110	26.2	173.4	0	0	0	0	0	112.4	F49 Y88 T90 F131 H137 G138	A44-F49 HydrophobicContact CB-CE2 4.31Å; A44-F49 HydrophobicContact CB-CZ 4.42Å; A44-Y88 WeakPolarHBondContact CA-O 3.5Å; A44-Y88 VanDerWaalsContact CB-O 3.28Å; A44-Y88 WeakPolarHBondContact CB-O 3.35Å; A44-Y88 PolarHBondContact N-O 2.78Å; A44-T90 HydrophobicContact CB-CG2 3.84Å; A44-F131 HydrophobicContact CB-CE1 3.87Å; A44-F131 HydrophobicContact CB-CZ 4Å; A44-H137 WeakPolarHBondContact O-CB 3.44Å; A44-G138 PolarHBondContact O-N 2.92Å
45	S	95.4	Very high	88.5	Confident	19 Å²	19	45.8 Å²	45.8	13%	0.133	24%	0.235	C	C	.	.	S	Bend	trans	-65.7	157.2	170.7	-62.2	0	0	0	0	111.6	D43 A47 M48 F49 Y141	D43-S45 WeakPolarHBondContact OD1-CA 3.16Å; D43-S45 WeakPolarHBondContact OD1-CB 3.03Å; D43-S45 PolarHBondContact OD1-N 3.32Å; D43-S45 PolarHBondContact OD1-OG 3.39Å; S45-A47 VanDerWaalsContact C-N 3.26Å; S45-A47 PolarHBondContact O-N 3.49Å; S45-M48 WeakPolarHBondContact O-CB 3.49Å; S45-M48 PolarHBondContact O-N 2.87Å; S45-F49 WeakPolarHBondContact O-CD2 3.39Å; S45-Y141 WeakPolarHBondContact OG-CE1 3.37Å
46	K	94.1	Very high	88.3	Confident	134 Å²	134	45.1 Å²	45.1	58%	0.583	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-53.8	-41.5	-178.3	-170.9	-177.2	175.2	-172.4	0	113.1	M48 F49 E50	K46-M48 PolarHBondContact O-N 2.95Å; K46-F49 PolarHBondContact O-N 3.12Å; K46-F49 VanDerWaalsContact O-N 3.14Å; K46-E50 WeakPolarHBondContact CE-OE1 3.24Å
47	A	93.4	Very high	88.5	Confident	33 Å²	33	46.6 Å²	46.6	27%	0.273	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-62.3	-23.7	-179.1	0	0	0	0	0	113.9	S45 F49 E50 N171	S45-A47 VanDerWaalsContact C-N 3.26Å; S45-A47 PolarHBondContact O-N 3.49Å; A47-F49 PolarHBondContact O-N 3.33Å; A47-E50 PolarHBondContact O-N 3.1Å; A47-N171 PolarHBondContact O-ND2 2.64Å
48	M	94.4	Very high	88.6	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-71.6	-19.5	179.3	-72.3	-74.4	-69.6	0	0	112.9	V42 D43 S45 K46 P59 F60 N171 L205	V42-M48 HydrophobicContact CG1-CE 4.36Å; D43-M48 HydrophobicContact CB-CE 4.07Å; D43-M48 HydrophobicContact CB-CG 3.76Å; D43-M48 HydrophobicContact CB-SD 4.06Å; D43-M48 WeakPolarHBondContact O-CE 3.37Å; D43-M48 WeakPolarHBondContact O-CG 3.26Å; S45-M48 WeakPolarHBondContact O-CB 3.49Å; S45-M48 PolarHBondContact O-N 2.87Å; K46-M48 PolarHBondContact O-N 2.95Å; M48-P59 HydrophobicContact CE-CB 4.19Å; M48-P59 WeakPolarHBondContact O-CD 3.5Å; M48-P59 HydrophobicContact SD-CB 3.78Å; M48-F60 HydrophobicContact CB-CB 4.27Å; M48-F60 VanDerWaalsContact O-CB 3.25Å; M48-F60 WeakPolarHBondContact O-CB 3.17Å; M48-F60 PolarHBondContact O-N 3.47Å; M48-N171 WeakPolarHBondContact CG-OD1 3.14Å; M48-N171 HydrophobicContact SD-CB 4.08Å; M48-N171 PolarHBondContact SD-N 3.47Å; M48-N171 VanDerWaalsContact SD-N 3.4Å; M48-N171 PolarHBondContact SD-OD1 3.41Å; M48-N171 VanDerWaalsContact SD-OD1 3.38Å; M48-L205 HydrophobicContact CE-CD1 3.69Å; M48-L205 HydrophobicContact SD-CD1 3.97Å
49	F	93.4	Very high	88.6	Confident	16 Å²	16	47 Å²	47	7%	0.07	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-99.7	-1.9	-176.5	-68.2	-64.8	0	0	0	113.2	A44 S45 K46 A47 T58 F60 Q128 F131 H137	A44-F49 HydrophobicContact CB-CE2 4.31Å; A44-F49 HydrophobicContact CB-CZ 4.42Å; S45-F49 WeakPolarHBondContact O-CD2 3.39Å; K46-F49 PolarHBondContact O-N 3.12Å; K46-F49 VanDerWaalsContact O-N 3.14Å; A47-F49 PolarHBondContact O-N 3.33Å; F49-T58 WeakPolarHBondContact O-CG2 3.34Å; F49-F60 HydrophobicContact CD1-CB 3.87Å; F49-F60 HydrophobicContact CD1-CD1 4.13Å; F49-F60 HydrophobicContact CD1-CD2 4.42Å; F49-F60 AromaticContact CD1-CG 3.88Å; F49-F60 HydrophobicContact CD1-CG 3.88Å; F49-F60 HydrophobicContact CE1-CB 3.84Å; F49-F60 AromaticContact CE1-CD1 3.51Å; F49-F60 HydrophobicContact CE1-CD1 3.51Å; F49-F60 AromaticContact CE1-CD2 3.56Å; F49-F60 HydrophobicContact CE1-CD2 3.56Å; F49-F60 AromaticContact CE1-CE1 3.9Å; F49-F60 HydrophobicContact CE1-CE1 3.9Å; F49-F60 AromaticContact CE1-CE2 3.94Å; F49-F60 HydrophobicContact CE1-CE2 3.94Å; F49-F60 AromaticContact CE1-CG 3.32Å; F49-F60 HydrophobicContact CE1-CG 3.32Å; F49-F60 HydrophobicContact CE1-CZ 4.1Å; F49-F60 HydrophobicContact CZ-CD1 4.38Å; F49-F60 AromaticContact CZ-CD2 3.64Å; F49-F60 HydrophobicContact CZ-CD2 3.64Å; F49-F60 AromaticContact CZ-CE2 3.86Å; F49-F60 HydrophobicContact CZ-CE2 3.86Å; F49-F60 AromaticContact CZ-CG 3.92Å; F49-F60 HydrophobicContact CZ-CG 3.92Å; F49-F60 HydrophobicContact CZ-CZ 4.33Å; F49-Q128 HydrophobicContact CD1-CG 3.61Å; F49-Q128 VanDerWaalsContact CD1-NE2 3.27Å; F49-Q128 HydrophobicContact CE1-CG 4.06Å; F49-Q128 PolarHBondContact O-NE2 3.49Å; F49-F131 HydrophobicContact CE1-CD1 4.12Å; F49-F131 AromaticContact CZ-CD1 3.71Å; F49-F131 HydrophobicContact CZ-CD1 3.71Å; F49-F131 AromaticContact CZ-CE1 3.74Å; F49-F131 HydrophobicContact CZ-CE1 3.74Å; F49-H137 HydrophobicContact CD2-CB 4.16Å; F49-H137 AromaticContact CD2-CD2 3.82Å; F49-H137 HydrophobicContact CE2-CB 3.56Å; F49-H137 HydrophobicContact CZ-CB 4.24Å
50	E	90.6	Very high	88.5	Confident	99 Å²	99	47 Å²	47	46%	0.463	25%	0.246	S	C	.	.			trans	-98.2	123.3	-179.7	-65.9	176.4	-178.1	0	0	109.3	K46 A47 P59	K46-E50 WeakPolarHBondContact CE-OE1 3.24Å; A47-E50 PolarHBondContact O-N 3.1Å; E50-P59 WeakPolarHBondContact O-CD 3.45Å
51	S	84.9	Confident	88.4	Confident	56 Å²	56	47.6 Å²	47.6	39%	0.392	25%	0.249	S	C	.	.			trans	-82.5	143.2	172.1	-172.2	0	0	0	0	110.4	S53 E56	S51-S53 PolarHBondContact OG-O 3.09Å; S51-E56 PolarHBondContact OG-O 3.42Å
52	Q	73.1	Confident	88.2	Confident	71 Å²	71	47.9 Å²	47.9	33%	0.332	25%	0.25	S	S	.	.	S	Bend	trans	-96.5	-7.3	-176.9	-64.9	170.7	24.6	0	0	112.7	K206	Q52-K206 PolarHBondContact NE2-O 3.06Å
53	S	68.9	Low	88.1	Confident	49 Å²	49	47.9 Å²	47.9	34%	0.343	25%	0.25	S	S	.	.	S	Bend	trans	-156	149.1	176.9	46.7	0	0	0	0	110	S51 D55 E56	S51-S53 PolarHBondContact OG-O 3.09Å; S53-D55 PolarHBondContact O-N 3.09Å; S53-E56 PolarHBondContact O-N 3.47Å; S53-E56 WeakPolarHBondContact OG-CB 3.49Å; S53-E56 PolarHBondContact OG-OE2 2.86Å
54	E	58.7	Low	88	Confident	201 Å²	201	47.9 Å²	47.9	94%	0.939	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-26.7	-172.7	-66.6	-174.8	173	0	0	114.2
55	D	71.3	Confident	87.9	Confident	171 Å²	171	49.4 Å²	49.4	91%	0.914	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-4.8	-175.2	-67.6	-36.6	0	0	0	114.3	S53	S53-D55 PolarHBondContact O-N 3.09Å
56	E	80.3	Confident	87.8	Confident	52 Å²	52	48.5 Å²	48.5	24%	0.243	25%	0.251	C	S	.	.	S	Bend	trans	-108.2	145.2	-174.4	-155.2	147.8	-137.6	0	0	111.7	S51 S53 K238	S51-E56 PolarHBondContact OG-O 3.42Å; S53-E56 PolarHBondContact O-N 3.47Å; S53-E56 WeakPolarHBondContact OG-CB 3.49Å; S53-E56 PolarHBondContact OG-OE2 2.86Å; E56-K238 WeakPolarHBondContact OE1-CG 3.46Å
57	L	89.1	Confident	87.9	Confident	65 Å²	65	42.1 Å²	42.1	34%	0.34	22%	0.223	S	C	.	.			trans	-67.3	152.9	-179.8	-61.6	179.5	0	0	0	110.6	D61 M62 L239	L57-D61 HydrophobicContact CB-CB 4.45Å; L57-D61 WeakPolarHBondContact CD2-OD2 3.25Å; L57-M62 HydrophobicContact CB-CG 3.71Å; L57-M62 HydrophobicContact CD1-CG 4.41Å; L57-L239 HydrophobicContact CD1-CD2 4.39Å
58	T	93.1	Very high	87.9	Confident	16 Å²	16	41.4 Å²	41.4	10%	0.098	21%	0.214	C	C	.	.			trans	-64.1	149.7	171.8	62.5	0	0	0	0	110.3	F49 F60 D61 M62	F49-T58 WeakPolarHBondContact O-CG2 3.34Å; T58-F60 PolarHBondContact O-N 2.93Å; T58-F60 VanDerWaalsContact O-N 3.16Å; T58-D61 PolarHBondContact O-N 2.96Å; T58-D61 WeakPolarHBondContact OG1-CB 3.36Å; T58-D61 PolarHBondContact OG1-N 3.46Å; T58-M62 PolarHBondContact O-N 3.18Å
59	P	94.4	Very high	87.7	Confident	5 Å²	5	42.9 Å²	42.9	3%	0.032	22%	0.224	C	C	.	.	H	α-helix	trans	-50.3	-38.3	174.2	-28.9	35.1	0	0	0	113.6	M48 E50 S63 L205	M48-P59 HydrophobicContact CE-CB 4.19Å; M48-P59 WeakPolarHBondContact O-CD 3.5Å; M48-P59 HydrophobicContact SD-CB 3.78Å; E50-P59 WeakPolarHBondContact O-CD 3.45Å; P59-S63 PolarHBondContact O-N 3.33Å; P59-S63 VanDerWaalsContact O-N 3.08Å; P59-S63 PolarHBondContact O-OG 3.35Å; P59-L205 HydrophobicContact CB-CB 4.16Å; P59-L205 HydrophobicContact CB-CD1 3.59Å; P59-L205 HydrophobicContact CB-CG 4.47Å; P59-L205 WeakPolarHBondContact O-CD1 3.36Å
60	F	95.4	Very high	87.6	Confident	1 Å²	1	42.1 Å²	42.1	0%	0.004	22%	0.221	C	C	.	.	H	α-helix	trans	-63.2	-51.2	174.8	-176.4	-94.4	0	0	0	112.4	V42 M48 F49 T58 M62 S63 I64 F87 F122 F131	V42-F60 HydrophobicContact CG1-CD2 4.1Å; V42-F60 HydrophobicContact CG1-CE2 4.16Å; M48-F60 HydrophobicContact CB-CB 4.27Å; M48-F60 VanDerWaalsContact O-CB 3.25Å; M48-F60 WeakPolarHBondContact O-CB 3.17Å; M48-F60 PolarHBondContact O-N 3.47Å; F49-F60 HydrophobicContact CD1-CB 3.87Å; F49-F60 HydrophobicContact CD1-CD1 4.13Å; F49-F60 HydrophobicContact CD1-CD2 4.42Å; F49-F60 AromaticContact CD1-CG 3.88Å; F49-F60 HydrophobicContact CD1-CG 3.88Å; F49-F60 HydrophobicContact CE1-CB 3.84Å; F49-F60 AromaticContact CE1-CD1 3.51Å; F49-F60 HydrophobicContact CE1-CD1 3.51Å; F49-F60 AromaticContact CE1-CD2 3.56Å; F49-F60 HydrophobicContact CE1-CD2 3.56Å; F49-F60 AromaticContact CE1-CE1 3.9Å; F49-F60 HydrophobicContact CE1-CE1 3.9Å; F49-F60 AromaticContact CE1-CE2 3.94Å; F49-F60 HydrophobicContact CE1-CE2 3.94Å; F49-F60 AromaticContact CE1-CG 3.32Å; F49-F60 HydrophobicContact CE1-CG 3.32Å; F49-F60 HydrophobicContact CE1-CZ 4.1Å; F49-F60 HydrophobicContact CZ-CD1 4.38Å; F49-F60 AromaticContact CZ-CD2 3.64Å; F49-F60 HydrophobicContact CZ-CD2 3.64Å; F49-F60 AromaticContact CZ-CE2 3.86Å; F49-F60 HydrophobicContact CZ-CE2 3.86Å; F49-F60 AromaticContact CZ-CG 3.92Å; F49-F60 HydrophobicContact CZ-CG 3.92Å; F49-F60 HydrophobicContact CZ-CZ 4.33Å; T58-F60 PolarHBondContact O-N 2.93Å; T58-F60 VanDerWaalsContact O-N 3.16Å; F60-M62 VanDerWaalsContact C-N 3.34Å; F60-M62 PolarHBondContact O-N 3.23Å; F60-S63 WeakPolarHBondContact O-CB 3.48Å; F60-S63 PolarHBondContact O-N 3.49Å; F60-S63 VanDerWaalsContact O-N 3.08Å; F60-I64 HydrophobicContact CD1-CG1 4.13Å; F60-I64 HydrophobicContact CE1-CD1 4.3Å; F60-I64 HydrophobicContact CE1-CG1 3.7Å; F60-I64 HydrophobicContact CZ-CD1 4.01Å; F60-I64 HydrophobicContact CZ-CG1 3.92Å; F60-I64 WeakPolarHBondContact O-CG1 3.32Å; F60-I64 PolarHBondContact O-N 3.31Å; F60-F87 HydrophobicContact CE2-CD1 4.19Å; F60-F87 AromaticContact CE2-CE1 3.89Å; F60-F87 HydrophobicContact CE2-CE1 3.89Å; F60-F87 HydrophobicContact CZ-CE1 4.14Å; F60-F122 HydrophobicContact CE1-CB 4.42Å; F60-F131 HydrophobicContact CE1-CB 4.36Å; F60-F131 HydrophobicContact CE1-CD2 4.42Å; F60-F131 HydrophobicContact CE1-CG 4.18Å; F60-F131 HydrophobicContact CE2-CD1 4.22Å; F60-F131 HydrophobicContact CE2-CD2 4.3Å; F60-F131 HydrophobicContact CE2-CE1 4.04Å; F60-F131 HydrophobicContact CE2-CE2 4.07Å; F60-F131 HydrophobicContact CE2-CG 4.35Å; F60-F131 AromaticContact CE2-CZ 3.94Å; F60-F131 HydrophobicContact CE2-CZ 3.94Å; F60-F131 HydrophobicContact CZ-CB 4.24Å; F60-F131 AromaticContact CZ-CD1 3.86Å; F60-F131 HydrophobicContact CZ-CD1 3.86Å; F60-F131 AromaticContact CZ-CD2 3.55Å; F60-F131 HydrophobicContact CZ-CD2 3.55Å; F60-F131 HydrophobicContact CZ-CE1 4.09Å; F60-F131 AromaticContact CZ-CE2 3.76Å; F60-F131 HydrophobicContact CZ-CE2 3.76Å; F60-F131 AromaticContact CZ-CG 3.59Å; F60-F131 HydrophobicContact CZ-CG 3.59Å; F60-F131 HydrophobicContact CZ-CZ 4.04Å
61	D	94.9	Very high	87.7	Confident	12 Å²	12	37.4 Å²	37.4	6%	0.064	20%	0.199	C	C	.	.	H	α-helix	trans	-64.4	-38.5	-179.5	-169.9	19.1	0	0	0	111.7	L57 T58 S63 I64 Q65 G124	L57-D61 HydrophobicContact CB-CB 4.45Å; L57-D61 WeakPolarHBondContact CD2-OD2 3.25Å; T58-D61 PolarHBondContact O-N 2.96Å; T58-D61 WeakPolarHBondContact OG1-CB 3.36Å; T58-D61 PolarHBondContact OG1-N 3.46Å; D61-S63 VanDerWaalsContact C-N 3.28Å; D61-S63 PolarHBondContact O-N 3.24Å; D61-I64 PolarHBondContact O-N 2.93Å; D61-Q65 WeakPolarHBondContact O-CG 3.39Å; D61-Q65 PolarHBondContact O-N 3.43Å; D61-Q65 PolarHBondContact OD1-NE2 2.92Å; D61-Q65 PolarHBondContact OD2-NE2 3.14Å; D61-G124 PolarHBondContact OD1-N 2.93Å; D61-G124 WeakPolarHBondContact OD2-CA 3.26Å; D61-G124 PolarHBondContact OD2-N 3.42Å
62	M	93.6	Very high	87.9	Confident	6 Å²	6	36.3 Å²	36.3	3%	0.03	19%	0.188	C	C	.	.	H	α-helix	trans	-57.3	-42.9	171.2	-71.3	-164.7	-75.9	0	0	112.1	L57 T58 F60 C66 S237 L239 L242	L57-M62 HydrophobicContact CB-CG 3.71Å; L57-M62 HydrophobicContact CD1-CG 4.41Å; T58-M62 PolarHBondContact O-N 3.18Å; F60-M62 VanDerWaalsContact C-N 3.34Å; F60-M62 PolarHBondContact O-N 3.23Å; M62-C66 WeakPolarHBondContact O-CB 3.23Å; M62-C66 PolarHBondContact O-N 3.19Å; M62-S237 WeakPolarHBondContact CE-O 3.33Å; M62-L239 HydrophobicContact CG-CB 4.48Å; M62-L239 WeakPolarHBondContact O-CD1 3.21Å; M62-L242 HydrophobicContact CB-CD2 4.03Å
63	S	96.1	Very high	88.6	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-65	-48.1	179.4	-56.6	0	0	0	0	111.2	P59 F60 D61 Q65 C66 I67 L205	P59-S63 PolarHBondContact O-N 3.33Å; P59-S63 VanDerWaalsContact O-N 3.08Å; P59-S63 PolarHBondContact O-OG 3.35Å; F60-S63 WeakPolarHBondContact O-CB 3.48Å; F60-S63 PolarHBondContact O-N 3.49Å; F60-S63 VanDerWaalsContact O-N 3.08Å; D61-S63 VanDerWaalsContact C-N 3.28Å; D61-S63 PolarHBondContact O-N 3.24Å; S63-Q65 PolarHBondContact O-N 2.89Å; S63-C66 PolarHBondContact O-N 2.95Å; S63-I67 WeakPolarHBondContact O-CD1 3.5Å; S63-I67 WeakPolarHBondContact O-CG1 3.06Å; S63-I67 PolarHBondContact O-N 2.84Å; S63-L205 WeakPolarHBondContact OG-CD1 3.29Å
64	I	95.8	Very high	89.5	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.2	-47.4	178.8	-64.9	-59.8	0	0	0	111.5	F60 D61 C66 I67 Q68 F87 L119 F122	F60-I64 HydrophobicContact CD1-CG1 4.13Å; F60-I64 HydrophobicContact CE1-CD1 4.3Å; F60-I64 HydrophobicContact CE1-CG1 3.7Å; F60-I64 HydrophobicContact CZ-CD1 4.01Å; F60-I64 HydrophobicContact CZ-CG1 3.92Å; F60-I64 WeakPolarHBondContact O-CG1 3.32Å; F60-I64 PolarHBondContact O-N 3.31Å; D61-I64 PolarHBondContact O-N 2.93Å; I64-C66 VanDerWaalsContact C-N 3.33Å; I64-C66 PolarHBondContact O-N 2.95Å; I64-I67 PolarHBondContact O-N 3.27Å; I64-Q68 WeakPolarHBondContact O-CB 3.45Å; I64-Q68 PolarHBondContact O-N 3.26Å; I64-F87 HydrophobicContact CD1-CE1 3.92Å; I64-F87 HydrophobicContact CD1-CZ 3.87Å; I64-L119 WeakPolarHBondContact CG2-O 3.47Å; I64-F122 HydrophobicContact CD1-CB 4.42Å; I64-F122 HydrophobicContact CG1-CB 4.33Å; I64-F122 HydrophobicContact CG2-CB 4.31Å
65	Q	94.3	Very high	90.9	Very high	32 Å²	32	24.9 Å²	24.9	15%	0.15	13%	0.133	C	C	.	.	H	α-helix	trans	-66.3	-35.5	179.1	-68.4	-172.9	45.7	0	0	112.5	D61 S63 S69 K123 L239	D61-Q65 WeakPolarHBondContact O-CG 3.39Å; D61-Q65 PolarHBondContact O-N 3.43Å; D61-Q65 PolarHBondContact OD1-NE2 2.92Å; D61-Q65 PolarHBondContact OD2-NE2 3.14Å; S63-Q65 PolarHBondContact O-N 2.89Å; Q65-S69 WeakPolarHBondContact O-CB 3.43Å; Q65-S69 PolarHBondContact O-N 3.23Å; Q65-S69 PolarHBondContact O-OG 2.66Å; Q65-K123 HydrophobicContact CG-CD 4.06Å; Q65-K123 HydrophobicContact CG-CG 3.86Å; Q65-L239 HydrophobicContact CB-CD1 4.08Å; Q65-L239 HydrophobicContact CB-CD2 4.09Å
66	C	94.7	Very high	91.5	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-64.4	-44.9	173.8	-172	0	0	0	0	111.3	M62 S63 I64 S69 V70 L239 L242 V246	M62-C66 WeakPolarHBondContact O-CB 3.23Å; M62-C66 PolarHBondContact O-N 3.19Å; S63-C66 PolarHBondContact O-N 2.95Å; I64-C66 VanDerWaalsContact C-N 3.33Å; I64-C66 PolarHBondContact O-N 2.95Å; C66-S69 WeakPolarHBondContact O-CB 3.33Å; C66-S69 PolarHBondContact O-N 3.23Å; C66-V70 WeakPolarHBondContact O-CG2 3.47Å; C66-V70 PolarHBondContact O-N 2.95Å; C66-L239 HydrophobicContact CB-CD1 4.18Å; C66-L242 HydrophobicContact CB-CD2 3.92Å; C66-L242 HydrophobicContact CB-CG 4.2Å; C66-V246 VanDerWaalsContact SG-CG2 3.58Å
67	I	95.4	Very high	91.4	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62	-47	177.1	-65.3	163.9	0	0	0	110.1	F40 V42 S63 I64 S69 V70 Y71 V85 L119	F40-I67 HydrophobicContact CB-CD1 3.75Å; F40-I67 HydrophobicContact CB-CG1 3.95Å; F40-I67 HydrophobicContact CB-CG2 4.44Å; F40-I67 HydrophobicContact CD1-CD1 4.46Å; F40-I67 HydrophobicContact CD1-CG1 3.77Å; F40-I67 HydrophobicContact CD2-CG1 4.38Å; F40-I67 HydrophobicContact CD2-CG2 3.74Å; F40-I67 HydrophobicContact CE1-CG1 4.37Å; F40-I67 HydrophobicContact CE2-CG2 4.08Å; F40-I67 HydrophobicContact CG-CB 4.49Å; F40-I67 HydrophobicContact CG-CD1 4.16Å; F40-I67 HydrophobicContact CG-CG1 3.77Å; F40-I67 HydrophobicContact CG-CG2 3.99Å; V42-I67 HydrophobicContact CG2-CD1 3.48Å; V42-I67 VanDerWaalsContact CG2-CD1 3.48Å; S63-I67 WeakPolarHBondContact O-CD1 3.5Å; S63-I67 WeakPolarHBondContact O-CG1 3.06Å; S63-I67 PolarHBondContact O-N 2.84Å; I64-I67 PolarHBondContact O-N 3.27Å; I67-S69 VanDerWaalsContact C-N 3.26Å; I67-S69 PolarHBondContact O-N 3.19Å; I67-V70 PolarHBondContact O-N 3.18Å; I67-V70 VanDerWaalsContact O-N 3.08Å; I67-Y71 HydrophobicContact CG2-CD2 3.83Å; I67-Y71 HydrophobicContact CG2-CE2 3.71Å; I67-Y71 WeakPolarHBondContact O-CD2 3.36Å; I67-Y71 PolarHBondContact O-N 3.06Å; I67-V85 HydrophobicContact CG2-CG2 4.05Å; I67-L119 HydrophobicContact CG2-CD1 3.86Å
68	Q	92.9	Very high	90.4	Very high	18 Å²	18	19.6 Å²	19.6	8%	0.084	12%	0.116	C	C	.	.	H	α-helix	trans	-55.8	-43.2	175.7	-168.4	-176.4	39	0	0	111.4	I64 V70 Y71 I72 I116 D120	I64-Q68 WeakPolarHBondContact O-CB 3.45Å; I64-Q68 PolarHBondContact O-N 3.26Å; Q68-V70 VanDerWaalsContact C-N 3.33Å; Q68-V70 PolarHBondContact O-N 2.9Å; Q68-Y71 PolarHBondContact O-N 3.44Å; Q68-I72 HydrophobicContact CG-CD1 4.18Å; Q68-I72 WeakPolarHBondContact O-CG1 3.48Å; Q68-I72 PolarHBondContact O-N 3.44Å; Q68-I116 HydrophobicContact CG-CG2 4.08Å; Q68-D120 PolarHBondContact NE2-OD1 2.88Å
69	S	91	Very high	89.1	Confident	30 Å²	30	23.1 Å²	23.1	21%	0.21	14%	0.135	C	C	.	.	H	α-helix	trans	-62.5	-38.2	177.6	-60.8	0	0	0	0	112.5	Q65 C66 I67 S73	Q65-S69 WeakPolarHBondContact O-CB 3.43Å; Q65-S69 PolarHBondContact O-N 3.23Å; Q65-S69 PolarHBondContact O-OG 2.66Å; C66-S69 WeakPolarHBondContact O-CB 3.33Å; C66-S69 PolarHBondContact O-N 3.23Å; I67-S69 VanDerWaalsContact C-N 3.26Å; I67-S69 PolarHBondContact O-N 3.19Å; S69-S73 VanDerWaalsContact O-CB 3.31Å; S69-S73 WeakPolarHBondContact O-CB 3.37Å; S69-S73 PolarHBondContact O-N 3.26Å; S69-S73 PolarHBondContact O-OG 3.33Å
70	V	91.6	Very high	88.5	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-68.9	-44	175	176.2	0	0	0	0	111.2	F40 C66 I67 Q68 I72 S73 K74 V246 E250	F40-V70 HydrophobicContact CE1-CG1 4.46Å; F40-V70 HydrophobicContact CE1-CG2 4.48Å; F40-V70 HydrophobicContact CE2-CG1 4.49Å; F40-V70 HydrophobicContact CZ-CB 3.92Å; F40-V70 HydrophobicContact CZ-CG1 3.63Å; F40-V70 HydrophobicContact CZ-CG2 4.35Å; C66-V70 WeakPolarHBondContact O-CG2 3.47Å; C66-V70 PolarHBondContact O-N 2.95Å; I67-V70 PolarHBondContact O-N 3.18Å; I67-V70 VanDerWaalsContact O-N 3.08Å; Q68-V70 VanDerWaalsContact C-N 3.33Å; Q68-V70 PolarHBondContact O-N 2.9Å; V70-I72 VanDerWaalsContact C-N 3.33Å; V70-I72 PolarHBondContact O-N 3.15Å; V70-S73 PolarHBondContact O-N 3.11Å; V70-S73 VanDerWaalsContact O-N 3.13Å; V70-K74 HydrophobicContact CG1-CG 4.2Å; V70-K74 WeakPolarHBondContact O-CG 3.37Å; V70-K74 PolarHBondContact O-N 2.91Å; V70-V246 HydrophobicContact CG2-CG1 3.51Å; V70-E250 VanDerWaalsContact CG1-CD 3.44Å; V70-E250 HydrophobicContact CG1-CG 3.79Å
71	Y	92.1	Very high	88	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-55.2	-48.7	175.5	-91.8	-112.3	0	0	0	111.7	F40 I67 Q68 S73 K74 I75 L83 V85 Q106 P111 R115 I116 L119	F40-Y71 HydrophobicContact CD2-CE2 4.02Å; F40-Y71 HydrophobicContact CE2-CD2 4.19Å; F40-Y71 AromaticContact CE2-CE2 3.76Å; F40-Y71 HydrophobicContact CE2-CE2 3.76Å; I67-Y71 HydrophobicContact CG2-CD2 3.83Å; I67-Y71 HydrophobicContact CG2-CE2 3.71Å; I67-Y71 WeakPolarHBondContact O-CD2 3.36Å; I67-Y71 PolarHBondContact O-N 3.06Å; Q68-Y71 PolarHBondContact O-N 3.44Å; Y71-S73 PolarHBondContact O-N 3.07Å; Y71-K74 PolarHBondContact O-N 3.49Å; Y71-I75 WeakPolarHBondContact O-CG1 3.31Å; Y71-I75 PolarHBondContact O-N 3.17Å; Y71-L83 HydrophobicContact CD1-CD1 3.97Å; Y71-L83 HydrophobicContact CD2-CD1 3.54Å; Y71-L83 HydrophobicContact CE1-CB 4.16Å; Y71-L83 HydrophobicContact CE1-CD1 4.05Å; Y71-L83 HydrophobicContact CE2-CB 3.82Å; Y71-L83 HydrophobicContact CE2-CD1 3.62Å; Y71-L83 HydrophobicContact CE2-CG 4.36Å; Y71-L83 HydrophobicContact CG-CD1 3.72Å; Y71-V85 HydrophobicContact CE2-CG2 4.1Å; Y71-V85 WeakPolarHBondContact OH-CG2 3.23Å; Y71-Q106 VanDerWaalsContact CZ-OE1 3.31Å; Y71-Q106 PolarHBondContact OH-OE1 3.09Å; Y71-P111 HydrophobicContact CD1-CB 3.83Å; Y71-P111 HydrophobicContact CE1-CB 4.37Å; Y71-P111 HydrophobicContact CG-CB 4.5Å; Y71-R115 HydrophobicContact CD1-CB 4.41Å; Y71-R115 HydrophobicContact CE1-CB 3.96Å; Y71-I116 HydrophobicContact CD1-CG1 4.16Å; Y71-I116 HydrophobicContact CG-CG1 4.42Å; Y71-L119 HydrophobicContact CD1-CD1 4.48Å; Y71-L119 HydrophobicContact CD2-CD1 4.06Å; Y71-L119 HydrophobicContact CE1-CD1 4.42Å; Y71-L119 HydrophobicContact CE2-CD1 4.01Å; Y71-L119 HydrophobicContact CG-CD1 4.3Å
72	I	89.1	Confident	87.9	Confident	34 Å²	34	30.2 Å²	30.2	17%	0.174	16%	0.161	C	C	.	.	H	α-helix	trans	-62.4	-44.4	176.9	-64.9	166.4	0	0	0	110.4	Q68 V70 K74 I75 I76 I116	Q68-I72 HydrophobicContact CG-CD1 4.18Å; Q68-I72 WeakPolarHBondContact O-CG1 3.48Å; Q68-I72 PolarHBondContact O-N 3.44Å; V70-I72 VanDerWaalsContact C-N 3.33Å; V70-I72 PolarHBondContact O-N 3.15Å; I72-K74 VanDerWaalsContact C-N 3.31Å; I72-K74 PolarHBondContact O-N 2.74Å; I72-I75 PolarHBondContact O-N 3.07Å; I72-I76 HydrophobicContact CG2-CD1 3.85Å; I72-I76 HydrophobicContact CG2-CG1 4.5Å; I72-I76 VanDerWaalsContact O-CG1 3.27Å; I72-I76 WeakPolarHBondContact O-CG1 3.42Å; I72-I76 PolarHBondContact O-N 3.34Å; I72-I116 HydrophobicContact CG1-CD1 3.87Å
73	S	87.5	Confident	87.9	Confident	25 Å²	25	29.9 Å²	29.9	18%	0.175	16%	0.16	C	C	.	.	H	α-helix	trans	-61.6	-38.3	179.1	-58.6	0	0	0	0	112.2	S69 V70 Y71 I76 S77	S69-S73 VanDerWaalsContact O-CB 3.31Å; S69-S73 WeakPolarHBondContact O-CB 3.37Å; S69-S73 PolarHBondContact O-N 3.26Å; S69-S73 PolarHBondContact O-OG 3.33Å; V70-S73 PolarHBondContact O-N 3.11Å; V70-S73 VanDerWaalsContact O-N 3.13Å; Y71-S73 PolarHBondContact O-N 3.07Å; S73-I76 PolarHBondContact O-N 2.93Å; S73-S77 WeakPolarHBondContact O-CB 3.46Å; S73-S77 PolarHBondContact O-N 2.68Å; S73-S77 PolarHBondContact O-OG 2.8Å
74	K	88.5	Confident	88	Confident	5 Å²	5	29.9 Å²	29.9	2%	0.022	16%	0.16	C	C	.	.	H	α-helix	trans	-67.4	-41	175.1	-72.5	-61.1	-164.7	-166.5	0	112.3	V70 Y71 I72 I76 S77 S78 D79 D81 L83 P111 E250	V70-K74 HydrophobicContact CG1-CG 4.2Å; V70-K74 WeakPolarHBondContact O-CG 3.37Å; V70-K74 PolarHBondContact O-N 2.91Å; Y71-K74 PolarHBondContact O-N 3.49Å; I72-K74 VanDerWaalsContact C-N 3.31Å; I72-K74 PolarHBondContact O-N 2.74Å; K74-I76 PolarHBondContact O-N 3.38Å; K74-S77 PolarHBondContact O-N 3.49Å; K74-S78 CarbonylContact O-C 3.59Å; K74-S78 WeakPolarHBondContact O-CA 3.38Å; K74-S78 PolarHBondContact O-N 3.15Å; K74-D79 PolarHBondContact O-N 2.71Å; K74-D81 HydrophobicContact CD-CB 4.19Å; K74-D81 WeakPolarHBondContact CD-OD2 3.25Å; K74-D81 WeakPolarHBondContact CE-OD2 3.4Å; K74-D81 IonicContact NZ-OD2 3.42Å; K74-D81 PolarHBondContact NZ-OD2 2.96Å; K74-L83 HydrophobicContact CB-CD1 4.36Å; K74-L83 HydrophobicContact CG-CD1 4.12Å; K74-L83 HydrophobicContact CG-CD2 4.46Å; K74-P111 HydrophobicContact CB-CG 4.08Å; K74-E250 VanDerWaalsContact CD-OE1 3.26Å; K74-E250 WeakPolarHBondContact CD-OE1 3.47Å; K74-E250 WeakPolarHBondContact CE-OE1 3.18Å; K74-E250 IonicContact NZ-OE1 3.95Å; K74-E250 PolarHBondContact NZ-OE1 3.46Å; K74-E250 VanDerWaalsContact NZ-OE1 3.09Å
75	I	87.8	Confident	88.1	Confident	50 Å²	50	29.9 Å²	29.9	26%	0.256	16%	0.16	S	C	.	.	H	α-helix	trans	-60.2	-37.7	173	-67	175.7	0	0	0	111.1	Y71 I72 P111 I116 F487	Y71-I75 WeakPolarHBondContact O-CG1 3.31Å; Y71-I75 PolarHBondContact O-N 3.17Å; I72-I75 PolarHBondContact O-N 3.07Å; I75-P111 HydrophobicContact CD1-CB 4.26Å; I75-P111 HydrophobicContact CG1-CB 3.81Å; I75-P111 HydrophobicContact CG1-CG 3.86Å; I75-I116 HydrophobicContact CD1-CD1 3.36Å; I75-F487 HydrophobicContact CG2-CD1 4.14Å; I75-F487 HydrophobicContact CG2-CE1 4.13Å
76	I	83.7	Confident	88.3	Confident	51 Å²	51	28.4 Å²	28.4	26%	0.262	15%	0.153	S	C	.	.	H	α-helix	trans	-71.5	-38.7	179.9	-64.9	169.1	0	0	0	112.1	I72 S73 K74 F487	I72-I76 HydrophobicContact CG2-CD1 3.85Å; I72-I76 HydrophobicContact CG2-CG1 4.5Å; I72-I76 VanDerWaalsContact O-CG1 3.27Å; I72-I76 WeakPolarHBondContact O-CG1 3.42Å; I72-I76 PolarHBondContact O-N 3.34Å; S73-I76 PolarHBondContact O-N 2.93Å; K74-I76 PolarHBondContact O-N 3.38Å; I76-F487 HydrophobicContact CB-CE2 4.08Å; I76-F487 HydrophobicContact CB-CZ 4.14Å; I76-F487 HydrophobicContact CD1-CD2 4.28Å; I76-F487 HydrophobicContact CG1-CD1 4.21Å; I76-F487 HydrophobicContact CG1-CD2 3.66Å; I76-F487 HydrophobicContact CG1-CE1 4.22Å; I76-F487 HydrophobicContact CG1-CE2 3.69Å; I76-F487 HydrophobicContact CG1-CG 3.94Å; I76-F487 HydrophobicContact CG1-CZ 3.97Å; I76-F487 HydrophobicContact CG2-CD2 4.5Å; I76-F487 HydrophobicContact CG2-CE2 3.84Å; I76-F487 HydrophobicContact CG2-CZ 4.2Å
77	S	79.2	Confident	88.4	Confident	78 Å²	78	28.4 Å²	28.4	55%	0.545	15%	0.153	S	C	.	.	H	α-helix	trans	-118.5	-25.1	-163.6	65.8	0	0	0	0	115.9	S73 K74	S73-S77 WeakPolarHBondContact O-CB 3.46Å; S73-S77 PolarHBondContact O-N 2.68Å; S73-S77 PolarHBondContact O-OG 2.8Å; K74-S77 PolarHBondContact O-N 3.49Å
78	S	66.9	Low	88.5	Confident	48 Å²	48	28.4 Å²	28.4	34%	0.336	15%	0.153	S	C	.	.			trans	-164	77.3	-170.1	-68.9	0	0	0	0	112.1	K74 R80	K74-S78 CarbonylContact O-C 3.59Å; K74-S78 WeakPolarHBondContact O-CA 3.38Å; K74-S78 PolarHBondContact O-N 3.15Å; S78-R80 PolarHBondContact O-N 2.65Å; S78-R80 VanDerWaalsContact O-N 3.14Å
79	D	65.6	Low	88.6	Confident	91 Å²	91	27.5 Å²	27.5	49%	0.487	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	1.4	-177.1	-164	30.6	0	0	0	114.6	K74	K74-D79 PolarHBondContact O-N 2.71Å
80	R	81.8	Confident	88.8	Confident	147 Å²	147	26.1 Å²	26.1	56%	0.555	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-11.5	179.7	-65.2	-173.9	177.8	177	2.1	113.3	E17 R35 S78	E17-R80 IonicContact OE1-CZ 3.55Å; E17-R80 IonicContact OE1-NH1 3Å; E17-R80 IonicContact OE1-NH2 3.69Å; E17-R80 PolarHBondContact OE1-NH2 3.26Å; E17-R80 IonicContact OE2-CZ 2.83Å; E17-R80 IonicContact OE2-NH1 3.76Å; E17-R80 PolarHBondContact OE2-NH1 2.96Å; E17-R80 IonicContact OE2-NH2 3.7Å; E17-R80 PolarHBondContact OE2-NH2 3.28Å; R35-R80 WeakPolarHBondContact CB-O 3.06Å; R35-R80 WeakPolarHBondContact CD-O 3.32Å; R35-R80 WeakPolarHBondContact CG-O 3.19Å; S78-R80 PolarHBondContact O-N 2.65Å; S78-R80 VanDerWaalsContact O-N 3.14Å
81	D	86.3	Confident	88.9	Confident	19 Å²	19	32.7 Å²	32.7	10%	0.102	17%	0.17	C	C	.	.			trans	-78.9	144	-177.1	-67.5	-15.8	0	0	0	111	D36 K74 P111	D36-D81 PolarHBondContact N-OD1 3.15Å; D36-D81 WeakPolarHBondContact O-CA 3.33Å; K74-D81 HydrophobicContact CD-CB 4.19Å; K74-D81 WeakPolarHBondContact CD-OD2 3.25Å; K74-D81 WeakPolarHBondContact CE-OD2 3.4Å; K74-D81 IonicContact NZ-OD2 3.42Å; K74-D81 PolarHBondContact NZ-OD2 2.96Å; D81-P111 WeakPolarHBondContact O-CD 3.42Å
82	L	92.1	Very high	89	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	124.5	-178.2	-55.2	177.2	0	0	0	109.6	R35 D36 S37 L38 L108 D109 N110 V157 F159	R35-L82 HydrophobicContact CB-CD1 4.45Å; R35-L82 HydrophobicContact CB-CG 4.32Å; D36-L82 PolarHBondContact O-N 3.1Å; S37-L82 WeakPolarHBondContact CA-O 3.37Å; L38-L82 PolarHBondContact N-O 2.88Å; L82-L108 HydrophobicContact CB-CB 4.37Å; L82-L108 HydrophobicContact CB-CD2 4.14Å; L82-D109 WeakPolarHBondContact CA-O 3.28Å; L82-N110 VanDerWaalsContact CD2-OD1 3.25Å; L82-N110 WeakPolarHBondContact CD2-OD1 3.22Å; L82-V157 HydrophobicContact CD1-CG2 3.4Å; L82-F159 HydrophobicContact CD1-CB 4.5Å; L82-F159 HydrophobicContact CD1-CD2 4.11Å; L82-F159 HydrophobicContact CD2-CD2 4.49Å
83	L	94.4	Very high	89.2	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	142	-179	-54.3	-177.7	0	0	0	110.4	L38 F40 Y71 K74 E107 D109 P111 R115	L38-L83 HydrophobicContact CB-CD2 3.93Å; L38-L83 HydrophobicContact CD2-CD2 4.25Å; L38-L83 HydrophobicContact CG-CD2 4.48Å; L38-L83 WeakPolarHBondContact O-CA 3.45Å; F40-L83 HydrophobicContact CE2-CB 4.43Å; F40-L83 HydrophobicContact CE2-CD1 4.45Å; F40-L83 HydrophobicContact CE2-CD2 4.14Å; Y71-L83 HydrophobicContact CD1-CD1 3.97Å; Y71-L83 HydrophobicContact CD2-CD1 3.54Å; Y71-L83 HydrophobicContact CE1-CB 4.16Å; Y71-L83 HydrophobicContact CE1-CD1 4.05Å; Y71-L83 HydrophobicContact CE2-CB 3.82Å; Y71-L83 HydrophobicContact CE2-CD1 3.62Å; Y71-L83 HydrophobicContact CE2-CG 4.36Å; Y71-L83 HydrophobicContact CG-CD1 3.72Å; K74-L83 HydrophobicContact CB-CD1 4.36Å; K74-L83 HydrophobicContact CG-CD1 4.12Å; K74-L83 HydrophobicContact CG-CD2 4.46Å; L83-E107 VanDerWaalsContact O-O 3.11Å; L83-D109 PolarHBondContact N-O 3.17Å; L83-D109 PolarHBondContact O-N 3.29Å; L83-P111 HydrophobicContact CD1-CB 4.04Å; L83-P111 HydrophobicContact CD1-CG 4.46Å; L83-R115 PolarHBondContact O-NH1 2.92Å
84	A	96.7	Very high	89.6	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	154	173.2	0	0	0	0	0	111	L38 I39 F40 Q106 L108 L153	L38-A84 PolarHBondContact O-N 2.94Å; I39-A84 HydrophobicContact CB-CB 4.46Å; I39-A84 HydrophobicContact CG1-CB 4.1Å; I39-A84 HydrophobicContact CG2-CB 4.3Å; F40-A84 WeakPolarHBondContact CD2-O 3.46Å; F40-A84 PolarHBondContact N-O 2.78Å; A84-Q106 VanDerWaalsContact CA-O 3.32Å; A84-Q106 WeakPolarHBondContact CA-O 3.34Å; A84-Q106 VanDerWaalsContact CB-O 3.3Å; A84-Q106 WeakPolarHBondContact CB-O 3.47Å; A84-L108 HydrophobicContact CB-CB 4.47Å; A84-L108 HydrophobicContact CB-CD2 3.66Å; A84-L108 HydrophobicContact CB-CG 3.78Å; A84-L153 HydrophobicContact CB-CD1 4.47Å
85	V	98	Very high	89.8	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	120.1	178.2	-177.9	0	0	0	0	109.2	F40 I67 Y71 F87 L105 Q106 L119	F40-V85 HydrophobicContact CB-CG2 4.48Å; F40-V85 HydrophobicContact CD2-CG2 4.3Å; I67-V85 HydrophobicContact CG2-CG2 4.05Å; Y71-V85 HydrophobicContact CE2-CG2 4.1Å; Y71-V85 WeakPolarHBondContact OH-CG2 3.23Å; V85-F87 HydrophobicContact CG1-CD2 4.48Å; V85-F87 HydrophobicContact CG1-CE2 3.69Å; V85-F87 HydrophobicContact CG1-CZ 3.71Å; V85-L105 HydrophobicContact CB-CB 4.49Å; V85-L105 HydrophobicContact CG1-CB 4.48Å; V85-L105 HydrophobicContact CG1-CD2 4.27Å; V85-L105 PolarHBondContact O-N 3.37Å; V85-Q106 HydrophobicContact CB-CB 4.33Å; V85-Q106 PolarHBondContact N-O 3.22Å; V85-Q106 PolarHBondContact O-N 2.81Å; V85-L119 HydrophobicContact CG1-CD2 4.17Å; V85-L119 HydrophobicContact CG2-CD1 4.45Å; V85-L119 HydrophobicContact CG2-CD2 4.14Å
86	V	98.1	Very high	89.9	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	134	-178.3	-175.6	0	0	0	0	109	I39 F40 L41 V42 I102 V104 L153	I39-V86 HydrophobicContact CG2-CB 4.46Å; I39-V86 HydrophobicContact CG2-CG2 3.82Å; F40-V86 PolarHBondContact O-N 2.66Å; L41-V86 CarbonylContact C-O 3.54Å; L41-V86 WeakPolarHBondContact CA-O 3.24Å; L41-V86 HydrophobicContact CD1-CB 3.92Å; L41-V86 HydrophobicContact CD1-CG1 3.8Å; V42-V86 PolarHBondContact N-O 3.5Å; V86-I102 HydrophobicContact CG1-CG2 4.04Å; V86-V104 HydrophobicContact CG1-CG2 4.37Å; V86-V104 HydrophobicContact CG2-CG1 4.43Å; V86-V104 HydrophobicContact CG2-CG2 4.26Å; V86-L153 HydrophobicContact CG2-CD1 3.61Å
87	F	97.9	Very high	90.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	147.7	172.4	-59.9	-81	0	0	0	110.4	V42 F60 I64 V85 T90 Y103 L105 F131 M135	V42-F87 HydrophobicContact CB-CD1 3.67Å; V42-F87 HydrophobicContact CB-CE1 3.74Å; V42-F87 HydrophobicContact CG1-CD1 4.05Å; V42-F87 HydrophobicContact CG1-CE1 3.97Å; V42-F87 HydrophobicContact CG2-CE1 4.19Å; V42-F87 WeakPolarHBondContact O-CA 3.38Å; F60-F87 HydrophobicContact CE2-CD1 4.19Å; F60-F87 AromaticContact CE2-CE1 3.89Å; F60-F87 HydrophobicContact CE2-CE1 3.89Å; F60-F87 HydrophobicContact CZ-CE1 4.14Å; I64-F87 HydrophobicContact CD1-CE1 3.92Å; I64-F87 HydrophobicContact CD1-CZ 3.87Å; V85-F87 HydrophobicContact CG1-CD2 4.48Å; V85-F87 HydrophobicContact CG1-CE2 3.69Å; V85-F87 HydrophobicContact CG1-CZ 3.71Å; F87-T90 HydrophobicContact CB-CG2 3.91Å; F87-Y103 PolarHBondContact N-O 2.84Å; F87-Y103 PolarHBondContact O-N 3.19Å; F87-L105 HydrophobicContact CD2-CB 4.14Å; F87-L105 HydrophobicContact CE2-CB 3.8Å; F87-L105 HydrophobicContact CE2-CD2 3.82Å; F87-L105 HydrophobicContact CE2-CG 4.34Å; F87-L105 HydrophobicContact CZ-CD2 4.46Å; F87-F131 HydrophobicContact CB-CZ 4.23Å; F87-F131 AromaticContact CD1-CE2 3.71Å; F87-F131 HydrophobicContact CD1-CE2 3.71Å; F87-F131 AromaticContact CD1-CZ 3.78Å; F87-F131 HydrophobicContact CD1-CZ 3.78Å; F87-F131 AromaticContact CD2-CE2 3.91Å; F87-F131 HydrophobicContact CD2-CE2 3.91Å; F87-F131 HydrophobicContact CD2-CZ 4.42Å; F87-F131 AromaticContact CE1-CE2 3.78Å; F87-F131 HydrophobicContact CE1-CE2 3.78Å; F87-F131 HydrophobicContact CE1-CZ 4.26Å; F87-F131 AromaticContact CE2-CE2 3.97Å; F87-F131 HydrophobicContact CE2-CE2 3.97Å; F87-F131 AromaticContact CG-CE2 3.79Å; F87-F131 HydrophobicContact CG-CE2 3.79Å; F87-F131 AromaticContact CG-CZ 3.88Å; F87-F131 HydrophobicContact CG-CZ 3.88Å; F87-F131 AromaticContact CZ-CE2 3.91Å; F87-F131 HydrophobicContact CZ-CE2 3.91Å; F87-M135 HydrophobicContact CD2-CE 4.44Å; F87-M135 HydrophobicContact CD2-SD 4.08Å; F87-M135 HydrophobicContact CE2-CE 4.42Å
88	Y	97.4	Very high	90.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	155	172.1	72.1	-88.4	0	0	0	111.5	L41 V42 D43 A44 T90 N101 Y141 L143 V146 L168 T170	L41-Y88 HydrophobicContact CD1-CD1 3.67Å; L41-Y88 HydrophobicContact CD1-CE1 4.34Å; L41-Y88 HydrophobicContact CG-CD1 3.9Å; L41-Y88 HydrophobicContact CG-CE1 4.06Å; V42-Y88 WeakPolarHBondContact O-CD1 3.45Å; V42-Y88 PolarHBondContact O-N 2.9Å; V42-Y88 VanDerWaalsContact O-N 3.16Å; D43-Y88 VanDerWaalsContact CA-CE1 3.48Å; D43-Y88 HydrophobicContact CB-CE1 3.81Å; D43-Y88 HydrophobicContact CB-CE2 4.09Å; D43-Y88 VanDerWaalsContact CB-CZ 3.45Å; D43-Y88 WeakPolarHBondContact CB-OH 3.35Å; D43-Y88 VanDerWaalsContact CG-CZ 3.43Å; D43-Y88 PolarHBondContact OD2-OH 2.83Å; A44-Y88 WeakPolarHBondContact CA-O 3.5Å; A44-Y88 VanDerWaalsContact CB-O 3.28Å; A44-Y88 WeakPolarHBondContact CB-O 3.35Å; A44-Y88 PolarHBondContact N-O 2.78Å; Y88-T90 VanDerWaalsContact C-N 3.32Å; Y88-N101 CarbonylContact C-O 3.52Å; Y88-N101 WeakPolarHBondContact CA-O 3.33Å; Y88-Y141 HydrophobicContact CD2-CD1 4.11Å; Y88-Y141 AromaticContact CD2-CD2 3.8Å; Y88-Y141 HydrophobicContact CD2-CD2 3.8Å; Y88-Y141 HydrophobicContact CD2-CE1 4.19Å; Y88-Y141 AromaticContact CD2-CE2 3.89Å; Y88-Y141 HydrophobicContact CD2-CE2 3.89Å; Y88-Y141 AromaticContact CD2-CG 3.92Å; Y88-Y141 HydrophobicContact CD2-CG 3.92Å; Y88-Y141 HydrophobicContact CE2-CD1 4.44Å; Y88-Y141 HydrophobicContact CE2-CD2 4.03Å; Y88-Y141 HydrophobicContact CE2-CE1 4.07Å; Y88-Y141 AromaticContact CE2-CE2 3.61Å; Y88-Y141 HydrophobicContact CE2-CE2 3.61Å; Y88-Y141 HydrophobicContact CE2-CG 4.43Å; Y88-Y141 AromaticContact CE2-CZ 3.63Å; Y88-L143 HydrophobicContact CE2-CD2 4.36Å; Y88-V146 HydrophobicContact CD1-CG1 4.24Å; Y88-V146 HydrophobicContact CD2-CG2 4.44Å; Y88-V146 HydrophobicContact CG-CG1 4.23Å; Y88-V146 HydrophobicContact CG-CG2 4.11Å; Y88-L168 HydrophobicContact CE1-CD1 3.53Å; Y88-T170 WeakPolarHBondContact OH-CB 3.32Å
89	G	94.9	Very high	92.1	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.238	C	C	.	.	S	Bend	trans	80.7	15.3	-172.8	0	0	0	0	0	113.3	N101 H137 G138 S139	G89-N101 PolarHBondContact N-O 3.09Å; G89-H137 CarbonylContact O-C 3.54Å; G89-G138 PolarHBondContact O-N 2.66Å; G89-G138 VanDerWaalsContact O-N 3.12Å; G89-S139 PolarHBondContact O-N 2.77Å
90	T	95.4	Very high	93.5	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.246	C	C	.	.			trans	-79.9	158.2	173.2	53.1	0	0	0	0	110.8	A44 F87 Y88 K92 N101 F131 M135 S139	A44-T90 HydrophobicContact CB-CG2 3.84Å; F87-T90 HydrophobicContact CB-CG2 3.91Å; Y88-T90 VanDerWaalsContact C-N 3.32Å; T90-K92 WeakPolarHBondContact CB-O 3.31Å; T90-K92 PolarHBondContact OG1-O 2.93Å; T90-N101 WeakPolarHBondContact O-CA 3.23Å; T90-N101 VanDerWaalsContact O-CB 3.23Å; T90-N101 WeakPolarHBondContact O-CB 3.47Å; T90-N101 PolarHBondContact O-ND2 3.36Å; T90-F131 HydrophobicContact CG2-CE1 4.34Å; T90-F131 HydrophobicContact CG2-CZ 3.92Å; T90-M135 HydrophobicContact CG2-CB 3.98Å; T90-S139 WeakPolarHBondContact O-CB 3.45Å; T90-S139 PolarHBondContact O-OG 3.22Å
91	E	94.1	Very high	94.1	Very high	139 Å²	139	45.5 Å²	45.5	65%	0.65	23%	0.227	S	C	*	.	S	Bend	trans	-77.5	-39	175.8	-170.6	178.7	177.4	0	0	111.2	M135 S139	E91-M135 PolarHBondContact N-O 2.97Å; E91-S139 WeakPolarHBondContact CA-OG 3.36Å
92	K	93.9	Very high	94.6	Very high	111 Å²	111	44.6 Å²	44.6	48%	0.483	22%	0.222	S	C	.	.	S	Bend	trans	-87	149.2	172.6	-63.2	-171.4	-168.4	158.9	0	111.4	T90 Y103 L134 M135	T90-K92 WeakPolarHBondContact CB-O 3.31Å; T90-K92 PolarHBondContact OG1-O 2.93Å; K92-Y103 HydrophobicContact CB-CD2 4.3Å; K92-Y103 HydrophobicContact CB-CE2 4.44Å; K92-L134 VanDerWaalsContact CD-O 3.26Å; K92-L134 WeakPolarHBondContact CD-O 3.42Å; K92-L134 VanDerWaalsContact CE-O 3.3Å; K92-L134 WeakPolarHBondContact CE-O 3.42Å; K92-L134 PolarHBondContact NZ-O 2.84Å; K92-M135 PolarHBondContact N-O 3.25Å
93	D	93.6	Very high	94.9	Very high	67 Å²	67	46.5 Å²	46.5	36%	0.358	23%	0.23	S	C	.	.			trans	-117.1	148.8	173	53.6	-83	0	0	0	112.2	F99 I102	D93-F99 VanDerWaalsContact CB-O 3.26Å; D93-F99 WeakPolarHBondContact CB-O 3.13Å; D93-I102 WeakPolarHBondContact CA-O 3.31Å
94	K	94.7	Very high	95	Very high	98 Å²	98	46.8 Å²	46.8	43%	0.426	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-153.9	97.2	173.5	-176.6	-174.5	171.9	-156.7	0	108.4	I102 Y103 V104	K94-I102 PolarHBondContact N-O 2.87Å; K94-Y103 HydrophobicContact CB-CD1 4.38Å; K94-Y103 HydrophobicContact CB-CD2 3.65Å; K94-Y103 HydrophobicContact CB-CE1 4.37Å; K94-Y103 HydrophobicContact CB-CE2 3.62Å; K94-Y103 HydrophobicContact CB-CG 4.04Å; K94-Y103 HydrophobicContact CD-CE1 4.04Å; K94-Y103 HydrophobicContact CD-CE2 4.26Å; K94-V104 WeakPolarHBondContact O-CB 3.25Å; K94-V104 WeakPolarHBondContact O-CG2 3.36Å; K94-V104 PolarHBondContact O-N 3.1Å
95	N	92.9	Very high	95	Very high	19 Å²	19	47.5 Å²	47.5	10%	0.102	24%	0.236	C	C	.	.	S	Bend	trans	-157.6	166.1	176.7	58.4	80.6	0	0	0	110.4	V97 N98 F99 I102 V104 V149	N95-V97 PolarHBondContact O-N 3.21Å; N95-V97 VanDerWaalsContact O-N 3.16Å; N95-V97 PolarHBondContact OD1-N 3.45Å; N95-N98 PolarHBondContact O-N 3.46Å; N95-N98 WeakPolarHBondContact OD1-CA 3.43Å; N95-N98 PolarHBondContact OD1-N 2.8Å; N95-F99 PolarHBondContact ND2-O 2.84Å; N95-F99 PolarHBondContact OD1-N 3.05Å; N95-I102 PolarHBondContact ND2-O 2.97Å; N95-V104 HydrophobicContact CB-CG2 4.15Å; N95-V149 HydrophobicContact CB-CG1 3.87Å; N95-V149 HydrophobicContact CB-CG2 4.1Å
96	S	89.5	Confident	94.9	Very high	78 Å²	78	47.8 Å²	47.8	55%	0.545	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-24	-171.9	52.8	0	0	0	0	114.9	N152	S96-N152 PolarHBondContact OG-ND2 2.83Å
97	V	91.3	Very high	94.8	Very high	61 Å²	61	53.7 Å²	53.7	37%	0.37	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	8.2	-174.6	-66.7	0	0	0	0	113.7	N95 F99 W148	N95-V97 PolarHBondContact O-N 3.21Å; N95-V97 VanDerWaalsContact O-N 3.16Å; N95-V97 PolarHBondContact OD1-N 3.45Å; V97-F99 HydrophobicContact CG2-CB 4.44Å; V97-F99 HydrophobicContact CG2-CD2 3.27Å; V97-F99 HydrophobicContact CG2-CE2 3.51Å; V97-F99 HydrophobicContact CG2-CG 3.82Å; V97-F99 HydrophobicContact CG2-CZ 4.21Å; V97-F99 PolarHBondContact O-N 3.38Å; V97-W148 HydrophobicContact CB-CH2 4.44Å; V97-W148 HydrophobicContact CB-CZ3 4.11Å; V97-W148 HydrophobicContact CG1-CH2 3.43Å; V97-W148 VanDerWaalsContact CG1-CH2 3.43Å; V97-W148 HydrophobicContact CG1-CZ3 3.5Å; V97-W148 HydrophobicContact CG2-CE3 3.94Å; V97-W148 HydrophobicContact CG2-CH2 4.22Å; V97-W148 HydrophobicContact CG2-CZ3 3.44Å; V97-W148 VanDerWaalsContact CG2-CZ3 3.44Å
98	N	92.7	Very high	94.6	Very high	122 Å²	122	54.7 Å²	54.7	65%	0.652	27%	0.27	S	S	*	.			trans	51.7	38.4	-177.2	-55.4	-35.8	0	0	0	113.6	N95	N95-N98 PolarHBondContact O-N 3.46Å; N95-N98 WeakPolarHBondContact OD1-CA 3.43Å; N95-N98 PolarHBondContact OD1-N 2.8Å
99	F	93.1	Very high	94.5	Very high	62 Å²	62	58.4 Å²	58.4	27%	0.272	29%	0.289	S	S	.	.			trans	-64.6	138.9	166.5	-77.6	-43.6	0	0	0	109.8	D93 N95 V97 I102 E145 W148 V149	D93-F99 VanDerWaalsContact CB-O 3.26Å; D93-F99 WeakPolarHBondContact CB-O 3.13Å; N95-F99 PolarHBondContact ND2-O 2.84Å; N95-F99 PolarHBondContact OD1-N 3.05Å; V97-F99 HydrophobicContact CG2-CB 4.44Å; V97-F99 HydrophobicContact CG2-CD2 3.27Å; V97-F99 HydrophobicContact CG2-CE2 3.51Å; V97-F99 HydrophobicContact CG2-CG 3.82Å; V97-F99 HydrophobicContact CG2-CZ 4.21Å; V97-F99 PolarHBondContact O-N 3.38Å; F99-I102 HydrophobicContact CB-CD1 3.85Å; F99-E145 HydrophobicContact CB-CB 4.4Å; F99-E145 HydrophobicContact CD1-CB 4.31Å; F99-E145 HydrophobicContact CD1-CG 4Å; F99-E145 HydrophobicContact CD2-CB 3.97Å; F99-E145 HydrophobicContact CD2-CG 4.38Å; F99-E145 HydrophobicContact CE1-CG 4.03Å; F99-E145 HydrophobicContact CE2-CB 4.28Å; F99-E145 HydrophobicContact CE2-CG 4.38Å; F99-E145 HydrophobicContact CG-CB 4Å; F99-E145 HydrophobicContact CG-CG 4.22Å; F99-E145 HydrophobicContact CZ-CG 4.23Å; F99-W148 HydrophobicContact CD2-CE3 4.22Å; F99-W148 HydrophobicContact CE2-CB 4.34Å; F99-W148 AromaticContact CE2-CD2 3.93Å; F99-W148 HydrophobicContact CE2-CD2 3.93Å; F99-W148 AromaticContact CE2-CE3 3.64Å; F99-W148 HydrophobicContact CE2-CE3 3.64Å; F99-W148 HydrophobicContact CE2-CG 4.24Å; F99-W148 HydrophobicContact CE2-CZ3 4.32Å; F99-V149 HydrophobicContact CD2-CG2 3.83Å
100	K	94.3	Very high	94.3	Very high	148 Å²	148	60.8 Å²	60.8	64%	0.643	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	151	-174.3	-60.9	-174.5	176.3	-176.5	0	111	I102	K100-I102 PolarHBondContact O-N 3.09Å; K100-I102 VanDerWaalsContact O-N 3.16Å
101	N	95.1	Very high	94.1	Very high	31 Å²	31	61.3 Å²	61.3	17%	0.166	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	22.5	169.4	-46.6	102.2	0	0	0	115.3	Y88 G89 T90 S139 D140	Y88-N101 CarbonylContact C-O 3.52Å; Y88-N101 WeakPolarHBondContact CA-O 3.33Å; G89-N101 PolarHBondContact N-O 3.09Å; T90-N101 WeakPolarHBondContact O-CA 3.23Å; T90-N101 VanDerWaalsContact O-CB 3.23Å; T90-N101 WeakPolarHBondContact O-CB 3.47Å; T90-N101 PolarHBondContact O-ND2 3.36Å; N101-S139 WeakPolarHBondContact ND2-CB 3.35Å; N101-D140 VanDerWaalsContact CB-O 3.23Å; N101-D140 WeakPolarHBondContact CB-O 3.41Å; N101-D140 PolarHBondContact OD1-O 3.46Å
102	I	97.2	Very high	93.9	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.005	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	120.4	177.7	-59.3	163.3	0	0	0	109	V86 D93 K94 N95 F99 K100 E145 V146 V149	V86-I102 HydrophobicContact CG1-CG2 4.04Å; D93-I102 WeakPolarHBondContact CA-O 3.31Å; K94-I102 PolarHBondContact N-O 2.87Å; N95-I102 PolarHBondContact ND2-O 2.97Å; F99-I102 HydrophobicContact CB-CD1 3.85Å; K100-I102 PolarHBondContact O-N 3.09Å; K100-I102 VanDerWaalsContact O-N 3.16Å; I102-E145 HydrophobicContact CD1-CB 3.94Å; I102-V146 HydrophobicContact CD1-CB 4.33Å; I102-V146 HydrophobicContact CD1-CG2 3.87Å; I102-V146 HydrophobicContact CG1-CG2 3.85Å; I102-V149 HydrophobicContact CD1-CG2 4.01Å; I102-V149 HydrophobicContact CG2-CB 4.19Å; I102-V149 HydrophobicContact CG2-CG1 4.07Å; I102-V149 HydrophobicContact CG2-CG2 4.11Å
103	Y	97.5	Very high	93.6	Very high	39 Å²	39	51.5 Å²	51.5	15%	0.153	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	109.9	-176.4	-160.4	-80.4	0	0	0	111.1	F87 K92 K94 L105 M135	F87-Y103 PolarHBondContact N-O 2.84Å; F87-Y103 PolarHBondContact O-N 3.19Å; K92-Y103 HydrophobicContact CB-CD2 4.3Å; K92-Y103 HydrophobicContact CB-CE2 4.44Å; K94-Y103 HydrophobicContact CB-CD1 4.38Å; K94-Y103 HydrophobicContact CB-CD2 3.65Å; K94-Y103 HydrophobicContact CB-CE1 4.37Å; K94-Y103 HydrophobicContact CB-CE2 3.62Å; K94-Y103 HydrophobicContact CB-CG 4.04Å; K94-Y103 HydrophobicContact CD-CE1 4.04Å; K94-Y103 HydrophobicContact CD-CE2 4.26Å; Y103-L105 HydrophobicContact CD1-CB 4.48Å; Y103-L105 HydrophobicContact CE1-CD1 4.33Å; Y103-L105 PolarHBondContact O-N 3.47Å; Y103-M135 HydrophobicContact CD1-CE 4.03Å; Y103-M135 HydrophobicContact CD1-CG 4.46Å; Y103-M135 HydrophobicContact CD1-SD 3.64Å; Y103-M135 HydrophobicContact CD2-CG 4.4Å; Y103-M135 HydrophobicContact CD2-SD 4.47Å; Y103-M135 HydrophobicContact CE1-CE 3.9Å; Y103-M135 HydrophobicContact CE1-SD 4.02Å; Y103-M135 HydrophobicContact CE2-CG 4.46Å; Y103-M135 HydrophobicContact CG-CG 4.39Å; Y103-M135 HydrophobicContact CG-SD 3.89Å
104	V	97.3	Very high	93.5	Very high	7 Å²	7	56.3 Å²	56.3	4%	0.042	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	101.5	171	-176.9	0	0	0	0	108.1	V86 K94 N95 E107 V149 L153	V86-V104 HydrophobicContact CG1-CG2 4.37Å; V86-V104 HydrophobicContact CG2-CG1 4.43Å; V86-V104 HydrophobicContact CG2-CG2 4.26Å; K94-V104 WeakPolarHBondContact O-CB 3.25Å; K94-V104 WeakPolarHBondContact O-CG2 3.36Å; K94-V104 PolarHBondContact O-N 3.1Å; N95-V104 HydrophobicContact CB-CG2 4.15Å; V104-E107 HydrophobicContact CG1-CG 4.01Å; V104-V149 HydrophobicContact CG2-CG1 3.73Å; V104-L153 HydrophobicContact CG1-CD1 4.21Å; V104-L153 HydrophobicContact CG1-CD2 4.17Å; V104-L153 HydrophobicContact CG2-CD1 4.43Å
105	L	96.4	Very high	93.5	Very high	15 Å²	15	53.7 Å²	53.7	8%	0.079	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	-54.9	176.2	-179.9	72.9	0	0	0	109.6	V85 F87 Y103 E118 L119 F122 M135	V85-L105 HydrophobicContact CB-CB 4.49Å; V85-L105 HydrophobicContact CG1-CB 4.48Å; V85-L105 HydrophobicContact CG1-CD2 4.27Å; V85-L105 PolarHBondContact O-N 3.37Å; F87-L105 HydrophobicContact CD2-CB 4.14Å; F87-L105 HydrophobicContact CE2-CB 3.8Å; F87-L105 HydrophobicContact CE2-CD2 3.82Å; F87-L105 HydrophobicContact CE2-CG 4.34Å; F87-L105 HydrophobicContact CZ-CD2 4.46Å; Y103-L105 HydrophobicContact CD1-CB 4.48Å; Y103-L105 HydrophobicContact CE1-CD1 4.33Å; Y103-L105 PolarHBondContact O-N 3.47Å; L105-E118 HydrophobicContact CD1-CG 4.26Å; L105-E118 WeakPolarHBondContact CD1-OE1 3.5Å; L105-E118 HydrophobicContact CD2-CG 4.33Å; L105-L119 HydrophobicContact CD2-CD2 3.99Å; L105-F122 HydrophobicContact CD1-CE2 4.14Å; L105-F122 HydrophobicContact CD1-CZ 4.34Å; L105-F122 HydrophobicContact CD2-CD2 4.44Å; L105-F122 HydrophobicContact CD2-CE2 3.72Å; L105-M135 HydrophobicContact CD1-CE 3.8Å
106	Q	95.9	Very high	93.4	Very high	6 Å²	6	53 Å²	53	3%	0.028	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	123.8	-178.3	-63.7	178	6.3	0	0	109.8	Y71 A84 V85 R115 E118	Y71-Q106 VanDerWaalsContact CZ-OE1 3.31Å; Y71-Q106 PolarHBondContact OH-OE1 3.09Å; A84-Q106 VanDerWaalsContact CA-O 3.32Å; A84-Q106 WeakPolarHBondContact CA-O 3.34Å; A84-Q106 VanDerWaalsContact CB-O 3.3Å; A84-Q106 WeakPolarHBondContact CB-O 3.47Å; V85-Q106 HydrophobicContact CB-CB 4.33Å; V85-Q106 PolarHBondContact N-O 3.22Å; V85-Q106 PolarHBondContact O-N 2.81Å; Q106-R115 HydrophobicContact CG-CG 4.49Å; Q106-R115 PolarHBondContact NE2-O 3.12Å; Q106-E118 WeakPolarHBondContact CG-OE2 3.49Å; Q106-E118 PolarHBondContact NE2-OE2 3.24Å
107	E	95.5	Very high	93.5	Very high	123 Å²	123	52.7 Å²	52.7	58%	0.575	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.1	166.7	170.3	-66.7	174.9	-161.1	0	0	111.2	L83 V104 D109 R115 L153	L83-E107 VanDerWaalsContact O-O 3.11Å; V104-E107 HydrophobicContact CG1-CG 4.01Å; E107-D109 PolarHBondContact O-N 2.97Å; E107-R115 VanDerWaalsContact O-CZ 3.31Å; E107-R115 PolarHBondContact O-NH1 3.11Å; E107-R115 PolarHBondContact O-NH2 3.11Å; E107-L153 HydrophobicContact CG-CD2 4.25Å
108	L	94.1	Very high	93.7	Very high	22 Å²	22	53.4 Å²	53.4	12%	0.115	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	109.4	179	-80.4	173.1	0	0	0	110.9	I39 L82 A84 L153 F154	I39-L108 HydrophobicContact CD1-CD1 4.45Å; I39-L108 HydrophobicContact CG1-CD1 4.43Å; I39-L108 HydrophobicContact CG1-CD2 4.07Å; I39-L108 HydrophobicContact CG1-CG 4.36Å; L82-L108 HydrophobicContact CB-CB 4.37Å; L82-L108 HydrophobicContact CB-CD2 4.14Å; A84-L108 HydrophobicContact CB-CB 4.47Å; A84-L108 HydrophobicContact CB-CD2 3.66Å; A84-L108 HydrophobicContact CB-CG 3.78Å; L108-L153 HydrophobicContact CD1-CB 4.28Å; L108-F154 HydrophobicContact CD1-CD1 3.56Å; L108-F154 HydrophobicContact CD1-CE1 3.94Å; L108-F154 HydrophobicContact CD1-CG 4.27Å
109	D	94.4	Very high	93.7	Very high	77 Å²	77	47.6 Å²	47.6	41%	0.412	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	171.4	176	-161.3	4.6	0	0	0	109.3	L82 L83 E107 R115	L82-D109 WeakPolarHBondContact CA-O 3.28Å; L83-D109 PolarHBondContact N-O 3.17Å; L83-D109 PolarHBondContact O-N 3.29Å; E107-D109 PolarHBondContact O-N 2.97Å; D109-R115 VanDerWaalsContact CB-CZ 3.42Å; D109-R115 IonicContact OD2-NH2 2.68Å
110	N	91.8	Very high	93.6	Very high	51 Å²	51	47.7 Å²	47.7	27%	0.273	24%	0.236	S	C	.	.			trans	-60.5	147.3	176.3	-63.2	-21.4	0	0	0	111	R35 L82	R35-N110 PolarHBondContact NH1-OD1 3.03Å; L82-N110 VanDerWaalsContact CD2-OD1 3.25Å; L82-N110 WeakPolarHBondContact CD2-OD1 3.22Å
111	P	91.6	Very high	93.6	Very high	10 Å²	10	44 Å²	44	7%	0.065	22%	0.222	C	C	.	.			trans	-63.2	149.5	173	29	-35.4	0	0	0	110.8	Y71 K74 I75 D81 L83	Y71-P111 HydrophobicContact CD1-CB 3.83Å; Y71-P111 HydrophobicContact CE1-CB 4.37Å; Y71-P111 HydrophobicContact CG-CB 4.5Å; K74-P111 HydrophobicContact CB-CG 4.08Å; I75-P111 HydrophobicContact CD1-CB 4.26Å; I75-P111 HydrophobicContact CG1-CB 3.81Å; I75-P111 HydrophobicContact CG1-CG 3.86Å; D81-P111 WeakPolarHBondContact O-CD 3.42Å; L83-P111 HydrophobicContact CD1-CB 4.04Å; L83-P111 HydrophobicContact CD1-CG 4.46Å
112	G	89.2	Confident	93.5	Very high	25 Å²	25	43 Å²	43	26%	0.258	22%	0.216	S	C	.	.			trans	-159.8	162.6	179.4	0	0	0	0	0	112.6	K114 R115 I116	G112-K114 VanDerWaalsContact C-N 3.32Å; G112-K114 PolarHBondContact O-N 3.37Å; G112-R115 WeakPolarHBondContact O-CB 3.44Å; G112-R115 PolarHBondContact O-N 3.31Å; G112-I116 PolarHBondContact O-N 3.12Å
113	A	88.6	Confident	93.3	Very high	19 Å²	19	46.9 Å²	46.9	16%	0.157	23%	0.232	C	C	.	.	H	α-helix	trans	-58.6	-41.5	-173.1	0	0	0	0	0	112.7	R115 I116 L117 A494 L495	A113-R115 VanDerWaalsContact C-N 3.34Å; A113-R115 PolarHBondContact O-N 3.06Å; A113-I116 PolarHBondContact O-N 3.03Å; A113-L117 WeakPolarHBondContact O-CB 3.41Å; A113-L117 PolarHBondContact O-N 3.01Å; A113-A494 HydrophobicContact CB-CB 3.68Å; A113-L495 HydrophobicContact CB-CD1 4.43Å; A113-L495 HydrophobicContact CB-CD2 3.77Å; A113-L495 HydrophobicContact CB-CG 3.83Å
114	K	91.1	Very high	93	Very high	168 Å²	168	46 Å²	46	73%	0.73	24%	0.236	S	C	*	.	H	α-helix	trans	-62.9	-38.1	176.7	-67.7	-178.5	-179.9	177.2	0	112.9	G112 L117 E118 L495	G112-K114 VanDerWaalsContact C-N 3.32Å; G112-K114 PolarHBondContact O-N 3.37Å; K114-L117 PolarHBondContact O-N 2.93Å; K114-E118 WeakPolarHBondContact O-CB 3.35Å; K114-E118 PolarHBondContact O-N 3.49Å; K114-L495 HydrophobicContact CG-CD2 4.27Å
115	R	94.3	Very high	92.5	Very high	43 Å²	43	53.3 Å²	53.3	16%	0.162	27%	0.269	C	S	.	.	H	α-helix	trans	-68	-37.3	177.7	-73.9	-175	168	-137.9	-9.5	111.6	Y71 L83 Q106 E107 D109 G112 A113 L119	Y71-R115 HydrophobicContact CD1-CB 4.41Å; Y71-R115 HydrophobicContact CE1-CB 3.96Å; L83-R115 PolarHBondContact O-NH1 2.92Å; Q106-R115 HydrophobicContact CG-CG 4.49Å; Q106-R115 PolarHBondContact NE2-O 3.12Å; E107-R115 VanDerWaalsContact O-CZ 3.31Å; E107-R115 PolarHBondContact O-NH1 3.11Å; E107-R115 PolarHBondContact O-NH2 3.11Å; D109-R115 VanDerWaalsContact CB-CZ 3.42Å; D109-R115 IonicContact OD2-NH2 2.68Å; G112-R115 WeakPolarHBondContact O-CB 3.44Å; G112-R115 PolarHBondContact O-N 3.31Å; A113-R115 VanDerWaalsContact C-N 3.34Å; A113-R115 PolarHBondContact O-N 3.06Å; R115-L119 WeakPolarHBondContact O-CG 3.24Å; R115-L119 PolarHBondContact O-N 2.81Å
116	I	91.4	Very high	92.2	Very high	5 Å²	5	59.7 Å²	59.7	3%	0.026	30%	0.299	C	S	.	.	H	α-helix	trans	-66.3	-44.9	173.7	-68.6	171.2	0	0	0	110.4	Q68 Y71 I72 I75 G112 A113 E118 L119 D120	Q68-I116 HydrophobicContact CG-CG2 4.08Å; Y71-I116 HydrophobicContact CD1-CG1 4.16Å; Y71-I116 HydrophobicContact CG-CG1 4.42Å; I72-I116 HydrophobicContact CG1-CD1 3.87Å; I75-I116 HydrophobicContact CD1-CD1 3.36Å; G112-I116 PolarHBondContact O-N 3.12Å; A113-I116 PolarHBondContact O-N 3.03Å; I116-E118 VanDerWaalsContact C-N 3.31Å; I116-E118 PolarHBondContact O-N 2.64Å; I116-L119 PolarHBondContact O-N 2.88Å; I116-D120 PolarHBondContact O-N 3.47Å
117	L	91.5	Very high	91.9	Very high	72 Å²	72	59.5 Å²	59.5	38%	0.377	30%	0.298	S	S	.	.	H	α-helix	trans	-63	-36.7	178.2	-177.9	64.4	0	0	0	112.3	A113 K114 D120 Q121 L495	A113-L117 WeakPolarHBondContact O-CB 3.41Å; A113-L117 PolarHBondContact O-N 3.01Å; K114-L117 PolarHBondContact O-N 2.93Å; L117-D120 PolarHBondContact O-N 3.36Å; L117-Q121 WeakPolarHBondContact O-CG 3.06Å; L117-Q121 PolarHBondContact O-N 2.89Å; L117-Q121 PolarHBondContact O-NE2 2.96Å; L117-L495 HydrophobicContact CB-CD1 4.27Å; L117-L495 HydrophobicContact CB-CD2 4.25Å; L117-L495 HydrophobicContact CD2-CD1 4.36Å; L117-L495 HydrophobicContact CD2-CD2 3.96Å
118	E	94.2	Very high	91.7	Very high	75 Å²	75	55.1 Å²	55.1	35%	0.35	28%	0.278	S	S	.	.	H	α-helix	trans	-63.8	-43.5	174.5	-174.7	179.1	-137.8	0	0	111.5	L105 Q106 K114 I116 D120 Q121	L105-E118 HydrophobicContact CD1-CG 4.26Å; L105-E118 WeakPolarHBondContact CD1-OE1 3.5Å; L105-E118 HydrophobicContact CD2-CG 4.33Å; Q106-E118 WeakPolarHBondContact CG-OE2 3.49Å; Q106-E118 PolarHBondContact NE2-OE2 3.24Å; K114-E118 WeakPolarHBondContact O-CB 3.35Å; K114-E118 PolarHBondContact O-N 3.49Å; I116-E118 VanDerWaalsContact C-N 3.31Å; I116-E118 PolarHBondContact O-N 2.64Å; E118-D120 VanDerWaalsContact C-N 3.33Å; E118-Q121 WeakPolarHBondContact O-CB 3.4Å; E118-Q121 PolarHBondContact O-N 3.02Å
119	L	93.4	Very high	91.6	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-66.1	-35.8	175	-69.5	169.3	0	0	0	112.4	I64 I67 Y71 V85 L105 R115 I116 Q121 F122	I64-L119 WeakPolarHBondContact CG2-O 3.47Å; I67-L119 HydrophobicContact CG2-CD1 3.86Å; Y71-L119 HydrophobicContact CD1-CD1 4.48Å; Y71-L119 HydrophobicContact CD2-CD1 4.06Å; Y71-L119 HydrophobicContact CE1-CD1 4.42Å; Y71-L119 HydrophobicContact CE2-CD1 4.01Å; Y71-L119 HydrophobicContact CG-CD1 4.3Å; V85-L119 HydrophobicContact CG1-CD2 4.17Å; V85-L119 HydrophobicContact CG2-CD1 4.45Å; V85-L119 HydrophobicContact CG2-CD2 4.14Å; L105-L119 HydrophobicContact CD2-CD2 3.99Å; R115-L119 WeakPolarHBondContact O-CG 3.24Å; R115-L119 PolarHBondContact O-N 2.81Å; I116-L119 PolarHBondContact O-N 2.88Å; L119-Q121 PolarHBondContact O-N 2.77Å; L119-F122 PolarHBondContact O-N 3.47Å
120	D	91.8	Very high	91.6	Very high	65 Å²	65	62.9 Å²	62.9	35%	0.348	30%	0.304	S	S	.	.	H	α-helix	trans	-62.5	-26.5	176.9	-159.7	65.6	0	0	0	112.3	Q68 I116 L117 E118 F122 K123	Q68-D120 PolarHBondContact NE2-OD1 2.88Å; I116-D120 PolarHBondContact O-N 3.47Å; L117-D120 PolarHBondContact O-N 3.36Å; E118-D120 VanDerWaalsContact C-N 3.33Å; D120-F122 PolarHBondContact O-N 2.7Å; D120-F122 VanDerWaalsContact O-N 3.13Å; D120-K123 WeakPolarHBondContact O-CB 3.46Å; D120-K123 PolarHBondContact O-N 2.94Å; D120-K123 VanDerWaalsContact O-N 3.17Å; D120-K123 WeakPolarHBondContact OD1-CD 3.45Å
121	Q	93.4	Very high	91.7	Very high	71 Å²	71	60.4 Å²	60.4	33%	0.332	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-20.7	174.5	-57.8	-53.2	-48	0	0	113.5	L117 E118 L119 G127	L117-Q121 WeakPolarHBondContact O-CG 3.06Å; L117-Q121 PolarHBondContact O-N 2.89Å; L117-Q121 PolarHBondContact O-NE2 2.96Å; E118-Q121 WeakPolarHBondContact O-CB 3.4Å; E118-Q121 PolarHBondContact O-N 3.02Å; L119-Q121 PolarHBondContact O-N 2.77Å; Q121-G127 WeakPolarHBondContact O-CA 3.37Å
122	F	93.8	Very high	91.7	Very high	9 Å²	9	62.6 Å²	62.6	4%	0.039	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	2.4	-178.5	-52	-50.4	0	0	0	113.5	F60 I64 L105 L119 D120 G127 F131 M135	F60-F122 HydrophobicContact CE1-CB 4.42Å; I64-F122 HydrophobicContact CD1-CB 4.42Å; I64-F122 HydrophobicContact CG1-CB 4.33Å; I64-F122 HydrophobicContact CG2-CB 4.31Å; L105-F122 HydrophobicContact CD1-CE2 4.14Å; L105-F122 HydrophobicContact CD1-CZ 4.34Å; L105-F122 HydrophobicContact CD2-CD2 4.44Å; L105-F122 HydrophobicContact CD2-CE2 3.72Å; L119-F122 PolarHBondContact O-N 3.47Å; D120-F122 PolarHBondContact O-N 2.7Å; D120-F122 VanDerWaalsContact O-N 3.13Å; F122-G127 CarbonylContact O-C 3.56Å; F122-F131 HydrophobicContact CD1-CB 3.74Å; F122-F131 AromaticContact CD1-CD2 3.99Å; F122-F131 HydrophobicContact CD1-CD2 3.99Å; F122-F131 HydrophobicContact CD1-CG 4.39Å; F122-F131 HydrophobicContact CE1-CB 4.3Å; F122-F131 HydrophobicContact CE1-CD2 4.21Å; F122-F131 HydrophobicContact CG-CB 4.4Å; F122-F131 HydrophobicContact CG-CD2 4.18Å; F122-M135 HydrophobicContact CE1-CE 4.34Å; F122-M135 HydrophobicContact CE2-CE 4.23Å; F122-M135 HydrophobicContact CZ-CE 3.73Å
123	K	92.4	Very high	91.9	Very high	82 Å²	82	67.7 Å²	67.7	36%	0.357	32%	0.321	S	S	.	.	S	Bend	trans	-77.9	140.4	-179.1	-173.8	174.4	178.3	174.5	0	112.4	Q65 D120 G127	Q65-K123 HydrophobicContact CG-CD 4.06Å; Q65-K123 HydrophobicContact CG-CG 3.86Å; D120-K123 WeakPolarHBondContact O-CB 3.46Å; D120-K123 PolarHBondContact O-N 2.94Å; D120-K123 VanDerWaalsContact O-N 3.17Å; D120-K123 WeakPolarHBondContact OD1-CD 3.45Å; K123-G127 WeakPolarHBondContact O-CA 3.32Å; K123-G127 PolarHBondContact O-N 2.82Å
124	G	90.7	Very high	92.1	Very high	22 Å²	22	70.6 Å²	70.6	23%	0.227	33%	0.333	C	S	.	.	H	α-helix	trans	67.9	-176.8	177.4	0	0	0	0	0	114.6	D61 Q126 G127 Q128	D61-G124 PolarHBondContact OD1-N 2.93Å; D61-G124 WeakPolarHBondContact OD2-CA 3.26Å; D61-G124 PolarHBondContact OD2-N 3.42Å; G124-Q126 VanDerWaalsContact C-N 3.29Å; G124-Q126 PolarHBondContact O-N 3.38Å; G124-G127 PolarHBondContact O-N 2.88Å; G124-G127 VanDerWaalsContact O-N 3.16Å; G124-Q128 PolarHBondContact O-N 3.31Å
125	Q	88.3	Confident	92.1	Very high	160 Å²	160	62.6 Å²	62.6	75%	0.748	30%	0.299	S	S	*	.	H	α-helix	trans	-62.5	-32.9	-176.6	-67.3	179.3	3	0	0	113.7	K129	Q125-K129 PolarHBondContact O-N 3.31Å
126	Q	89.5	Confident	92	Very high	149 Å²	149	60.9 Å²	60.9	70%	0.696	30%	0.295	S	S	*	.	H	α-helix	trans	-71.5	-41.2	176.3	-65.6	-176.3	6.6	0	0	111.1	G124 Q128 K129 R130	G124-Q126 VanDerWaalsContact C-N 3.29Å; G124-Q126 PolarHBondContact O-N 3.38Å; Q126-Q128 VanDerWaalsContact C-N 3.34Å; Q126-K129 PolarHBondContact O-N 2.88Å; Q126-R130 PolarHBondContact O-N 3.33Å
127	G	89.8	Confident	92.1	Very high	2 Å²	2	64 Å²	64	2%	0.021	31%	0.309	C	S	.	.	H	α-helix	trans	-68.4	-33.8	177.4	0	0	0	0	0	113.1	Q121 F122 K123 G124 K129 R130 F131	Q121-G127 WeakPolarHBondContact O-CA 3.37Å; F122-G127 CarbonylContact O-C 3.56Å; K123-G127 WeakPolarHBondContact O-CA 3.32Å; K123-G127 PolarHBondContact O-N 2.82Å; G124-G127 PolarHBondContact O-N 2.88Å; G124-G127 VanDerWaalsContact O-N 3.16Å; G127-K129 VanDerWaalsContact C-N 3.34Å; G127-K129 PolarHBondContact O-N 2.96Å; G127-R130 WeakPolarHBondContact O-CB 3.43Å; G127-R130 PolarHBondContact O-N 3.45Å; G127-F131 PolarHBondContact O-N 2.88Å
128	Q	91.1	Very high	92	Very high	30 Å²	30	62.8 Å²	62.8	14%	0.14	31%	0.313	C	S	.	.	H	α-helix	trans	-56.5	-46.2	171.2	-175.1	-178.7	15	0	0	112.2	F49 G124 Q126 F131 Q132	F49-Q128 HydrophobicContact CD1-CG 3.61Å; F49-Q128 VanDerWaalsContact CD1-NE2 3.27Å; F49-Q128 HydrophobicContact CE1-CG 4.06Å; F49-Q128 PolarHBondContact O-NE2 3.49Å; G124-Q128 PolarHBondContact O-N 3.31Å; Q126-Q128 VanDerWaalsContact C-N 3.34Å; Q128-F131 PolarHBondContact O-N 3.44Å; Q128-Q132 VanDerWaalsContact O-CG 3.32Å; Q128-Q132 WeakPolarHBondContact O-CG 3.44Å; Q128-Q132 PolarHBondContact O-N 2.87Å
129	K	92.2	Very high	91.9	Very high	139 Å²	139	60.6 Å²	60.6	60%	0.604	31%	0.307	S	S	*	.	H	α-helix	trans	-62.2	-45.2	176.3	-67.8	178.3	-176.6	179.8	0	111.4	Q125 Q126 G127 F131 Q132 D133	Q125-K129 PolarHBondContact O-N 3.31Å; Q126-K129 PolarHBondContact O-N 2.88Å; G127-K129 VanDerWaalsContact C-N 3.34Å; G127-K129 PolarHBondContact O-N 2.96Å; K129-F131 VanDerWaalsContact C-N 3.3Å; K129-F131 PolarHBondContact O-N 2.89Å; K129-Q132 PolarHBondContact O-N 3.32Å; K129-Q132 VanDerWaalsContact O-N 3.16Å; K129-D133 VanDerWaalsContact O-CG 3.22Å; K129-D133 PolarHBondContact O-N 3.15Å
130	R	93.1	Very high	91.9	Very high	123 Å²	123	66 Å²	66	46%	0.464	34%	0.336	S	S	.	.	H	α-helix	trans	-58.8	-41.4	176.8	-69.5	177.6	-179.4	175.8	2.9	112.2	Q126 G127 L134	Q126-R130 PolarHBondContact O-N 3.33Å; G127-R130 WeakPolarHBondContact O-CB 3.43Å; G127-R130 PolarHBondContact O-N 3.45Å; R130-L134 WeakPolarHBondContact O-CB 3.37Å; R130-L134 PolarHBondContact O-N 3Å
131	F	94.4	Very high	92	Very high	0 Å²	0	64 Å²	64	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-61.5	-48.5	175.5	-178.4	-89.3	0	0	0	111.3	A44 F49 F60 F87 T90 F122 G127 Q128 K129 D133 L134 M135	A44-F131 HydrophobicContact CB-CE1 3.87Å; A44-F131 HydrophobicContact CB-CZ 4Å; F49-F131 HydrophobicContact CE1-CD1 4.12Å; F49-F131 AromaticContact CZ-CD1 3.71Å; F49-F131 HydrophobicContact CZ-CD1 3.71Å; F49-F131 AromaticContact CZ-CE1 3.74Å; F49-F131 HydrophobicContact CZ-CE1 3.74Å; F60-F131 HydrophobicContact CE1-CB 4.36Å; F60-F131 HydrophobicContact CE1-CD2 4.42Å; F60-F131 HydrophobicContact CE1-CG 4.18Å; F60-F131 HydrophobicContact CE2-CD1 4.22Å; F60-F131 HydrophobicContact CE2-CD2 4.3Å; F60-F131 HydrophobicContact CE2-CE1 4.04Å; F60-F131 HydrophobicContact CE2-CE2 4.07Å; F60-F131 HydrophobicContact CE2-CG 4.35Å; F60-F131 AromaticContact CE2-CZ 3.94Å; F60-F131 HydrophobicContact CE2-CZ 3.94Å; F60-F131 HydrophobicContact CZ-CB 4.24Å; F60-F131 AromaticContact CZ-CD1 3.86Å; F60-F131 HydrophobicContact CZ-CD1 3.86Å; F60-F131 AromaticContact CZ-CD2 3.55Å; F60-F131 HydrophobicContact CZ-CD2 3.55Å; F60-F131 HydrophobicContact CZ-CE1 4.09Å; F60-F131 AromaticContact CZ-CE2 3.76Å; F60-F131 HydrophobicContact CZ-CE2 3.76Å; F60-F131 AromaticContact CZ-CG 3.59Å; F60-F131 HydrophobicContact CZ-CG 3.59Å; F60-F131 HydrophobicContact CZ-CZ 4.04Å; F87-F131 HydrophobicContact CB-CZ 4.23Å; F87-F131 AromaticContact CD1-CE2 3.71Å; F87-F131 HydrophobicContact CD1-CE2 3.71Å; F87-F131 AromaticContact CD1-CZ 3.78Å; F87-F131 HydrophobicContact CD1-CZ 3.78Å; F87-F131 AromaticContact CD2-CE2 3.91Å; F87-F131 HydrophobicContact CD2-CE2 3.91Å; F87-F131 HydrophobicContact CD2-CZ 4.42Å; F87-F131 AromaticContact CE1-CE2 3.78Å; F87-F131 HydrophobicContact CE1-CE2 3.78Å; F87-F131 HydrophobicContact CE1-CZ 4.26Å; F87-F131 AromaticContact CE2-CE2 3.97Å; F87-F131 HydrophobicContact CE2-CE2 3.97Å; F87-F131 AromaticContact CG-CE2 3.79Å; F87-F131 HydrophobicContact CG-CE2 3.79Å; F87-F131 AromaticContact CG-CZ 3.88Å; F87-F131 HydrophobicContact CG-CZ 3.88Å; F87-F131 AromaticContact CZ-CE2 3.91Å; F87-F131 HydrophobicContact CZ-CE2 3.91Å; T90-F131 HydrophobicContact CG2-CE1 4.34Å; T90-F131 HydrophobicContact CG2-CZ 3.92Å; F122-F131 HydrophobicContact CD1-CB 3.74Å; F122-F131 AromaticContact CD1-CD2 3.99Å; F122-F131 HydrophobicContact CD1-CD2 3.99Å; F122-F131 HydrophobicContact CD1-CG 4.39Å; F122-F131 HydrophobicContact CE1-CB 4.3Å; F122-F131 HydrophobicContact CE1-CD2 4.21Å; F122-F131 HydrophobicContact CG-CB 4.4Å; F122-F131 HydrophobicContact CG-CD2 4.18Å; G127-F131 PolarHBondContact O-N 2.88Å; Q128-F131 PolarHBondContact O-N 3.44Å; K129-F131 VanDerWaalsContact C-N 3.3Å; K129-F131 PolarHBondContact O-N 2.89Å; F131-D133 PolarHBondContact O-N 3.46Å; F131-L134 PolarHBondContact O-N 2.79Å; F131-M135 HydrophobicContact CD2-CE 4.05Å; F131-M135 HydrophobicContact CD2-SD 3.95Å; F131-M135 HydrophobicContact CE2-CE 3.89Å; F131-M135 HydrophobicContact CE2-CG 4.41Å; F131-M135 HydrophobicContact CE2-SD 3.35Å; F131-M135 WeakPolarHBondContact CE2-SD 3.21Å; F131-M135 HydrophobicContact CZ-CB 4.39Å; F131-M135 HydrophobicContact CZ-SD 3.81Å; F131-M135 PolarHBondContact O-N 2.84Å
132	Q	92	Very high	92.1	Very high	55 Å²	55	60.8 Å²	60.8	26%	0.257	31%	0.309	S	S	.	.	H	α-helix	trans	-61.7	-41.9	179.3	-69.2	175.5	-3.8	0	0	112	Q128 K129 G136	Q128-Q132 VanDerWaalsContact O-CG 3.32Å; Q128-Q132 WeakPolarHBondContact O-CG 3.44Å; Q128-Q132 PolarHBondContact O-N 2.87Å; K129-Q132 PolarHBondContact O-N 3.32Å; K129-Q132 VanDerWaalsContact O-N 3.16Å; Q132-G136 WeakPolarHBondContact O-CA 3.45Å; Q132-G136 PolarHBondContact O-N 2.96Å
133	D	92.8	Very high	92.1	Very high	133 Å²	133	60.6 Å²	60.6	71%	0.711	31%	0.308	S	S	*	.	H	α-helix	trans	-68.1	-35.9	177.7	-65.5	-27.7	0	0	0	112.1	K129 F131	K129-D133 VanDerWaalsContact O-CG 3.22Å; K129-D133 PolarHBondContact O-N 3.15Å; F131-D133 PolarHBondContact O-N 3.46Å
134	L	92.7	Very high	92.3	Very high	79 Å²	79	57.4 Å²	57.4	41%	0.414	30%	0.296	S	S	.	.	H	α-helix	trans	-79.7	-43.7	-175.7	-163.8	148.7	0	0	0	112.1	K92 R130 F131	K92-L134 VanDerWaalsContact CD-O 3.26Å; K92-L134 WeakPolarHBondContact CD-O 3.42Å; K92-L134 VanDerWaalsContact CE-O 3.3Å; K92-L134 WeakPolarHBondContact CE-O 3.42Å; K92-L134 PolarHBondContact NZ-O 2.84Å; R130-L134 WeakPolarHBondContact O-CB 3.37Å; R130-L134 PolarHBondContact O-N 3Å; F131-L134 PolarHBondContact O-N 2.79Å
135	M	91.8	Very high	92.5	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-118.8	-18.1	-170.1	-55.5	-176.1	-157.5	0	0	114.6	F87 T90 E91 K92 Y103 L105 F122 F131	F87-M135 HydrophobicContact CD2-CE 4.44Å; F87-M135 HydrophobicContact CD2-SD 4.08Å; F87-M135 HydrophobicContact CE2-CE 4.42Å; T90-M135 HydrophobicContact CG2-CB 3.98Å; E91-M135 PolarHBondContact N-O 2.97Å; K92-M135 PolarHBondContact N-O 3.25Å; Y103-M135 HydrophobicContact CD1-CE 4.03Å; Y103-M135 HydrophobicContact CD1-CG 4.46Å; Y103-M135 HydrophobicContact CD1-SD 3.64Å; Y103-M135 HydrophobicContact CD2-CG 4.4Å; Y103-M135 HydrophobicContact CD2-SD 4.47Å; Y103-M135 HydrophobicContact CE1-CE 3.9Å; Y103-M135 HydrophobicContact CE1-SD 4.02Å; Y103-M135 HydrophobicContact CE2-CG 4.46Å; Y103-M135 HydrophobicContact CG-CG 4.39Å; Y103-M135 HydrophobicContact CG-SD 3.89Å; L105-M135 HydrophobicContact CD1-CE 3.8Å; F122-M135 HydrophobicContact CE1-CE 4.34Å; F122-M135 HydrophobicContact CE2-CE 4.23Å; F122-M135 HydrophobicContact CZ-CE 3.73Å; F131-M135 HydrophobicContact CD2-CE 4.05Å; F131-M135 HydrophobicContact CD2-SD 3.95Å; F131-M135 HydrophobicContact CE2-CE 3.89Å; F131-M135 HydrophobicContact CE2-CG 4.41Å; F131-M135 HydrophobicContact CE2-SD 3.35Å; F131-M135 WeakPolarHBondContact CE2-SD 3.21Å; F131-M135 HydrophobicContact CZ-CB 4.39Å; F131-M135 HydrophobicContact CZ-SD 3.81Å; F131-M135 PolarHBondContact O-N 2.84Å
136	G	92	Very high	92.9	Very high	7 Å²	7	51.3 Å²	51.3	7%	0.072	26%	0.261	C	S	.	.			trans	69.7	172.5	-167.8	0	0	0	0	0	112.9	Q132	Q132-G136 WeakPolarHBondContact O-CA 3.45Å; Q132-G136 PolarHBondContact O-N 2.96Å
137	H	92.8	Very high	93.2	Very high	71 Å²	71	44.4 Å²	44.4	33%	0.329	23%	0.229	S	C	.	.			trans	-151.6	165.1	-177.7	72.5	-74.1	0	0	0	112.1	A44 F49 G89 S139	A44-H137 WeakPolarHBondContact O-CB 3.44Å; F49-H137 HydrophobicContact CD2-CB 4.16Å; F49-H137 AromaticContact CD2-CD2 3.82Å; F49-H137 HydrophobicContact CE2-CB 3.56Å; F49-H137 HydrophobicContact CZ-CB 4.24Å; G89-H137 CarbonylContact O-C 3.54Å; H137-S139 VanDerWaalsContact C-N 3.31Å; H137-S139 PolarHBondContact O-N 2.79Å
138	G	89.5	Confident	93.5	Very high	45 Å²	45	48.5 Å²	48.5	46%	0.464	24%	0.244	S	C	.	.	S	Bend	trans	69	24.9	173.7	0	0	0	0	0	114.9	A44 G89	A44-G138 PolarHBondContact O-N 2.92Å; G89-G138 PolarHBondContact O-N 2.66Å; G89-G138 VanDerWaalsContact O-N 3.12Å
139	S	92.4	Very high	93.8	Very high	30 Å²	30	47.1 Å²	47.1	21%	0.21	24%	0.238	C	C	.	.			trans	-83.8	158.8	175.6	-63.4	0	0	0	0	112.1	G89 T90 E91 N101 H137 Y141	G89-S139 PolarHBondContact O-N 2.77Å; T90-S139 WeakPolarHBondContact O-CB 3.45Å; T90-S139 PolarHBondContact O-OG 3.22Å; E91-S139 WeakPolarHBondContact CA-OG 3.36Å; N101-S139 WeakPolarHBondContact ND2-CB 3.35Å; H137-S139 VanDerWaalsContact C-N 3.31Å; H137-S139 PolarHBondContact O-N 2.79Å; S139-Y141 WeakPolarHBondContact O-CD1 3.44Å
140	D	93.6	Very high	93.9	Very high	114 Å²	114	40.5 Å²	40.5	61%	0.61	21%	0.209	S	C	*	.			trans	-65.7	149.5	173.5	-171.9	26	0	0	0	110.8	N101 K182	N101-D140 VanDerWaalsContact CB-O 3.23Å; N101-D140 WeakPolarHBondContact CB-O 3.41Å; N101-D140 PolarHBondContact OD1-O 3.46Å; D140-K182 IonicContact OD1-NZ 3.29Å; D140-K182 PolarHBondContact OD1-NZ 2.95Å; D140-K182 IonicContact OD2-NZ 3.78Å; D140-K182 PolarHBondContact OD2-NZ 2.79Å
141	Y	94.4	Very high	94	Very high	22 Å²	22	35.5 Å²	35.5	9%	0.086	19%	0.194	C	C	.	.			trans	-147.9	170.1	-178.9	58.2	-94.4	0	0	0	112	S45 Y88 S139 L143 P175 H176 K182	S45-Y141 WeakPolarHBondContact OG-CE1 3.37Å; Y88-Y141 HydrophobicContact CD2-CD1 4.11Å; Y88-Y141 AromaticContact CD2-CD2 3.8Å; Y88-Y141 HydrophobicContact CD2-CD2 3.8Å; Y88-Y141 HydrophobicContact CD2-CE1 4.19Å; Y88-Y141 AromaticContact CD2-CE2 3.89Å; Y88-Y141 HydrophobicContact CD2-CE2 3.89Å; Y88-Y141 AromaticContact CD2-CG 3.92Å; Y88-Y141 HydrophobicContact CD2-CG 3.92Å; Y88-Y141 HydrophobicContact CE2-CD1 4.44Å; Y88-Y141 HydrophobicContact CE2-CD2 4.03Å; Y88-Y141 HydrophobicContact CE2-CE1 4.07Å; Y88-Y141 AromaticContact CE2-CE2 3.61Å; Y88-Y141 HydrophobicContact CE2-CE2 3.61Å; Y88-Y141 HydrophobicContact CE2-CG 4.43Å; Y88-Y141 AromaticContact CE2-CZ 3.63Å; S139-Y141 WeakPolarHBondContact O-CD1 3.44Å; Y141-L143 HydrophobicContact CD2-CG 4.42Å; Y141-L143 HydrophobicContact CE2-CD2 4.42Å; Y141-L143 HydrophobicContact CE2-CG 4.16Å; Y141-P175 HydrophobicContact CE2-CB 4.06Å; Y141-H176 AromaticContact CD2-CE1 3.89Å; Y141-H176 AromaticContact CE2-CE1 3.9Å; Y141-H176 AromaticContact CE2-NE2 3.88Å; Y141-H176 PolarHBondContact O-CE1 2.74Å; Y141-K182 PolarHBondContact O-NZ 2.78Å
142	S	94.9	Very high	94	Very high	4 Å²	4	37 Å²	37	3%	0.028	20%	0.202	C	C	.	.			trans	-129.4	118.3	168.1	-175.9	0	0	0	0	110	S144 E145 V146	S142-S144 PolarHBondContact O-N 2.96Å; S142-S144 VanDerWaalsContact O-N 3.13Å; S142-S144 PolarHBondContact OG-OG 2.86Å; S142-E145 PolarHBondContact O-N 3.1Å; S142-V146 WeakPolarHBondContact O-CG2 3.38Å; S142-V146 PolarHBondContact O-N 3.26Å; S142-V146 VanDerWaalsContact O-N 3.1Å
143	L	94.8	Very high	94.1	Very high	5 Å²	5	35.1 Å²	35.1	3%	0.026	19%	0.194	C	C	.	.	H	α-helix	trans	-60.6	-27	179.4	-81.1	175.7	0	0	0	112.6	Y88 Y141 E145 V146 L147 P175 H176 A186 F216 Y217	Y88-L143 HydrophobicContact CE2-CD2 4.36Å; Y141-L143 HydrophobicContact CD2-CG 4.42Å; Y141-L143 HydrophobicContact CE2-CD2 4.42Å; Y141-L143 HydrophobicContact CE2-CG 4.16Å; L143-E145 VanDerWaalsContact C-N 3.34Å; L143-E145 PolarHBondContact O-N 3.35Å; L143-V146 HydrophobicContact CD2-CB 4.45Å; L143-V146 PolarHBondContact O-N 3.19Å; L143-L147 WeakPolarHBondContact O-CB 3.48Å; L143-L147 VanDerWaalsContact O-CG 3.22Å; L143-L147 WeakPolarHBondContact O-CG 3.24Å; L143-L147 PolarHBondContact O-N 3.37Å; L143-P175 HydrophobicContact CD1-CB 4.13Å; L143-P175 HydrophobicContact CD1-CG 3.98Å; L143-H176 WeakPolarHBondContact CG-NE2 3.44Å; L143-H176 PolarHBondContact N-NE2 2.9Å; L143-A186 HydrophobicContact CB-CB 3.8Å; L143-F216 HydrophobicContact CD1-CE1 3.48Å; L143-F216 VanDerWaalsContact CD1-CE1 3.48Å; L143-F216 HydrophobicContact CD1-CZ 3.92Å; L143-Y217 HydrophobicContact CD1-CE1 4.44Å
144	S	95.3	Very high	94.1	Very high	15 Å²	15	28.9 Å²	28.9	11%	0.105	16%	0.16	C	C	.	.	H	α-helix	trans	-62.6	-40.1	174.7	66.1	0	0	0	0	112.9	S142 W148	S142-S144 PolarHBondContact O-N 2.96Å; S142-S144 VanDerWaalsContact O-N 3.13Å; S142-S144 PolarHBondContact OG-OG 2.86Å; S144-W148 WeakPolarHBondContact O-CB 3.3Å; S144-W148 PolarHBondContact O-N 3.24Å; S144-W148 VanDerWaalsContact O-N 3.13Å
145	E	95.9	Very high	93.9	Very high	53 Å²	53	29.4 Å²	29.4	25%	0.248	17%	0.17	C	C	.	.	H	α-helix	trans	-72.6	-41.5	177	-66.2	173.3	-161.1	0	0	110.3	F99 I102 S142 L143 L147 W148 V149	F99-E145 HydrophobicContact CB-CB 4.4Å; F99-E145 HydrophobicContact CD1-CB 4.31Å; F99-E145 HydrophobicContact CD1-CG 4Å; F99-E145 HydrophobicContact CD2-CB 3.97Å; F99-E145 HydrophobicContact CD2-CG 4.38Å; F99-E145 HydrophobicContact CE1-CG 4.03Å; F99-E145 HydrophobicContact CE2-CB 4.28Å; F99-E145 HydrophobicContact CE2-CG 4.38Å; F99-E145 HydrophobicContact CG-CB 4Å; F99-E145 HydrophobicContact CG-CG 4.22Å; F99-E145 HydrophobicContact CZ-CG 4.23Å; I102-E145 HydrophobicContact CD1-CB 3.94Å; S142-E145 PolarHBondContact O-N 3.1Å; L143-E145 VanDerWaalsContact C-N 3.34Å; L143-E145 PolarHBondContact O-N 3.35Å; E145-L147 PolarHBondContact O-N 3.37Å; E145-W148 WeakPolarHBondContact O-CB 3.44Å; E145-W148 PolarHBondContact O-N 2.85Å; E145-W148 VanDerWaalsContact O-N 3.16Å; E145-V149 WeakPolarHBondContact O-CG2 3.34Å; E145-V149 PolarHBondContact O-N 3.34Å
146	V	96.7	Very high	93.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-56.5	-52.3	175.6	179.2	0	0	0	0	111.1	L41 Y88 I102 S142 L143 W148 V149 C150	L41-V146 HydrophobicContact CD1-CG1 3.56Å; L41-V146 HydrophobicContact CD2-CG1 3.62Å; L41-V146 HydrophobicContact CG-CG1 4.16Å; Y88-V146 HydrophobicContact CD1-CG1 4.24Å; Y88-V146 HydrophobicContact CD2-CG2 4.44Å; Y88-V146 HydrophobicContact CG-CG1 4.23Å; Y88-V146 HydrophobicContact CG-CG2 4.11Å; I102-V146 HydrophobicContact CD1-CB 4.33Å; I102-V146 HydrophobicContact CD1-CG2 3.87Å; I102-V146 HydrophobicContact CG1-CG2 3.85Å; S142-V146 WeakPolarHBondContact O-CG2 3.38Å; S142-V146 PolarHBondContact O-N 3.26Å; S142-V146 VanDerWaalsContact O-N 3.1Å; L143-V146 HydrophobicContact CD2-CB 4.45Å; L143-V146 PolarHBondContact O-N 3.19Å; V146-W148 VanDerWaalsContact C-N 3.25Å; V146-W148 PolarHBondContact O-N 3.09Å; V146-V149 PolarHBondContact O-N 3.02Å; V146-C150 PolarHBondContact O-N 3.24Å; V146-C150 VanDerWaalsContact O-N 3.08Å; V146-C150 PolarHBondContact O-SG 3.2Å
147	L	95.8	Very high	93.6	Very high	4 Å²	4	34 Å²	34	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-64.1	-31.9	179.3	-70.5	-178.6	0	0	0	112.3	L143 E145 A151 K189 A190 L193 L200	L143-L147 WeakPolarHBondContact O-CB 3.48Å; L143-L147 VanDerWaalsContact O-CG 3.22Å; L143-L147 WeakPolarHBondContact O-CG 3.24Å; L143-L147 PolarHBondContact O-N 3.37Å; E145-L147 PolarHBondContact O-N 3.37Å; L147-A151 WeakPolarHBondContact O-CB 3.33Å; L147-A151 PolarHBondContact O-N 3.06Å; L147-K189 HydrophobicContact CB-CG 3.9Å; L147-A190 HydrophobicContact CD1-CB 4.09Å; L147-L193 HydrophobicContact CB-CD1 3.95Å; L147-L193 HydrophobicContact CD1-CD1 4.17Å; L147-L193 HydrophobicContact CD2-CD1 3.86Å; L147-L193 HydrophobicContact CG-CD1 4.2Å; L147-L200 HydrophobicContact CD1-CD1 4.29Å; L147-L200 HydrophobicContact CD2-CD1 3.55Å
148	W	95.8	Very high	93.3	Very high	88 Å²	88	39 Å²	39	33%	0.333	22%	0.218	S	C	.	.	H	α-helix	trans	-65.1	-45.8	173.8	-169.6	102.3	0	0	0	111.6	V97 F99 S144 E145 V146 C150 A151 N152	V97-W148 HydrophobicContact CB-CH2 4.44Å; V97-W148 HydrophobicContact CB-CZ3 4.11Å; V97-W148 HydrophobicContact CG1-CH2 3.43Å; V97-W148 VanDerWaalsContact CG1-CH2 3.43Å; V97-W148 HydrophobicContact CG1-CZ3 3.5Å; V97-W148 HydrophobicContact CG2-CE3 3.94Å; V97-W148 HydrophobicContact CG2-CH2 4.22Å; V97-W148 HydrophobicContact CG2-CZ3 3.44Å; V97-W148 VanDerWaalsContact CG2-CZ3 3.44Å; F99-W148 HydrophobicContact CD2-CE3 4.22Å; F99-W148 HydrophobicContact CE2-CB 4.34Å; F99-W148 AromaticContact CE2-CD2 3.93Å; F99-W148 HydrophobicContact CE2-CD2 3.93Å; F99-W148 AromaticContact CE2-CE3 3.64Å; F99-W148 HydrophobicContact CE2-CE3 3.64Å; F99-W148 HydrophobicContact CE2-CG 4.24Å; F99-W148 HydrophobicContact CE2-CZ3 4.32Å; S144-W148 WeakPolarHBondContact O-CB 3.3Å; S144-W148 PolarHBondContact O-N 3.24Å; S144-W148 VanDerWaalsContact O-N 3.13Å; E145-W148 WeakPolarHBondContact O-CB 3.44Å; E145-W148 PolarHBondContact O-N 2.85Å; E145-W148 VanDerWaalsContact O-N 3.16Å; V146-W148 VanDerWaalsContact C-N 3.25Å; V146-W148 PolarHBondContact O-N 3.09Å; W148-C150 VanDerWaalsContact C-N 3.34Å; W148-C150 PolarHBondContact O-N 3.28Å; W148-A151 WeakPolarHBondContact O-CB 3.24Å; W148-A151 PolarHBondContact O-N 2.68Å; W148-A151 VanDerWaalsContact O-N 3.15Å; W148-N152 HydrophobicContact CE3-CB 4.27Å; W148-N152 HydrophobicContact CH2-CB 4.23Å; W148-N152 HydrophobicContact CZ3-CB 3.86Å; W148-N152 PolarHBondContact O-N 3.49Å
149	V	96.3	Very high	93.1	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.012	21%	0.214	C	C	.	.	H	α-helix	trans	-60.1	-45.6	177	174.9	0	0	0	0	110.6	N95 F99 I102 V104 E145 V146 A151 N152 L153	N95-V149 HydrophobicContact CB-CG1 3.87Å; N95-V149 HydrophobicContact CB-CG2 4.1Å; F99-V149 HydrophobicContact CD2-CG2 3.83Å; I102-V149 HydrophobicContact CD1-CG2 4.01Å; I102-V149 HydrophobicContact CG2-CB 4.19Å; I102-V149 HydrophobicContact CG2-CG1 4.07Å; I102-V149 HydrophobicContact CG2-CG2 4.11Å; V104-V149 HydrophobicContact CG2-CG1 3.73Å; E145-V149 WeakPolarHBondContact O-CG2 3.34Å; E145-V149 PolarHBondContact O-N 3.34Å; V146-V149 PolarHBondContact O-N 3.02Å; V149-A151 VanDerWaalsContact C-N 3.31Å; V149-A151 PolarHBondContact O-N 3.31Å; V149-N152 WeakPolarHBondContact O-CB 3.42Å; V149-N152 PolarHBondContact O-N 3.31Å; V149-N152 VanDerWaalsContact O-N 3.13Å; V149-L153 PolarHBondContact O-N 3.47Å; V149-L153 VanDerWaalsContact O-N 3.11Å
150	C	95.7	Very high	92.7	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.2	-38.8	176.1	-63.1	0	0	0	0	112.4	I39 V146 W148 N152 L153 F154 I166	I39-C150 HydrophobicContact CD1-CB 4.03Å; I39-C150 WeakPolarHBondContact CD1-O 3.33Å; V146-C150 PolarHBondContact O-N 3.24Å; V146-C150 VanDerWaalsContact O-N 3.08Å; V146-C150 PolarHBondContact O-SG 3.2Å; W148-C150 VanDerWaalsContact C-N 3.34Å; W148-C150 PolarHBondContact O-N 3.28Å; C150-N152 VanDerWaalsContact C-N 3.32Å; C150-N152 PolarHBondContact O-N 2.92Å; C150-L153 PolarHBondContact O-N 2.89Å; C150-F154 VanDerWaalsContact O-CD2 3.28Å; C150-F154 WeakPolarHBondContact O-CD2 3.46Å; C150-I166 HydrophobicContact CB-CD1 3.57Å; C150-I166 HydrophobicContact CB-CG1 4.25Å
151	A	94.4	Very high	92.2	Very high	17 Å²	17	44.5 Å²	44.5	14%	0.14	22%	0.221	C	C	.	.	H	α-helix	trans	-62.8	-39.7	174.5	0	0	0	0	0	112.3	L147 W148 V149 L153 F154 S155 L193 I198	L147-A151 WeakPolarHBondContact O-CB 3.33Å; L147-A151 PolarHBondContact O-N 3.06Å; W148-A151 WeakPolarHBondContact O-CB 3.24Å; W148-A151 PolarHBondContact O-N 2.68Å; W148-A151 VanDerWaalsContact O-N 3.15Å; V149-A151 VanDerWaalsContact C-N 3.31Å; V149-A151 PolarHBondContact O-N 3.31Å; A151-L153 VanDerWaalsContact C-N 3.33Å; A151-F154 PolarHBondContact O-N 3.14Å; A151-S155 PolarHBondContact O-N 2.67Å; A151-S155 PolarHBondContact O-OG 3.17Å; A151-L193 HydrophobicContact CB-CD2 3.67Å; A151-I198 HydrophobicContact CB-CD1 4.37Å
152	N	94.1	Very high	91.7	Very high	33 Å²	33	45.3 Å²	45.3	18%	0.176	23%	0.23	C	C	.	.	H	α-helix	trans	-64.7	-39	179.8	-163	78.2	0	0	0	111.5	S96 W148 V149 C150 F154 S155 D156	S96-N152 PolarHBondContact OG-ND2 2.83Å; W148-N152 HydrophobicContact CE3-CB 4.27Å; W148-N152 HydrophobicContact CH2-CB 4.23Å; W148-N152 HydrophobicContact CZ3-CB 3.86Å; W148-N152 PolarHBondContact O-N 3.49Å; V149-N152 WeakPolarHBondContact O-CB 3.42Å; V149-N152 PolarHBondContact O-N 3.31Å; V149-N152 VanDerWaalsContact O-N 3.13Å; C150-N152 VanDerWaalsContact C-N 3.32Å; C150-N152 PolarHBondContact O-N 2.92Å; N152-F154 PolarHBondContact O-N 2.86Å; N152-S155 WeakPolarHBondContact O-CA 3.46Å; N152-S155 WeakPolarHBondContact O-CB 3.17Å; N152-S155 PolarHBondContact O-N 2.95Å; N152-D156 PolarHBondContact ND2-OD1 2.79Å; N152-D156 PolarHBondContact ND2-OD2 3.33Å; N152-D156 PolarHBondContact O-N 2.85Å; N152-D156 VanDerWaalsContact O-N 3.09Å
153	L	93.7	Very high	91.1	Very high	14 Å²	14	47 Å²	47	7%	0.073	24%	0.237	C	C	.	.	H	α-helix	trans	-57.2	-37.7	176.7	-67.7	177.4	0	0	0	112.4	I39 A84 V86 V104 E107 L108 V149 C150 A151 S155 D156	I39-L153 HydrophobicContact CD1-CB 3.97Å; I39-L153 HydrophobicContact CD1-CD1 4.16Å; A84-L153 HydrophobicContact CB-CD1 4.47Å; V86-L153 HydrophobicContact CG2-CD1 3.61Å; V104-L153 HydrophobicContact CG1-CD1 4.21Å; V104-L153 HydrophobicContact CG1-CD2 4.17Å; V104-L153 HydrophobicContact CG2-CD1 4.43Å; E107-L153 HydrophobicContact CG-CD2 4.25Å; L108-L153 HydrophobicContact CD1-CB 4.28Å; V149-L153 PolarHBondContact O-N 3.47Å; V149-L153 VanDerWaalsContact O-N 3.11Å; C150-L153 PolarHBondContact O-N 2.89Å; A151-L153 VanDerWaalsContact C-N 3.33Å; L153-S155 PolarHBondContact O-N 2.78Å; L153-D156 PolarHBondContact O-N 3.5Å
154	F	93.1	Very high	90.9	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.009	25%	0.247	C	C	.	.	H	α-helix	trans	-69.4	-20.3	173.5	-65.3	-64.6	0	0	0	113.6	I39 L108 C150 A151 N152 V157 M161 K164 I166 I198	I39-F154 HydrophobicContact CD1-CD1 4.44Å; I39-F154 HydrophobicContact CD1-CD2 3.94Å; I39-F154 HydrophobicContact CD1-CE1 3.97Å; I39-F154 HydrophobicContact CD1-CE2 3.42Å; I39-F154 VanDerWaalsContact CD1-CE2 3.42Å; I39-F154 HydrophobicContact CD1-CG 4.41Å; I39-F154 HydrophobicContact CD1-CZ 3.44Å; I39-F154 VanDerWaalsContact CD1-CZ 3.44Å; I39-F154 HydrophobicContact CG1-CE1 3.98Å; I39-F154 HydrophobicContact CG1-CE2 4.11Å; I39-F154 HydrophobicContact CG1-CZ 3.59Å; L108-F154 HydrophobicContact CD1-CD1 3.56Å; L108-F154 HydrophobicContact CD1-CE1 3.94Å; L108-F154 HydrophobicContact CD1-CG 4.27Å; C150-F154 VanDerWaalsContact O-CD2 3.28Å; C150-F154 WeakPolarHBondContact O-CD2 3.46Å; A151-F154 PolarHBondContact O-N 3.14Å; N152-F154 PolarHBondContact O-N 2.86Å; F154-V157 WeakPolarHBondContact O-CG1 3.48Å; F154-M161 HydrophobicContact CB-SD 4.25Å; F154-M161 HydrophobicContact CD1-SD 3.94Å; F154-M161 WeakPolarHBondContact O-CE 3.4Å; F154-K164 HydrophobicContact CB-CD 4.11Å; F154-K164 HydrophobicContact CD1-CB 3.9Å; F154-K164 HydrophobicContact CD1-CD 4.32Å; F154-K164 HydrophobicContact CD1-CG 3.84Å; F154-K164 HydrophobicContact CD2-CB 4.34Å; F154-K164 HydrophobicContact CE1-CB 3.77Å; F154-K164 HydrophobicContact CE1-CG 4.19Å; F154-K164 HydrophobicContact CE2-CB 4.21Å; F154-K164 HydrophobicContact CG-CB 4.2Å; F154-K164 HydrophobicContact CG-CD 4.11Å; F154-K164 HydrophobicContact CG-CG 4.13Å; F154-K164 HydrophobicContact CZ-CB 3.93Å; F154-I166 HydrophobicContact CE2-CD1 4.13Å; F154-I166 HydrophobicContact CE2-CG1 3.78Å; F154-I166 HydrophobicContact CZ-CG1 4.1Å; F154-I198 HydrophobicContact CD2-CD1 3.8Å; F154-I198 HydrophobicContact CD2-CG1 4.19Å; F154-I198 HydrophobicContact CD2-CG2 4.37Å; F154-I198 HydrophobicContact CE2-CD1 4.28Å; F154-I198 HydrophobicContact CE2-CG1 4.37Å; F154-I198 HydrophobicContact CE2-CG2 3.76Å; F154-I198 HydrophobicContact CZ-CG2 4.46Å
155	S	89.2	Confident	90.8	Very high	90 Å²	90	50.3 Å²	50.3	63%	0.629	25%	0.249	S	C	*	.	H	α-helix	trans	-85.6	-28.1	179.5	-55	0	0	0	0	111.9	A151 N152 L153 V157	A151-S155 PolarHBondContact O-N 2.67Å; A151-S155 PolarHBondContact O-OG 3.17Å; N152-S155 WeakPolarHBondContact O-CA 3.46Å; N152-S155 WeakPolarHBondContact O-CB 3.17Å; N152-S155 PolarHBondContact O-N 2.95Å; L153-S155 PolarHBondContact O-N 2.78Å; S155-V157 VanDerWaalsContact C-N 3.27Å; S155-V157 PolarHBondContact O-N 3.01Å
156	D	88.4	Confident	90.8	Very high	81 Å²	81	47.8 Å²	47.8	43%	0.433	24%	0.237	S	C	.	.	H	α-helix	trans	-76.2	-14.4	-178.1	-61.7	-31.2	0	0	0	113.2	N152 L153 Q158	N152-D156 PolarHBondContact ND2-OD1 2.79Å; N152-D156 PolarHBondContact ND2-OD2 3.33Å; N152-D156 PolarHBondContact O-N 2.85Å; N152-D156 VanDerWaalsContact O-N 3.09Å; L153-D156 PolarHBondContact O-N 3.5Å; D156-Q158 PolarHBondContact O-NE2 2.85Å
157	V	88.4	Confident	90.7	Very high	25 Å²	25	47.8 Å²	47.8	15%	0.152	24%	0.237	C	C	.	.			trans	-73.3	132.7	-177	73.6	0	0	0	0	112.4	L82 F154 S155 F159 M161	L82-V157 HydrophobicContact CD1-CG2 3.4Å; F154-V157 WeakPolarHBondContact O-CG1 3.48Å; S155-V157 VanDerWaalsContact C-N 3.27Å; S155-V157 PolarHBondContact O-N 3.01Å; V157-F159 VanDerWaalsContact C-N 3.33Å; V157-F159 HydrophobicContact CG2-CB 4.24Å; V157-F159 HydrophobicContact CG2-CD2 3.99Å; V157-M161 HydrophobicContact CG1-CE 3.32Å; V157-M161 HydrophobicContact CG1-CG 3.92Å; V157-M161 HydrophobicContact CG1-SD 3.5Å; V157-M161 VanDerWaalsContact CG1-SD 3.5Å
158	Q	86.2	Confident	90.8	Very high	174 Å²	174	47.8 Å²	47.8	81%	0.813	24%	0.237	S	C	*	.			trans	-86.1	-6.2	-178.6	-57	-59.6	-37.7	0	0	113.5	D156	D156-Q158 PolarHBondContact O-NE2 2.85Å
159	F	85.4	Confident	90.9	Very high	91 Å²	91	43.6 Å²	43.6	40%	0.399	22%	0.221	S	C	.	.	S	Bend	trans	-98.2	150.5	-176.7	-57.7	-73.6	0	0	0	111.6	L82 V157 M161	L82-F159 HydrophobicContact CD1-CB 4.5Å; L82-F159 HydrophobicContact CD1-CD2 4.11Å; L82-F159 HydrophobicContact CD2-CD2 4.49Å; V157-F159 VanDerWaalsContact C-N 3.33Å; V157-F159 HydrophobicContact CG2-CB 4.24Å; V157-F159 HydrophobicContact CG2-CD2 3.99Å; F159-M161 PolarHBondContact O-N 3.25Å
160	K	84.9	Confident	90.9	Very high	168 Å²	168	43.5 Å²	43.5	73%	0.73	22%	0.22	S	C	*	.	P	Polyproline II helix	trans	-68.1	118.3	168.5	-69.8	-178	-179.9	176.5	0	109.5	G34 R35	G34-K160 WeakPolarHBondContact CA-O 3.35Å; R35-K160 PolarHBondContact N-O 3.24Å
161	M	83.1	Confident	90.9	Very high	47 Å²	47	43.6 Å²	43.6	23%	0.232	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	135.2	176.2	-60.5	168.2	-83.3	0	0	110.6	R35 S37 F154 V157 F159 K164	R35-M161 CarbonylContact O-C 3.53Å; R35-M161 VanDerWaalsContact O-CA 3.24Å; R35-M161 WeakPolarHBondContact O-CA 3.31Å; S37-M161 WeakPolarHBondContact OG-CG 3.38Å; F154-M161 HydrophobicContact CB-SD 4.25Å; F154-M161 HydrophobicContact CD1-SD 3.94Å; F154-M161 WeakPolarHBondContact O-CE 3.4Å; V157-M161 HydrophobicContact CG1-CE 3.32Å; V157-M161 HydrophobicContact CG1-CG 3.92Å; V157-M161 HydrophobicContact CG1-SD 3.5Å; V157-M161 VanDerWaalsContact CG1-SD 3.5Å; F159-M161 PolarHBondContact O-N 3.25Å; M161-K164 HydrophobicContact CE-CD 4.41Å; M161-K164 HydrophobicContact SD-CD 4.31Å; M161-K164 HydrophobicContact SD-CG 3.9Å
162	S	83	Confident	90.9	Very high	39 Å²	39	45 Å²	45	27%	0.273	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	-45.6	167.5	-69.7	0	0	0	0	110.3	G34 R35 D36	G34-S162 WeakPolarHBondContact CA-OG 3.34Å; G34-S162 PolarHBondContact N-OG 3.47Å; G34-S162 PolarHBondContact O-OG 2.84Å; R35-S162 PolarHBondContact O-N 3.47Å; D36-S162 VanDerWaalsContact OD1-CB 3.24Å; D36-S162 WeakPolarHBondContact OD1-CB 3.45Å
163	H	83.3	Confident	90.9	Very high	39 Å²	39	44.1 Å²	44.1	18%	0.181	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	142.2	-170	-67.5	-50.2	0	0	0	112	Y32 D36 S37 R252	Y32-H163 PolarHBondContact OH-NE2 3.19Å; D36-H163 WeakPolarHBondContact OD1-CB 3.14Å; D36-H163 IonicContact OD1-CD2 3.55Å; D36-H163 PolarHBondContact OD1-CD2 3.47Å; D36-H163 IonicContact OD1-CG 2.9Å; D36-H163 IonicContact OD2-CD2 3.66Å; S37-H163 PolarHBondContact N-O 2.99Å; H163-R252 VanDerWaalsContact CB-CZ 3.49Å; H163-R252 WeakPolarHBondContact CD2-CD 3.42Å; H163-R252 PolarHBondContact CE1-NH1 3.02Å; H163-R252 PolarHBondContact ND1-NH1 3.43Å
164	K	90.9	Very high	91	Very high	54 Å²	54	46.2 Å²	46.2	24%	0.235	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	117.3	178.4	-57.6	175.4	-175.8	-177.7	0	109	F154 M161 I198 F199	F154-K164 HydrophobicContact CB-CD 4.11Å; F154-K164 HydrophobicContact CD1-CB 3.9Å; F154-K164 HydrophobicContact CD1-CD 4.32Å; F154-K164 HydrophobicContact CD1-CG 3.84Å; F154-K164 HydrophobicContact CD2-CB 4.34Å; F154-K164 HydrophobicContact CE1-CB 3.77Å; F154-K164 HydrophobicContact CE1-CG 4.19Å; F154-K164 HydrophobicContact CE2-CB 4.21Å; F154-K164 HydrophobicContact CG-CB 4.2Å; F154-K164 HydrophobicContact CG-CD 4.11Å; F154-K164 HydrophobicContact CG-CG 4.13Å; F154-K164 HydrophobicContact CZ-CB 3.93Å; M161-K164 HydrophobicContact CE-CD 4.41Å; M161-K164 HydrophobicContact SD-CD 4.31Å; M161-K164 HydrophobicContact SD-CG 3.9Å; K164-I198 HydrophobicContact CB-CB 4.35Å; K164-I198 HydrophobicContact CB-CG1 3.8Å; K164-I198 HydrophobicContact CB-CG2 4.43Å; K164-I198 HydrophobicContact CD-CD1 4.4Å; K164-I198 HydrophobicContact CD-CG1 3.75Å; K164-I198 HydrophobicContact CG-CG1 4.44Å; K164-F199 PolarHBondContact O-N 3.32Å
165	R	92	Very high	90.9	Very high	36 Å²	36	47 Å²	47	14%	0.136	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	138.3	-177.7	-169.7	-178.5	-66.1	-90.3	6.7	111.4	S37 L38 I39 F199 D201 K249	S37-R165 PolarHBondContact O-N 3.36Å; L38-R165 WeakPolarHBondContact CA-O 3.34Å; L38-R165 HydrophobicContact CD1-CB 3.91Å; L38-R165 HydrophobicContact CD1-CG 3.96Å; I39-R165 PolarHBondContact N-O 3.1Å; R165-F199 CarbonylContact C-O 3.5Å; R165-F199 VanDerWaalsContact CA-O 3.28Å; R165-F199 WeakPolarHBondContact CA-O 3.37Å; R165-F199 HydrophobicContact CG-CB 4.28Å; R165-D201 WeakPolarHBondContact CD-OD2 3.38Å; R165-D201 WeakPolarHBondContact CG-OD2 3.14Å; R165-D201 IonicContact CZ-OD2 3.62Å; R165-D201 IonicContact NE-OD2 3.8Å; R165-D201 IonicContact NH1-OD1 2.78Å; R165-D201 IonicContact NH1-OD2 2.68Å; R165-D201 PolarHBondContact NH1-OD2 3.15Å; R165-K249 PolarHBondContact NE-O 3.28Å
166	I	95.6	Very high	91.1	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	123.3	172.4	-57	170.7	0	0	0	107	I39 L41 C150 F154 L193 I198 F199 L200 D201	I39-I166 HydrophobicContact CB-CG1 4.34Å; I39-I166 HydrophobicContact CD1-CG1 4.46Å; I39-I166 WeakPolarHBondContact O-CA 3.39Å; L41-I166 HydrophobicContact CB-CG2 4Å; L41-I166 HydrophobicContact CD2-CG2 4.17Å; C150-I166 HydrophobicContact CB-CD1 3.57Å; C150-I166 HydrophobicContact CB-CG1 4.25Å; F154-I166 HydrophobicContact CE2-CD1 4.13Å; F154-I166 HydrophobicContact CE2-CG1 3.78Å; F154-I166 HydrophobicContact CZ-CG1 4.1Å; I166-L193 HydrophobicContact CD1-CD1 4.06Å; I166-I198 HydrophobicContact CD1-CG2 3.78Å; I166-I198 HydrophobicContact CG1-CG2 3.98Å; I166-F199 PolarHBondContact N-O 3.45Å; I166-L200 WeakPolarHBondContact O-CA 3.44Å; I166-D201 PolarHBondContact O-N 3.47Å
167	M	95.8	Very high	91.1	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	114.2	171	-76	-178.6	-177.2	0	0	109.4	L38 I39 F40 L41 F169 D201 V246 K249 E250	L38-M167 HydrophobicContact CD1-CB 4.48Å; L38-M167 HydrophobicContact CD1-CE 4.05Å; L38-M167 HydrophobicContact CD1-CG 3.85Å; L38-M167 HydrophobicContact CD1-SD 3.98Å; L38-M167 HydrophobicContact CD2-CE 4.36Å; L38-M167 HydrophobicContact CD2-SD 4.31Å; I39-M167 PolarHBondContact O-N 2.94Å; F40-M167 HydrophobicContact CD1-CB 4.45Å; F40-M167 HydrophobicContact CE1-SD 4.15Å; L41-M167 PolarHBondContact N-O 2.88Å; M167-F169 HydrophobicContact CB-CE2 3.72Å; M167-F169 HydrophobicContact CB-CZ 4.38Å; M167-F169 WeakPolarHBondContact O-CD2 3.47Å; M167-D201 WeakPolarHBondContact CA-O 3.48Å; M167-D201 HydrophobicContact CG-CB 4.31Å; M167-V246 HydrophobicContact SD-CG1 3.95Å; M167-K249 VanDerWaalsContact CE-C 3.5Å; M167-K249 HydrophobicContact CE-CB 3.76Å; M167-E250 HydrophobicContact CE-CB 4.33Å
168	L	96.9	Very high	91.2	Very high	3 Å²	3	47.6 Å²	47.6	2%	0.016	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	120.1	-179.3	172.4	61.5	0	0	0	110.9	L41 Y88 T170 L200 D201 L202 M203 Y217	L41-L168 HydrophobicContact CB-CD1 4.36Å; L41-L168 HydrophobicContact CD2-CD1 3.81Å; L41-L168 HydrophobicContact CG-CD1 3.84Å; L41-L168 CarbonylContact O-C 3.37Å; L41-L168 WeakPolarHBondContact O-CA 3.41Å; Y88-L168 HydrophobicContact CE1-CD1 3.53Å; L168-T170 HydrophobicContact CD1-CG2 4.46Å; L168-T170 HydrophobicContact CD2-CG2 4.25Å; L168-T170 HydrophobicContact CG-CG2 4.05Å; L168-L200 HydrophobicContact CB-CD2 4.49Å; L168-D201 PolarHBondContact N-O 3.1Å; L168-L202 HydrophobicContact CB-CD1 4.46Å; L168-L202 HydrophobicContact CD2-CD1 3.97Å; L168-L202 HydrophobicContact CG-CD1 4.1Å; L168-M203 WeakPolarHBondContact O-CA 3.45Å; L168-M203 WeakPolarHBondContact O-CB 3.48Å; L168-M203 PolarHBondContact O-N 3.4Å; L168-Y217 HydrophobicContact CD2-CD1 4.22Å; L168-Y217 HydrophobicContact CD2-CE1 3.39Å
169	F	97.4	Very high	91.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	112.8	176.6	-62.9	-104.6	0	0	0	109.4	F40 L41 V42 D43 M167 M203 L242 V246	F40-F169 AromaticContact CD1-CE2 3.8Å; F40-F169 HydrophobicContact CD1-CE2 3.8Å; F40-F169 HydrophobicContact CD1-CZ 4.13Å; L41-F169 PolarHBondContact O-N 2.74Å; V42-F169 HydrophobicContact CG2-CB 4.4Å; V42-F169 HydrophobicContact CG2-CD2 4.35Å; D43-F169 VanDerWaalsContact CB-O 3.28Å; D43-F169 WeakPolarHBondContact CB-O 3.29Å; D43-F169 PolarHBondContact N-O 2.92Å; M167-F169 HydrophobicContact CB-CE2 3.72Å; M167-F169 HydrophobicContact CB-CZ 4.38Å; M167-F169 WeakPolarHBondContact O-CD2 3.47Å; F169-M203 HydrophobicContact CD1-CB 3.76Å; F169-M203 HydrophobicContact CD1-CG 4.25Å; F169-M203 HydrophobicContact CE1-CB 3.88Å; F169-M203 HydrophobicContact CE1-CG 3.88Å; F169-M203 HydrophobicContact CE2-CG 4.21Å; F169-M203 HydrophobicContact CG-CB 4.11Å; F169-M203 HydrophobicContact CZ-CB 4.28Å; F169-M203 HydrophobicContact CZ-CG 3.85Å; F169-L242 HydrophobicContact CD1-CD1 4.19Å; F169-L242 HydrophobicContact CD1-CD2 4.29Å; F169-L242 HydrophobicContact CE1-CD1 3.97Å; F169-L242 HydrophobicContact CE1-CD2 4.23Å; F169-L242 HydrophobicContact CE1-CG 4.31Å; F169-V246 HydrophobicContact CE1-CG2 3.8Å; F169-V246 HydrophobicContact CZ-CG2 3.74Å
170	T	96.9	Very high	91.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	150	-178.2	-180	0	0	0	0	110.8	D43 Y88 L168 E172 L202 H204 L205 F211 Y217	D43-T170 WeakPolarHBondContact OD2-CB 3.31Å; D43-T170 PolarHBondContact OD2-OG1 2.99Å; Y88-T170 WeakPolarHBondContact OH-CB 3.32Å; L168-T170 HydrophobicContact CD1-CG2 4.46Å; L168-T170 HydrophobicContact CD2-CG2 4.25Å; L168-T170 HydrophobicContact CG-CG2 4.05Å; T170-E172 PolarHBondContact OG1-N 2.77Å; T170-L202 HydrophobicContact CG2-CD1 3.75Å; T170-H204 WeakPolarHBondContact O-CA 3.49Å; T170-L205 PolarHBondContact O-N 2.94Å; T170-F211 HydrophobicContact CG2-CE2 4.48Å; T170-Y217 HydrophobicContact CG2-CE2 4.41Å
171	N	95.6	Very high	92.3	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.016	22%	0.218	C	C	.	.	S	Bend	trans	-108.2	11.9	167.4	72.4	-20.2	0	0	0	113	A47 M48 L205 K206 K207	A47-N171 PolarHBondContact O-ND2 2.64Å; M48-N171 WeakPolarHBondContact CG-OD1 3.14Å; M48-N171 HydrophobicContact SD-CB 4.08Å; M48-N171 PolarHBondContact SD-N 3.47Å; M48-N171 VanDerWaalsContact SD-N 3.4Å; M48-N171 PolarHBondContact SD-OD1 3.41Å; M48-N171 VanDerWaalsContact SD-OD1 3.38Å; N171-L205 HydrophobicContact CB-CB 3.96Å; N171-K206 WeakPolarHBondContact CB-O 3.38Å; N171-K207 WeakPolarHBondContact O-CB 3.44Å; N171-K207 WeakPolarHBondContact O-CD 3.49Å; N171-K207 WeakPolarHBondContact O-CG 3.35Å
172	E	95	Very high	92.8	Very high	47 Å²	47	35.7 Å²	35.7	22%	0.22	21%	0.212	C	C	.	.			trans	-102.9	118.1	175.4	-178.6	53.2	-105.1	0	0	109.7	T170 N174 P175 K207 Y217	T170-E172 PolarHBondContact OG1-N 2.77Å; E172-N174 PolarHBondContact OE1-N 3.31Å; E172-N174 VanDerWaalsContact OE1-N 3.12Å; E172-P175 HydrophobicContact CG-CB 4.33Å; E172-P175 HydrophobicContact CG-CG 4.04Å; E172-K207 IonicContact OE1-NZ 2.75Å; E172-K207 PolarHBondContact OE1-NZ 2.71Å; E172-K207 IonicContact OE2-NZ 3.58Å; E172-Y217 VanDerWaalsContact O-CE2 3.23Å; E172-Y217 WeakPolarHBondContact O-CE2 3.36Å
173	D	94.4	Very high	93.2	Very high	14 Å²	14	34.1 Å²	34.1	8%	0.075	20%	0.202	C	C	.	.	S	Bend	trans	-90.6	-21	-174.3	61.5	-12.9	0	0	0	113.5	K207 F211 D212 F216	D173-K207 IonicContact OD1-NZ 3.79Å; D173-K207 PolarHBondContact OD1-NZ 2.87Å; D173-F211 HydrophobicContact CB-CD1 3.95Å; D173-F211 HydrophobicContact CB-CD2 3.84Å; D173-F211 HydrophobicContact CB-CE1 3.87Å; D173-F211 HydrophobicContact CB-CE2 3.78Å; D173-F211 HydrophobicContact CB-CG 3.93Å; D173-F211 HydrophobicContact CB-CZ 3.79Å; D173-D212 PolarHBondContact OD2-N 3.18Å; D173-D212 VanDerWaalsContact OD2-N 3.09Å; D173-F216 WeakPolarHBondContact O-CB 3.42Å
174	N	94.3	Very high	93.7	Very high	58 Å²	58	35.3 Å²	35.3	31%	0.31	22%	0.215	S	C	.	.			trans	-135.8	69.9	175.4	-170.3	17.4	0	0	0	113.3	E172 H176 G177 L215	E172-N174 PolarHBondContact OE1-N 3.31Å; E172-N174 VanDerWaalsContact OE1-N 3.12Å; N174-H176 VanDerWaalsContact C-N 3.3Å; N174-H176 PolarHBondContact O-N 3.4Å; N174-H176 VanDerWaalsContact O-N 3.16Å; N174-G177 WeakPolarHBondContact ND2-CA 3.42Å; N174-G177 PolarHBondContact O-N 2.85Å; N174-G177 WeakPolarHBondContact OD1-CA 3.49Å; N174-G177 PolarHBondContact OD1-N 2.9Å; N174-L215 HydrophobicContact CB-CB 4.33Å; N174-L215 HydrophobicContact CB-CD1 4.35Å
175	P	91.6	Very high	93.9	Very high	18 Å²	18	38.3 Å²	38.3	12%	0.117	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-34.8	-172.3	-27.1	34.4	0	0	0	115.8	Y141 L143 E172 F216 Y217	Y141-P175 HydrophobicContact CE2-CB 4.06Å; L143-P175 HydrophobicContact CD1-CB 4.13Å; L143-P175 HydrophobicContact CD1-CG 3.98Å; E172-P175 HydrophobicContact CG-CB 4.33Å; E172-P175 HydrophobicContact CG-CG 4.04Å; P175-F216 HydrophobicContact CG-CD1 4.33Å; P175-F216 HydrophobicContact CG-CE1 4.3Å; P175-Y217 HydrophobicContact CG-CE2 4.08Å; P175-Y217 WeakPolarHBondContact CG-OH 3.39Å
176	H	93.1	Very high	94	Very high	5 Å²	5	36.6 Å²	36.6	2%	0.023	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.3	26.4	-173.9	-59.9	-63	0	0	0	112.2	Y141 L143 N174 N178 D179 K182 A183 F216	Y141-H176 AromaticContact CD2-CE1 3.89Å; Y141-H176 AromaticContact CE2-CE1 3.9Å; Y141-H176 AromaticContact CE2-NE2 3.88Å; Y141-H176 PolarHBondContact O-CE1 2.74Å; L143-H176 WeakPolarHBondContact CG-NE2 3.44Å; L143-H176 PolarHBondContact N-NE2 2.9Å; N174-H176 VanDerWaalsContact C-N 3.3Å; N174-H176 PolarHBondContact O-N 3.4Å; N174-H176 VanDerWaalsContact O-N 3.16Å; H176-N178 PolarHBondContact O-N 2.78Å; H176-N178 VanDerWaalsContact O-N 3.13Å; H176-D179 CarbonylContact O-C 3.58Å; H176-D179 PolarHBondContact O-N 2.85Å; H176-D179 VanDerWaalsContact O-O 3.12Å; H176-K182 HydrophobicContact CB-CB 4.09Å; H176-A183 HydrophobicContact CB-CB 3.86Å; H176-F216 AromaticContact CD2-CZ 3.96Å
177	G	88.1	Confident	93.9	Very high	51 Å²	51	40.9 Å²	40.9	53%	0.526	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-24.6	-178.9	0	0	0	0	0	114.2	N174	N174-G177 WeakPolarHBondContact ND2-CA 3.42Å; N174-G177 PolarHBondContact O-N 2.85Å; N174-G177 WeakPolarHBondContact OD1-CA 3.49Å; N174-G177 PolarHBondContact OD1-N 2.9Å
178	N	91.3	Very high	93.8	Very high	152 Å²	152	44.8 Å²	44.8	81%	0.813	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-14.2	177	58.6	5.8	0	0	0	114	H176	H176-N178 PolarHBondContact O-N 2.78Å; H176-N178 VanDerWaalsContact O-N 3.13Å
179	D	92.5	Very high	93.7	Very high	51 Å²	51	46.7 Å²	46.7	27%	0.273	27%	0.267	S	S	.	.			trans	-132.1	93.3	-176.9	-173	-23.7	0	0	0	110.7	H176 A181 K182 A183	H176-D179 CarbonylContact O-C 3.58Å; H176-D179 PolarHBondContact O-N 2.85Å; H176-D179 VanDerWaalsContact O-O 3.12Å; D179-A181 PolarHBondContact O-N 3.39Å; D179-A181 WeakPolarHBondContact OD1-CA 3.43Å; D179-A181 WeakPolarHBondContact OD1-CB 3.34Å; D179-A181 PolarHBondContact OD1-N 3.11Å; D179-K182 HydrophobicContact CB-CB 4.17Å; D179-K182 HydrophobicContact CB-CD 4.19Å; D179-K182 HydrophobicContact CB-CG 4.31Å; D179-K182 PolarHBondContact O-N 3.03Å; D179-K182 PolarHBondContact OD1-N 3.17Å; D179-K182 WeakPolarHBondContact OD2-CD 3.01Å; D179-K182 WeakPolarHBondContact OD2-CG 3.48Å; D179-A183 PolarHBondContact O-N 3.03Å
180	S	92.1	Very high	93.4	Very high	104 Å²	104	46.8 Å²	46.8	73%	0.727	27%	0.267	S	S	*	.	H	α-helix	trans	-59.4	-28.9	179.2	63.1	0	0	0	0	113.6	S184	S180-S184 WeakPolarHBondContact O-CB 3.17Å; S180-S184 PolarHBondContact O-N 3.03Å
181	A	94.4	Very high	93.2	Very high	50 Å²	50	47.5 Å²	47.5	41%	0.413	28%	0.275	S	S	.	.	H	α-helix	trans	-75.2	-39.1	-179.8	0	0	0	0	0	111.6	D179 R185	D179-A181 PolarHBondContact O-N 3.39Å; D179-A181 WeakPolarHBondContact OD1-CA 3.43Å; D179-A181 WeakPolarHBondContact OD1-CB 3.34Å; D179-A181 PolarHBondContact OD1-N 3.11Å; A181-R185 WeakPolarHBondContact O-CB 3.46Å; A181-R185 WeakPolarHBondContact O-CG 3.49Å; A181-R185 PolarHBondContact O-N 2.98Å; A181-R185 PolarHBondContact O-NE 3.23Å
182	K	93.6	Very high	93.1	Very high	25 Å²	25	50.9 Å²	50.9	11%	0.109	29%	0.292	C	S	.	.	H	α-helix	trans	-66.8	-42.5	170.9	-74.5	-180	-176.4	-174.2	0	111.3	D140 Y141 H176 D179 S184 R185 A186	D140-K182 IonicContact OD1-NZ 3.29Å; D140-K182 PolarHBondContact OD1-NZ 2.95Å; D140-K182 IonicContact OD2-NZ 3.78Å; D140-K182 PolarHBondContact OD2-NZ 2.79Å; Y141-K182 PolarHBondContact O-NZ 2.78Å; H176-K182 HydrophobicContact CB-CB 4.09Å; D179-K182 HydrophobicContact CB-CB 4.17Å; D179-K182 HydrophobicContact CB-CD 4.19Å; D179-K182 HydrophobicContact CB-CG 4.31Å; D179-K182 PolarHBondContact O-N 3.03Å; D179-K182 PolarHBondContact OD1-N 3.17Å; D179-K182 WeakPolarHBondContact OD2-CD 3.01Å; D179-K182 WeakPolarHBondContact OD2-CG 3.48Å; K182-S184 PolarHBondContact O-N 3.34Å; K182-R185 PolarHBondContact O-N 3.26Å; K182-A186 WeakPolarHBondContact O-CB 3.47Å; K182-A186 PolarHBondContact O-N 3.47Å
183	A	92.6	Very high	93	Very high	6 Å²	6	48.8 Å²	48.8	5%	0.05	28%	0.283	C	S	.	.	H	α-helix	trans	-60.1	-46.8	178.1	0	0	0	0	0	112.3	H176 D179 A186 R187 F216	H176-A183 HydrophobicContact CB-CB 3.86Å; D179-A183 PolarHBondContact O-N 3.03Å; A183-A186 PolarHBondContact O-N 3.11Å; A183-R187 WeakPolarHBondContact O-CG 3.47Å; A183-R187 PolarHBondContact O-N 3.46Å; A183-R187 VanDerWaalsContact O-N 3.11Å; A183-F216 HydrophobicContact CB-CE2 3.97Å
184	S	93.3	Very high	92.7	Very high	65 Å²	65	52.7 Å²	52.7	46%	0.455	30%	0.296	S	S	.	.	H	α-helix	trans	-63	-43.8	178.1	177.1	0	0	0	0	112.5	S180 K182 A186 R187 T188	S180-S184 WeakPolarHBondContact O-CB 3.17Å; S180-S184 PolarHBondContact O-N 3.03Å; K182-S184 PolarHBondContact O-N 3.34Å; S184-A186 PolarHBondContact O-N 3.42Å; S184-R187 PolarHBondContact O-N 3.21Å; S184-T188 PolarHBondContact O-N 2.78Å; S184-T188 PolarHBondContact O-OG1 2.89Å
185	R	94.4	Very high	92.4	Very high	117 Å²	117	56.7 Å²	56.7	44%	0.442	32%	0.318	S	S	.	.	H	α-helix	trans	-63	-39.9	176	-75.1	-176.2	-75.3	164.7	-6	112.5	A181 K182 T188 K189	A181-R185 WeakPolarHBondContact O-CB 3.46Å; A181-R185 WeakPolarHBondContact O-CG 3.49Å; A181-R185 PolarHBondContact O-N 2.98Å; A181-R185 PolarHBondContact O-NE 3.23Å; K182-R185 PolarHBondContact O-N 3.26Å; R185-T188 PolarHBondContact O-N 2.88Å; R185-K189 WeakPolarHBondContact O-CB 3.46Å; R185-K189 PolarHBondContact O-N 2.92Å
186	A	94.4	Very high	92.3	Very high	0 Å²	0	60 Å²	60	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-63.9	-45	178	0	0	0	0	0	112	L143 K182 A183 S184 T188 K189 A190 F216	L143-A186 HydrophobicContact CB-CB 3.8Å; K182-A186 WeakPolarHBondContact O-CB 3.47Å; K182-A186 PolarHBondContact O-N 3.47Å; A183-A186 PolarHBondContact O-N 3.11Å; S184-A186 PolarHBondContact O-N 3.42Å; A186-T188 PolarHBondContact O-N 2.9Å; A186-K189 PolarHBondContact O-N 3.11Å; A186-A190 WeakPolarHBondContact O-CB 3.39Å; A186-A190 PolarHBondContact O-N 3.34Å; A186-F216 HydrophobicContact CB-CZ 3.91Å
187	R	93.2	Very high	92.1	Very high	90 Å²	90	61.4 Å²	61.4	34%	0.34	35%	0.354	S	S	.	.	H	α-helix	trans	-61.6	-43.4	175.4	-67.7	-174.6	-168.3	104	0.7	112.1	A183 S184 A190 G191 D219	A183-R187 WeakPolarHBondContact O-CG 3.47Å; A183-R187 PolarHBondContact O-N 3.46Å; A183-R187 VanDerWaalsContact O-N 3.11Å; S184-R187 PolarHBondContact O-N 3.21Å; R187-A190 PolarHBondContact O-N 3.25Å; R187-G191 PolarHBondContact O-N 2.83Å; R187-D219 HydrophobicContact CG-CB 4.39Å; R187-D219 IonicContact NE-OD2 2.67Å
188	T	94.6	Very high	92.2	Very high	82 Å²	82	59.2 Å²	59.2	50%	0.503	33%	0.33	S	S	.	.	H	α-helix	trans	-60.1	-49.1	177.1	-52.5	0	0	0	0	110.3	S184 R185 A186 A190 G191 D192	S184-T188 PolarHBondContact O-N 2.78Å; S184-T188 PolarHBondContact O-OG1 2.89Å; R185-T188 PolarHBondContact O-N 2.88Å; A186-T188 PolarHBondContact O-N 2.9Å; T188-A190 VanDerWaalsContact C-N 3.33Å; T188-A190 PolarHBondContact O-N 3.33Å; T188-G191 WeakPolarHBondContact O-CA 3.43Å; T188-G191 PolarHBondContact O-N 3.07Å; T188-D192 PolarHBondContact O-N 3.44Å
189	K	94.3	Very high	92.2	Very high	43 Å²	43	55.4 Å²	55.4	19%	0.187	31%	0.306	C	S	.	.	H	α-helix	trans	-64.7	-36.4	-179.6	-171	57.6	177.7	170.3	0	112.9	L147 R185 A186 G191 D192 L193	L147-K189 HydrophobicContact CB-CG 3.9Å; R185-K189 WeakPolarHBondContact O-CB 3.46Å; R185-K189 PolarHBondContact O-N 2.92Å; A186-K189 PolarHBondContact O-N 3.11Å; K189-G191 VanDerWaalsContact C-N 3.32Å; K189-D192 HydrophobicContact CD-CB 4.44Å; K189-D192 PolarHBondContact O-N 2.89Å; K189-L193 WeakPolarHBondContact O-CG 3.28Å; K189-L193 PolarHBondContact O-N 2.93Å
190	A	92.7	Very high	92.1	Very high	2 Å²	2	53.2 Å²	53.2	2%	0.017	29%	0.294	C	S	.	.	H	α-helix	trans	-64.7	-36.2	173.4	0	0	0	0	0	112.2	L147 A186 R187 T188 L193 R194 I220	L147-A190 HydrophobicContact CD1-CB 4.09Å; A186-A190 WeakPolarHBondContact O-CB 3.39Å; A186-A190 PolarHBondContact O-N 3.34Å; R187-A190 PolarHBondContact O-N 3.25Å; T188-A190 VanDerWaalsContact C-N 3.33Å; T188-A190 PolarHBondContact O-N 3.33Å; A190-L193 PolarHBondContact O-N 2.98Å; A190-R194 PolarHBondContact O-N 3Å; A190-I220 HydrophobicContact CB-CB 4.15Å; A190-I220 HydrophobicContact CB-CG1 4Å; A190-I220 HydrophobicContact CB-CG2 3.9Å
191	G	91.8	Very high	92.1	Very high	15 Å²	15	48.7 Å²	48.7	16%	0.155	26%	0.262	C	S	.	.	H	α-helix	trans	-57.6	-52.9	168.8	0	0	0	0	0	111.9	R187 T188 K189 L193 R194 D195	R187-G191 PolarHBondContact O-N 2.83Å; T188-G191 WeakPolarHBondContact O-CA 3.43Å; T188-G191 PolarHBondContact O-N 3.07Å; K189-G191 VanDerWaalsContact C-N 3.32Å; G191-L193 PolarHBondContact O-N 3.49Å; G191-R194 WeakPolarHBondContact O-CB 3.42Å; G191-R194 PolarHBondContact O-N 3Å; G191-D195 PolarHBondContact O-N 2.82Å
192	D	93.3	Very high	92.1	Very high	73 Å²	73	46.9 Å²	46.9	39%	0.39	25%	0.245	S	C	.	.	H	α-helix	trans	-56.8	-37.3	178.6	-56.2	-21.4	0	0	0	112.5	T188 K189 D195 T196	T188-D192 PolarHBondContact O-N 3.44Å; K189-D192 HydrophobicContact CD-CB 4.44Å; K189-D192 PolarHBondContact O-N 2.89Å; D192-D195 PolarHBondContact O-N 3.17Å; D192-T196 WeakPolarHBondContact O-CB 3.47Å; D192-T196 PolarHBondContact O-N 3.01Å; D192-T196 PolarHBondContact O-OG1 3.23Å
193	L	92	Very high	92.2	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.016	24%	0.241	C	C	.	.	H	α-helix	trans	-62.7	-44.5	176.3	-73.3	-176.7	0	0	0	111.8	L147 A151 I166 K189 A190 G191 T196 G197 I198	L147-L193 HydrophobicContact CB-CD1 3.95Å; L147-L193 HydrophobicContact CD1-CD1 4.17Å; L147-L193 HydrophobicContact CD2-CD1 3.86Å; L147-L193 HydrophobicContact CG-CD1 4.2Å; A151-L193 HydrophobicContact CB-CD2 3.67Å; I166-L193 HydrophobicContact CD1-CD1 4.06Å; K189-L193 WeakPolarHBondContact O-CG 3.28Å; K189-L193 PolarHBondContact O-N 2.93Å; A190-L193 PolarHBondContact O-N 2.98Å; G191-L193 PolarHBondContact O-N 3.49Å; L193-T196 CarbonylContact O-C 3Å; L193-T196 PolarHBondContact O-N 3.07Å; L193-G197 PolarHBondContact O-N 2.89Å; L193-I198 HydrophobicContact CB-CB 4.23Å; L193-I198 HydrophobicContact CD2-CB 4.3Å; L193-I198 HydrophobicContact CD2-CD1 3.64Å; L193-I198 HydrophobicContact CD2-CG2 4.36Å; L193-I198 WeakPolarHBondContact O-CB 3.37Å; L193-I198 PolarHBondContact O-N 3.04Å
194	R	88.6	Confident	92.2	Very high	96 Å²	96	46 Å²	46	36%	0.362	24%	0.241	S	C	.	.	H	α-helix	trans	-62.7	-44.3	177.7	-71	-172.7	-66.4	-121.3	-3.1	111.2	A190 G191 T196 G197 D219 I220 I221	A190-R194 PolarHBondContact O-N 3Å; G191-R194 WeakPolarHBondContact O-CB 3.42Å; G191-R194 PolarHBondContact O-N 3Å; R194-T196 PolarHBondContact O-N 3.31Å; R194-G197 WeakPolarHBondContact O-CA 3.26Å; R194-G197 PolarHBondContact O-N 3.43Å; R194-D219 PolarHBondContact NH1-O 2.86Å; R194-D219 PolarHBondContact NH2-O 2.76Å; R194-D219 VanDerWaalsContact NH2-O 3.11Å; R194-I220 PolarHBondContact NH1-O 3.02Å; R194-I221 PolarHBondContact NH1-O 2.94Å
195	D	89.4	Confident	92.3	Very high	143 Å²	143	43 Å²	43	77%	0.765	22%	0.219	S	C	*	.	H	α-helix	trans	-64	-29.6	177.5	-63.3	-20.2	0	0	0	112	G191 D192 G197	G191-D195 PolarHBondContact O-N 2.82Å; D192-D195 PolarHBondContact O-N 3.17Å; D195-G197 PolarHBondContact O-N 3.36Å
196	T	89.6	Confident	92.2	Very high	86 Å²	86	40.6 Å²	40.6	53%	0.528	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-4.7	173.8	-51.5	0	0	0	0	112.9	D192 L193 R194 I198	D192-T196 WeakPolarHBondContact O-CB 3.47Å; D192-T196 PolarHBondContact O-N 3.01Å; D192-T196 PolarHBondContact O-OG1 3.23Å; L193-T196 CarbonylContact O-C 3Å; L193-T196 PolarHBondContact O-N 3.07Å; R194-T196 PolarHBondContact O-N 3.31Å; T196-I198 HydrophobicContact CG2-CD1 4.12Å; T196-I198 HydrophobicContact CG2-CG1 4.41Å
197	G	87.2	Confident	92.1	Very high	35 Å²	35	42.9 Å²	42.9	36%	0.361	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.4	21.8	-177	0	0	0	0	0	114.3	L193 R194 D195 F199	L193-G197 PolarHBondContact O-N 2.89Å; R194-G197 WeakPolarHBondContact O-CA 3.26Å; R194-G197 PolarHBondContact O-N 3.43Å; D195-G197 PolarHBondContact O-N 3.36Å; G197-F199 WeakPolarHBondContact O-CD2 3.36Å; G197-F199 WeakPolarHBondContact O-CE2 3.46Å
198	I	91.3	Very high	91.8	Very high	5 Å²	5	43.5 Å²	43.5	3%	0.026	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	124.8	173.5	-61.2	167.2	0	0	0	108.7	A151 F154 K164 I166 L193 T196	A151-I198 HydrophobicContact CB-CD1 4.37Å; F154-I198 HydrophobicContact CD2-CD1 3.8Å; F154-I198 HydrophobicContact CD2-CG1 4.19Å; F154-I198 HydrophobicContact CD2-CG2 4.37Å; F154-I198 HydrophobicContact CE2-CD1 4.28Å; F154-I198 HydrophobicContact CE2-CG1 4.37Å; F154-I198 HydrophobicContact CE2-CG2 3.76Å; F154-I198 HydrophobicContact CZ-CG2 4.46Å; K164-I198 HydrophobicContact CB-CB 4.35Å; K164-I198 HydrophobicContact CB-CG1 3.8Å; K164-I198 HydrophobicContact CB-CG2 4.43Å; K164-I198 HydrophobicContact CD-CD1 4.4Å; K164-I198 HydrophobicContact CD-CG1 3.75Å; K164-I198 HydrophobicContact CG-CG1 4.44Å; I166-I198 HydrophobicContact CD1-CG2 3.78Å; I166-I198 HydrophobicContact CG1-CG2 3.98Å; L193-I198 HydrophobicContact CB-CB 4.23Å; L193-I198 HydrophobicContact CD2-CB 4.3Å; L193-I198 HydrophobicContact CD2-CD1 3.64Å; L193-I198 HydrophobicContact CD2-CG2 4.36Å; L193-I198 WeakPolarHBondContact O-CB 3.37Å; L193-I198 PolarHBondContact O-N 3.04Å; T196-I198 HydrophobicContact CG2-CD1 4.12Å; T196-I198 HydrophobicContact CG2-CG1 4.41Å
199	F	90.4	Very high	91.4	Very high	73 Å²	73	44 Å²	44	32%	0.32	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	128.3	-178.1	-65.5	-100.4	0	0	0	110	K164 R165 I166 G197 R252	K164-F199 PolarHBondContact O-N 3.32Å; R165-F199 CarbonylContact C-O 3.5Å; R165-F199 VanDerWaalsContact CA-O 3.28Å; R165-F199 WeakPolarHBondContact CA-O 3.37Å; R165-F199 HydrophobicContact CG-CB 4.28Å; I166-F199 PolarHBondContact N-O 3.45Å; G197-F199 WeakPolarHBondContact O-CD2 3.36Å; G197-F199 WeakPolarHBondContact O-CE2 3.46Å; F199-R252 VanDerWaalsContact CE2-NH2 3.35Å
200	L	91.8	Very high	91.3	Very high	4 Å²	4	43.2 Å²	43.2	2%	0.021	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	115.5	175.8	-166.9	164.5	0	0	0	109.7	L147 I166 L168 I220 I221 S222	L147-L200 HydrophobicContact CD1-CD1 4.29Å; L147-L200 HydrophobicContact CD2-CD1 3.55Å; I166-L200 WeakPolarHBondContact O-CA 3.44Å; L168-L200 HydrophobicContact CB-CD2 4.49Å; L200-I220 HydrophobicContact CD1-CG2 3.65Å; L200-I220 HydrophobicContact CD2-CG2 4.02Å; L200-I220 HydrophobicContact CG-CG2 4.46Å; L200-I221 HydrophobicContact CD2-CG2 4.37Å; L200-S222 PolarHBondContact N-OG 3.29Å; L200-S222 PolarHBondContact O-N 3.28Å
201	D	91.9	Very high	91.3	Very high	9 Å²	9	44.2 Å²	44.2	5%	0.048	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	132.5	173.2	-66.9	-67.9	0	0	0	111.3	R165 I166 M167 L168 M203 K249	R165-D201 WeakPolarHBondContact CD-OD2 3.38Å; R165-D201 WeakPolarHBondContact CG-OD2 3.14Å; R165-D201 IonicContact CZ-OD2 3.62Å; R165-D201 IonicContact NE-OD2 3.8Å; R165-D201 IonicContact NH1-OD1 2.78Å; R165-D201 IonicContact NH1-OD2 2.68Å; R165-D201 PolarHBondContact NH1-OD2 3.15Å; I166-D201 PolarHBondContact O-N 3.47Å; M167-D201 WeakPolarHBondContact CA-O 3.48Å; M167-D201 HydrophobicContact CG-CB 4.31Å; L168-D201 PolarHBondContact N-O 3.1Å; D201-M203 HydrophobicContact CB-CE 3.67Å; D201-K249 HydrophobicContact CB-CD 4.15Å; D201-K249 WeakPolarHBondContact OD1-CD 3.34Å; D201-K249 IonicContact OD1-NZ 3.21Å; D201-K249 PolarHBondContact OD1-NZ 3.31Å
202	L	93.7	Very high	91.3	Very high	12 Å²	12	46.9 Å²	46.9	6%	0.063	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	125	173	-178.6	66.7	0	0	0	110.4	L168 T170 H204 F211 Y217 I221	L168-L202 HydrophobicContact CB-CD1 4.46Å; L168-L202 HydrophobicContact CD2-CD1 3.97Å; L168-L202 HydrophobicContact CG-CD1 4.1Å; T170-L202 HydrophobicContact CG2-CD1 3.75Å; L202-H204 HydrophobicContact CD1-CB 4.35Å; L202-H204 HydrophobicContact CD2-CB 3.96Å; L202-H204 HydrophobicContact CG-CB 3.89Å; L202-F211 HydrophobicContact CD1-CZ 4.48Å; L202-F211 HydrophobicContact CD2-CE1 3.78Å; L202-F211 HydrophobicContact CD2-CZ 3.99Å; L202-Y217 HydrophobicContact CD1-CD1 4.19Å; L202-Y217 HydrophobicContact CD1-CE1 4.28Å; L202-Y217 HydrophobicContact CD1-CG 4.31Å; L202-Y217 HydrophobicContact CD2-CD1 4.38Å; L202-Y217 HydrophobicContact CD2-CD2 4.14Å; L202-Y217 HydrophobicContact CD2-CG 3.82Å; L202-I221 HydrophobicContact CB-CG2 3.58Å; L202-I221 HydrophobicContact CD2-CG2 4.46Å
203	M	95.1	Very high	91.2	Very high	3 Å²	3	44.7 Å²	44.7	2%	0.015	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	73.9	167	-60.6	-55.4	119	0	0	107.9	L168 F169 D201 L242 K245 V246 K249	L168-M203 WeakPolarHBondContact O-CA 3.45Å; L168-M203 WeakPolarHBondContact O-CB 3.48Å; L168-M203 PolarHBondContact O-N 3.4Å; F169-M203 HydrophobicContact CD1-CB 3.76Å; F169-M203 HydrophobicContact CD1-CG 4.25Å; F169-M203 HydrophobicContact CE1-CB 3.88Å; F169-M203 HydrophobicContact CE1-CG 3.88Å; F169-M203 HydrophobicContact CE2-CG 4.21Å; F169-M203 HydrophobicContact CG-CB 4.11Å; F169-M203 HydrophobicContact CZ-CB 4.28Å; F169-M203 HydrophobicContact CZ-CG 3.85Å; D201-M203 HydrophobicContact CB-CE 3.67Å; M203-L242 HydrophobicContact CB-CD1 4.04Å; M203-K245 HydrophobicContact SD-CB 4.37Å; M203-V246 HydrophobicContact CG-CG2 3.94Å; M203-V246 HydrophobicContact SD-CG2 3.77Å; M203-K249 HydrophobicContact CE-CD 3.68Å
204	H	93.9	Very high	91.1	Very high	11 Å²	11	47.9 Å²	47.9	5%	0.051	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	130.4	-176.5	52.3	94.1	0	0	0	111.5	T170 L202 F211 F233 E234 E235 S236	T170-H204 WeakPolarHBondContact O-CA 3.49Å; L202-H204 HydrophobicContact CD1-CB 4.35Å; L202-H204 HydrophobicContact CD2-CB 3.96Å; L202-H204 HydrophobicContact CG-CB 3.89Å; H204-F211 HydrophobicContact CB-CD1 3.57Å; H204-F211 HydrophobicContact CB-CD2 3.71Å; H204-F211 HydrophobicContact CB-CE1 3.49Å; H204-F211 VanDerWaalsContact CB-CE1 3.49Å; H204-F211 HydrophobicContact CB-CE2 3.6Å; H204-F211 HydrophobicContact CB-CG 3.7Å; H204-F211 HydrophobicContact CB-CZ 3.5Å; H204-F211 VanDerWaalsContact CB-CZ 3.5Å; H204-F211 AromaticContact CG-CD1 3.76Å; H204-F211 AromaticContact CG-CE1 3.95Å; H204-F211 AromaticContact ND1-CD1 3.9Å; H204-F233 PolarHBondContact CE1-O 3.16Å; H204-F233 PolarHBondContact NE2-O 3.48Å; H204-F233 VanDerWaalsContact NE2-O 3.07Å; H204-E234 PolarHBondContact CE1-O 2.9Å; H204-E235 PolarHBondContact CE1-N 3.3Å; H204-E235 WeakPolarHBondContact ND1-CA 3.43Å; H204-S236 PolarHBondContact O-N 3.08Å
205	L	93.8	Very high	91.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-101.6	156.2	-175.9	-56.5	170.8	0	0	0	109.4	M48 P59 S63 T170 N171 K207 L242	M48-L205 HydrophobicContact CE-CD1 3.69Å; M48-L205 HydrophobicContact SD-CD1 3.97Å; P59-L205 HydrophobicContact CB-CB 4.16Å; P59-L205 HydrophobicContact CB-CD1 3.59Å; P59-L205 HydrophobicContact CB-CG 4.47Å; P59-L205 WeakPolarHBondContact O-CD1 3.36Å; S63-L205 WeakPolarHBondContact OG-CD1 3.29Å; T170-L205 PolarHBondContact O-N 2.94Å; N171-L205 HydrophobicContact CB-CB 3.96Å; L205-K207 PolarHBondContact O-N 3.24Å; L205-L242 HydrophobicContact CD2-CD1 3.88Å; L205-L242 HydrophobicContact CD2-CD2 3.87Å; L205-L242 HydrophobicContact CD2-CG 4.44Å
206	K	93.6	Very high	91.5	Very high	68 Å²	68	40.4 Å²	40.4	30%	0.296	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-52	136.5	-178.6	-163.9	-175	178.2	178	0	111.5	Q52 N171 S236	Q52-K206 PolarHBondContact NE2-O 3.06Å; N171-K206 WeakPolarHBondContact CB-O 3.38Å; K206-S236 PolarHBondContact N-O 3.11Å
207	K	91.4	Very high	91.6	Very high	47 Å²	47	36.4 Å²	36.4	20%	0.204	23%	0.231	C	C	.	.			trans	-127	146.7	174.5	-174	-176.4	-179.2	171	0	109.5	N171 E172 D173 L205 G209 G210	N171-K207 WeakPolarHBondContact O-CB 3.44Å; N171-K207 WeakPolarHBondContact O-CD 3.49Å; N171-K207 WeakPolarHBondContact O-CG 3.35Å; E172-K207 IonicContact OE1-NZ 2.75Å; E172-K207 PolarHBondContact OE1-NZ 2.71Å; E172-K207 IonicContact OE2-NZ 3.58Å; D173-K207 IonicContact OD1-NZ 3.79Å; D173-K207 PolarHBondContact OD1-NZ 2.87Å; L205-K207 PolarHBondContact O-N 3.24Å; K207-G209 PolarHBondContact O-N 3.15Å; K207-G209 VanDerWaalsContact O-N 3.13Å; K207-G210 PolarHBondContact O-N 2.81Å
208	P	87.5	Confident	91.8	Very high	104 Å²	104	42.3 Å²	42.3	68%	0.675	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	118.4	170.2	25.3	-35.2	0	0	0	110.4
209	G	87.2	Confident	91.6	Very high	91 Å²	91	46 Å²	46	94%	0.938	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.2	-1.9	-174.4	0	0	0	0	0	114.8	K207	K207-G209 PolarHBondContact O-N 3.15Å; K207-G209 VanDerWaalsContact O-N 3.13Å
210	G	90.8	Very high	91.5	Very high	28 Å²	28	42.7 Å²	42.7	29%	0.289	25%	0.248	S	C	.	.			trans	88.4	166.2	-177	0	0	0	0	0	113	K207 E235	K207-G210 PolarHBondContact O-N 2.81Å; G210-E235 WeakPolarHBondContact CA-OE2 3.31Å
211	F	93.4	Very high	91.2	Very high	22 Å²	22	43.1 Å²	43.1	10%	0.096	25%	0.25	C	C	.	.			trans	-105	112.5	177	-168.8	-75.2	0	0	0	111.3	T170 D173 L202 H204 I213 Y217 E235	T170-F211 HydrophobicContact CG2-CE2 4.48Å; D173-F211 HydrophobicContact CB-CD1 3.95Å; D173-F211 HydrophobicContact CB-CD2 3.84Å; D173-F211 HydrophobicContact CB-CE1 3.87Å; D173-F211 HydrophobicContact CB-CE2 3.78Å; D173-F211 HydrophobicContact CB-CG 3.93Å; D173-F211 HydrophobicContact CB-CZ 3.79Å; L202-F211 HydrophobicContact CD1-CZ 4.48Å; L202-F211 HydrophobicContact CD2-CE1 3.78Å; L202-F211 HydrophobicContact CD2-CZ 3.99Å; H204-F211 HydrophobicContact CB-CD1 3.57Å; H204-F211 HydrophobicContact CB-CD2 3.71Å; H204-F211 HydrophobicContact CB-CE1 3.49Å; H204-F211 VanDerWaalsContact CB-CE1 3.49Å; H204-F211 HydrophobicContact CB-CE2 3.6Å; H204-F211 HydrophobicContact CB-CG 3.7Å; H204-F211 HydrophobicContact CB-CZ 3.5Å; H204-F211 VanDerWaalsContact CB-CZ 3.5Å; H204-F211 AromaticContact CG-CD1 3.76Å; H204-F211 AromaticContact CG-CE1 3.95Å; H204-F211 AromaticContact ND1-CD1 3.9Å; F211-I213 HydrophobicContact CD1-CG1 4Å; F211-I213 HydrophobicContact CE1-CG1 4.09Å; F211-Y217 HydrophobicContact CE1-CD2 4.21Å; F211-Y217 AromaticContact CZ-CD2 3.84Å; F211-Y217 HydrophobicContact CZ-CD2 3.84Å; F211-Y217 AromaticContact CZ-CE2 3.95Å; F211-Y217 HydrophobicContact CZ-CE2 3.95Å; F211-E235 HydrophobicContact CB-CB 4.31Å; F211-E235 WeakPolarHBondContact CB-OE2 3.47Å; F211-E235 PolarHBondContact N-OE2 3.3Å
212	D	91.9	Very high	90.6	Very high	72 Å²	72	43.9 Å²	43.9	39%	0.385	26%	0.256	S	S	.	.			trans	-97.6	101.1	179.6	-171.5	-9.6	0	0	0	112.4	D173 S214 L215	D173-D212 PolarHBondContact OD2-N 3.18Å; D173-D212 VanDerWaalsContact OD2-N 3.09Å; D212-S214 VanDerWaalsContact CG-OG 3.31Å; D212-S214 PolarHBondContact O-N 3.31Å; D212-S214 VanDerWaalsContact OD1-CB 3.23Å; D212-S214 WeakPolarHBondContact OD1-CB 3.23Å; D212-S214 PolarHBondContact OD1-N 3.28Å; D212-S214 PolarHBondContact OD1-OG 3.37Å; D212-S214 PolarHBondContact OD2-OG 3.42Å; D212-L215 HydrophobicContact CB-CD1 3.86Å; D212-L215 HydrophobicContact CB-CG 3.85Å; D212-L215 PolarHBondContact O-N 3.26Å
213	I	91.3	Very high	89.5	Confident	27 Å²	27	48.1 Å²	48.1	14%	0.138	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-60.2	-29.6	178.8	-54.6	173.7	0	0	0	111.7	F211 L215 Y217 R218 I221 H232	F211-I213 HydrophobicContact CD1-CG1 4Å; F211-I213 HydrophobicContact CE1-CG1 4.09Å; I213-L215 PolarHBondContact O-N 2.94Å; I213-Y217 PolarHBondContact O-N 2.94Å; I213-R218 PolarHBondContact O-N 2.87Å; I213-I221 HydrophobicContact CG2-CD1 4.25Å; I213-H232 HydrophobicContact CD1-CB 3.74Å
214	S	90.4	Very high	87.9	Confident	70 Å²	70	50.5 Å²	50.5	49%	0.49	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-69.6	-20.4	-173	77.9	0	0	0	0	113.6	D212	D212-S214 VanDerWaalsContact CG-OG 3.31Å; D212-S214 PolarHBondContact O-N 3.31Å; D212-S214 VanDerWaalsContact OD1-CB 3.23Å; D212-S214 WeakPolarHBondContact OD1-CB 3.23Å; D212-S214 PolarHBondContact OD1-N 3.28Å; D212-S214 PolarHBondContact OD1-OG 3.37Å; D212-S214 PolarHBondContact OD2-OG 3.42Å
215	L	91.9	Very high	85.9	Confident	81 Å²	81	59.4 Å²	59.4	42%	0.424	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-69.1	-39.3	-177.5	-60.8	-179.6	0	0	0	113	N174 D212 I213	N174-L215 HydrophobicContact CB-CB 4.33Å; N174-L215 HydrophobicContact CB-CD1 4.35Å; D212-L215 HydrophobicContact CB-CD1 3.86Å; D212-L215 HydrophobicContact CB-CG 3.85Å; D212-L215 PolarHBondContact O-N 3.26Å; I213-L215 PolarHBondContact O-N 2.94Å
216	F	93	Very high	83.7	Confident	1 Å²	1	67 Å²	67	0%	0.004	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-146.8	-53.4	-171.5	-175.8	-104	0	0	0	113.8	L143 D173 P175 H176 A183 A186 R218 I220	L143-F216 HydrophobicContact CD1-CE1 3.48Å; L143-F216 VanDerWaalsContact CD1-CE1 3.48Å; L143-F216 HydrophobicContact CD1-CZ 3.92Å; D173-F216 WeakPolarHBondContact O-CB 3.42Å; P175-F216 HydrophobicContact CG-CD1 4.33Å; P175-F216 HydrophobicContact CG-CE1 4.3Å; H176-F216 AromaticContact CD2-CZ 3.96Å; A183-F216 HydrophobicContact CB-CE2 3.97Å; A186-F216 HydrophobicContact CB-CZ 3.91Å; F216-R218 VanDerWaalsContact C-N 3.32Å; F216-R218 PolarHBondContact O-N 2.73Å; F216-I220 HydrophobicContact CD1-CD1 3.58Å; F216-I220 HydrophobicContact CE1-CD1 3.05Å; F216-I220 HydrophobicContact CE2-CD1 4.21Å; F216-I220 HydrophobicContact CG-CD1 4.35Å; F216-I220 HydrophobicContact CZ-CD1 3.41Å; F216-I220 VanDerWaalsContact CZ-CD1 3.41Å
217	Y	92.9	Very high	81.5	Confident	1 Å²	1	67.7 Å²	67.7	0%	0.004	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-74.7	-16.8	-169.4	-73.1	-75.9	0	0	0	115.3	L143 L168 T170 E172 P175 L202 F211 I213 D219 I220 I221	L143-Y217 HydrophobicContact CD1-CE1 4.44Å; L168-Y217 HydrophobicContact CD2-CD1 4.22Å; L168-Y217 HydrophobicContact CD2-CE1 3.39Å; T170-Y217 HydrophobicContact CG2-CE2 4.41Å; E172-Y217 VanDerWaalsContact O-CE2 3.23Å; E172-Y217 WeakPolarHBondContact O-CE2 3.36Å; P175-Y217 HydrophobicContact CG-CE2 4.08Å; P175-Y217 WeakPolarHBondContact CG-OH 3.39Å; L202-Y217 HydrophobicContact CD1-CD1 4.19Å; L202-Y217 HydrophobicContact CD1-CE1 4.28Å; L202-Y217 HydrophobicContact CD1-CG 4.31Å; L202-Y217 HydrophobicContact CD2-CD1 4.38Å; L202-Y217 HydrophobicContact CD2-CD2 4.14Å; L202-Y217 HydrophobicContact CD2-CG 3.82Å; F211-Y217 HydrophobicContact CE1-CD2 4.21Å; F211-Y217 AromaticContact CZ-CD2 3.84Å; F211-Y217 HydrophobicContact CZ-CD2 3.84Å; F211-Y217 AromaticContact CZ-CE2 3.95Å; F211-Y217 HydrophobicContact CZ-CE2 3.95Å; I213-Y217 PolarHBondContact O-N 2.94Å; Y217-D219 PolarHBondContact O-N 3.12Å; Y217-D219 VanDerWaalsContact O-N 3.17Å; Y217-I220 HydrophobicContact CD1-CB 4.32Å; Y217-I220 HydrophobicContact CD1-CD1 4.17Å; Y217-I220 HydrophobicContact CD1-CG2 4.24Å; Y217-I220 HydrophobicContact CE1-CD1 4.5Å; Y217-I220 PolarHBondContact O-N 2.74Å; Y217-I221 WeakPolarHBondContact O-CG1 3.1Å; Y217-I221 PolarHBondContact O-N 3.19Å
218	R	89.9	Confident	79.2	Confident	160 Å²	160	73.7 Å²	73.7	60%	0.604	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-49.8	-39.1	173.7	179.7	-179.5	175.2	-177	-1.9	113	I213 F216 I220	I213-R218 PolarHBondContact O-N 2.87Å; F216-R218 VanDerWaalsContact C-N 3.32Å; F216-R218 PolarHBondContact O-N 2.73Å; R218-I220 VanDerWaalsContact C-N 3.34Å
219	D	86.8	Confident	77.2	Confident	82 Å²	82	71.4 Å²	71.4	44%	0.439	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-86.8	-6.2	-178.6	-59.5	-32.6	0	0	0	113.1	R187 R194 Y217	R187-D219 HydrophobicContact CG-CB 4.39Å; R187-D219 IonicContact NE-OD2 2.67Å; R194-D219 PolarHBondContact NH1-O 2.86Å; R194-D219 PolarHBondContact NH2-O 2.76Å; R194-D219 VanDerWaalsContact NH2-O 3.11Å; Y217-D219 PolarHBondContact O-N 3.12Å; Y217-D219 VanDerWaalsContact O-N 3.17Å
220	I	88.6	Confident	75.5	Confident	3 Å²	3	78.2 Å²	78.2	2%	0.015	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-43.6	-172.7	-70	174	0	0	0	111.8	A190 R194 L200 F216 Y217 R218	A190-I220 HydrophobicContact CB-CB 4.15Å; A190-I220 HydrophobicContact CB-CG1 4Å; A190-I220 HydrophobicContact CB-CG2 3.9Å; R194-I220 PolarHBondContact NH1-O 3.02Å; L200-I220 HydrophobicContact CD1-CG2 3.65Å; L200-I220 HydrophobicContact CD2-CG2 4.02Å; L200-I220 HydrophobicContact CG-CG2 4.46Å; F216-I220 HydrophobicContact CD1-CD1 3.58Å; F216-I220 HydrophobicContact CE1-CD1 3.05Å; F216-I220 HydrophobicContact CE2-CD1 4.21Å; F216-I220 HydrophobicContact CG-CD1 4.35Å; F216-I220 HydrophobicContact CZ-CD1 3.41Å; F216-I220 VanDerWaalsContact CZ-CD1 3.41Å; Y217-I220 HydrophobicContact CD1-CB 4.32Å; Y217-I220 HydrophobicContact CD1-CD1 4.17Å; Y217-I220 HydrophobicContact CD1-CG2 4.24Å; Y217-I220 HydrophobicContact CE1-CD1 4.5Å; Y217-I220 PolarHBondContact O-N 2.74Å; R218-I220 VanDerWaalsContact C-N 3.34Å
221	I	87.3	Confident	74.1	Confident	13 Å²	13	79.9 Å²	79.9	7%	0.067	40%	0.402	C	S	.	.	S	Bend	trans	-61.8	148.6	-179.1	61.2	-173.3	0	0	0	111.3	R194 L200 L202 I213 Y217 I223 H232	R194-I221 PolarHBondContact NH1-O 2.94Å; L200-I221 HydrophobicContact CD2-CG2 4.37Å; L202-I221 HydrophobicContact CB-CG2 3.58Å; L202-I221 HydrophobicContact CD2-CG2 4.46Å; I213-I221 HydrophobicContact CG2-CD1 4.25Å; Y217-I221 WeakPolarHBondContact O-CG1 3.1Å; Y217-I221 PolarHBondContact O-N 3.19Å; I221-I223 HydrophobicContact CG1-CG1 4.36Å; I221-I223 PolarHBondContact O-N 2.86Å; I221-H232 WeakPolarHBondContact CD1-CE1 3.29Å
222	S	79.2	Confident	73.1	Confident	25 Å²	25	82.3 Å²	82.3	18%	0.175	41%	0.414	C	S	.	.			trans	-84.5	109.6	176.8	-57.9	0	0	0	0	109.7	L200	L200-S222 PolarHBondContact N-OG 3.29Å; L200-S222 PolarHBondContact O-N 3.28Å
223	I	69.8	Low	72.8	Confident	102 Å²	102	80.5 Å²	80.5	52%	0.523	40%	0.403	S	S	.	.			trans	-92.7	124.8	173.2	-51.7	172.1	0	0	0	106.5	I221 E225	I221-I223 HydrophobicContact CG1-CG1 4.36Å; I221-I223 PolarHBondContact O-N 2.86Å; I223-E225 PolarHBondContact O-N 2.97Å
224	A	61.6	Low	72.7	Confident	53 Å²	53	83.7 Å²	83.7	44%	0.438	42%	0.417	S	S	.	.			trans	-68.3	127.4	172.1	0	0	0	0	0	108.7	D226	A224-D226 PolarHBondContact O-N 3.17Å
225	E	51.9	Low	72.6	Confident	197 Å²	197	82.7 Å²	82.7	92%	0.921	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-19.4	-174.6	-62.8	-178.4	165.1	0	0	113.4	I223	I223-E225 PolarHBondContact O-N 2.97Å
226	D	47.9	Very low	72.6	Confident	161 Å²	161	79 Å²	79	86%	0.861	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	-3	-172	-70.2	-36.6	0	0	0	115.2	A224	A224-D226 PolarHBondContact O-N 3.17Å
227	E	47.1	Very low	72.4	Confident	81 Å²	81	80.2 Å²	80.2	38%	0.379	39%	0.394	S	S	.	.			trans	-102.3	121.8	177.5	-68.3	-169.8	163	0	0	110	L229 K253	E227-L229 HydrophobicContact CB-CB 3.83Å; E227-L229 HydrophobicContact CB-CD1 3.86Å; E227-L229 HydrophobicContact CB-CG 4.1Å; E227-L229 VanDerWaalsContact CD-CD1 3.41Å; E227-L229 HydrophobicContact CG-CD1 4.01Å; E227-L229 PolarHBondContact O-N 3.49Å; E227-L229 WeakPolarHBondContact OE2-CD1 3.32Å; E227-K253 IonicContact OE1-NZ 2.87Å; E227-K253 PolarHBondContact OE1-NZ 3.43Å
228	D	41.9	Very low	72.4	Confident	174 Å²	174	85.4 Å²	85.4	93%	0.93	42%	0.417	S	S	*	.			trans	-55.2	5.4	161.7	-76.2	-49.7	0	0	0	113.3	R230	D228-R230 PolarHBondContact O-N 3.42Å
229	L	46.2	Very low	72.4	Confident	56 Å²	56	79.8 Å²	79.8	29%	0.293	40%	0.398	S	S	.	.			trans	-80.1	75.8	-178.7	-73.2	160.9	0	0	0	111.4	E227 V231	E227-L229 HydrophobicContact CB-CB 3.83Å; E227-L229 HydrophobicContact CB-CD1 3.86Å; E227-L229 HydrophobicContact CB-CG 4.1Å; E227-L229 VanDerWaalsContact CD-CD1 3.41Å; E227-L229 HydrophobicContact CG-CD1 4.01Å; E227-L229 PolarHBondContact O-N 3.49Å; E227-L229 WeakPolarHBondContact OE2-CD1 3.32Å; L229-V231 HydrophobicContact CD2-CG2 4.4Å; L229-V231 PolarHBondContact O-N 3Å; L229-V231 VanDerWaalsContact O-N 3.17Å
230	R	51.3	Low	72.5	Confident	234 Å²	234	82 Å²	82	88%	0.883	41%	0.406	S	S	*	.			trans	-71.4	12.5	158.1	-67	-174.8	-178.8	-174.8	1.7	113.3	D228 H232	D228-R230 PolarHBondContact O-N 3.42Å; R230-H232 PolarHBondContact O-N 3.38Å
231	V	60.8	Low	72.6	Confident	63 Å²	63	82.5 Å²	82.5	38%	0.382	41%	0.409	S	S	.	.			trans	-94.5	94.5	-176	-159.3	0	0	0	0	108.5	L229 L420 K424	L229-V231 HydrophobicContact CD2-CG2 4.4Å; L229-V231 PolarHBondContact O-N 3Å; L229-V231 VanDerWaalsContact O-N 3.17Å; V231-L420 HydrophobicContact CG1-CD1 4.2Å; V231-L420 HydrophobicContact CG2-CD1 4.32Å; V231-K424 HydrophobicContact CG1-CB 3.62Å; V231-K424 HydrophobicContact CG1-CD 3.75Å; V231-K424 HydrophobicContact CG1-CG 3.71Å
232	H	74.3	Confident	72.9	Confident	72 Å²	72	81.9 Å²	81.9	33%	0.333	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-70.2	150.3	164.8	-66	-57.4	0	0	0	109.5	I213 I221 R230	I213-H232 HydrophobicContact CD1-CB 3.74Å; I221-H232 WeakPolarHBondContact CD1-CE1 3.29Å; R230-H232 PolarHBondContact O-N 3.38Å
233	F	84.6	Confident	73.4	Confident	35 Å²	35	81.9 Å²	81.9	15%	0.154	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-60.4	151.9	170.9	-61.6	-38.6	0	0	0	109.9	H204 K245 A248 K249 I425	H204-F233 PolarHBondContact CE1-O 3.16Å; H204-F233 PolarHBondContact NE2-O 3.48Å; H204-F233 VanDerWaalsContact NE2-O 3.07Å; F233-K245 HydrophobicContact CB-CD 3.85Å; F233-K245 HydrophobicContact CB-CG 4.22Å; F233-K245 HydrophobicContact CD1-CG 4.45Å; F233-K245 HydrophobicContact CD2-CB 3.83Å; F233-K245 HydrophobicContact CD2-CD 4.11Å; F233-K245 HydrophobicContact CD2-CG 3.74Å; F233-K245 HydrophobicContact CE2-CB 3.94Å; F233-K245 HydrophobicContact CE2-CG 4.15Å; F233-K245 HydrophobicContact CG-CB 4.5Å; F233-K245 HydrophobicContact CG-CD 4.1Å; F233-K245 HydrophobicContact CG-CG 3.91Å; F233-A248 HydrophobicContact CZ-CB 4.38Å; F233-K249 HydrophobicContact CE2-CD 3.71Å; F233-K249 VanDerWaalsContact CE2-CE 3.42Å; F233-K249 HydrophobicContact CE2-CG 4.03Å; F233-K249 HydrophobicContact CZ-CD 4.44Å; F233-K249 HydrophobicContact CZ-CG 4.4Å; F233-I425 HydrophobicContact CD1-CG1 4.29Å; F233-I425 HydrophobicContact CE1-CG1 4.35Å
234	E	88.4	Confident	74.4	Confident	93 Å²	93	79.2 Å²	79.2	44%	0.435	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-68.8	169.3	168.1	-66.3	-62.3	155	0	0	110.5	H204 K245 Q423 K424	H204-E234 PolarHBondContact CE1-O 2.9Å; E234-K245 PolarHBondContact O-NZ 3.29Å; E234-Q423 PolarHBondContact N-O 3.05Å; E234-K424 HydrophobicContact CG-CG 4Å
235	E	90	Very high	75.8	Confident	50 Å²	50	76.8 Å²	76.8	23%	0.234	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-64.5	141.8	173.5	62.1	179.6	-153.5	0	0	111.9	H204 G210 F211 K245 Q423	H204-E235 PolarHBondContact CE1-N 3.3Å; H204-E235 WeakPolarHBondContact ND1-CA 3.43Å; G210-E235 WeakPolarHBondContact CA-OE2 3.31Å; F211-E235 HydrophobicContact CB-CB 4.31Å; F211-E235 WeakPolarHBondContact CB-OE2 3.47Å; F211-E235 PolarHBondContact N-OE2 3.3Å; E235-K245 PolarHBondContact O-NZ 2.78Å; E235-Q423 PolarHBondContact O-OE1 2.9Å
236	S	91.4	Very high	77.6	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.014	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-87.4	117.7	177.1	-64.6	0	0	0	0	110.8	H204 K206 K245	H204-S236 PolarHBondContact O-N 3.08Å; K206-S236 PolarHBondContact N-O 3.11Å; S236-K245 VanDerWaalsContact OG-CD 3.3Å; S236-K245 WeakPolarHBondContact OG-CD 3.21Å; S236-K245 PolarHBondContact OG-NZ 3.1Å
237	S	89.4	Confident	79.4	Confident	28 Å²	28	64.8 Å²	64.8	20%	0.196	30%	0.301	C	S	.	.			trans	-95.5	-35.1	170.3	55.4	0	0	0	0	112.6	M62	M62-S237 WeakPolarHBondContact CE-O 3.33Å
238	K	91	Very high	81.2	Confident	110 Å²	110	63.6 Å²	63.6	48%	0.478	31%	0.305	S	S	.	.	S	Bend	trans	-108.4	150.1	-176.7	-66.9	170.2	-177.4	178.5	0	112.3	E56 E240 D241 L242	E56-K238 WeakPolarHBondContact OE1-CG 3.46Å; K238-E240 VanDerWaalsContact C-N 3.29Å; K238-E240 PolarHBondContact O-N 2.78Å; K238-D241 PolarHBondContact O-N 3.35Å; K238-L242 PolarHBondContact O-N 2.82Å; K238-L242 VanDerWaalsContact O-N 3.1Å
239	L	90.8	Very high	83.2	Confident	41 Å²	41	58 Å²	58	22%	0.215	27%	0.272	C	S	.	.	H	α-helix	trans	-57.4	-42.2	171.7	177.5	61	0	0	0	111.7	L57 M62 Q65 C66 D241 L242 L243	L57-L239 HydrophobicContact CD1-CD2 4.39Å; M62-L239 HydrophobicContact CG-CB 4.48Å; M62-L239 WeakPolarHBondContact O-CD1 3.21Å; Q65-L239 HydrophobicContact CB-CD1 4.08Å; Q65-L239 HydrophobicContact CB-CD2 4.09Å; C66-L239 HydrophobicContact CB-CD1 4.18Å; L239-D241 VanDerWaalsContact C-N 3.31Å; L239-D241 PolarHBondContact O-N 3.17Å; L239-L242 PolarHBondContact O-N 3.26Å; L239-L243 VanDerWaalsContact O-CB 3.28Å; L239-L243 WeakPolarHBondContact O-CB 3.37Å; L239-L243 PolarHBondContact O-N 3.27Å
240	E	89.2	Confident	84.7	Confident	128 Å²	128	56 Å²	56	60%	0.598	26%	0.262	S	S	*	.	H	α-helix	trans	-58.5	-41.7	180	-64.6	179.9	-174	0	0	112.4	K238 R244	K238-E240 VanDerWaalsContact C-N 3.29Å; K238-E240 PolarHBondContact O-N 2.78Å; E240-R244 VanDerWaalsContact O-CG 3.32Å; E240-R244 WeakPolarHBondContact O-CG 3.38Å; E240-R244 PolarHBondContact O-N 3.07Å; E240-R244 VanDerWaalsContact O-N 3.1Å
241	D	90.7	Very high	85.6	Confident	14 Å²	14	48.7 Å²	48.7	8%	0.075	24%	0.243	C	C	.	.	H	α-helix	trans	-72.2	-42.9	-179.3	-60.5	-30.3	0	0	0	111	K238 L239 L243 R244 K245 Q423	K238-D241 PolarHBondContact O-N 3.35Å; L239-D241 VanDerWaalsContact C-N 3.31Å; L239-D241 PolarHBondContact O-N 3.17Å; D241-L243 VanDerWaalsContact C-N 3.33Å; D241-L243 PolarHBondContact O-N 3.44Å; D241-R244 PolarHBondContact O-N 2.91Å; D241-R244 IonicContact OD1-CZ 2.86Å; D241-R244 IonicContact OD1-NE 3.12Å; D241-R244 IonicContact OD1-NH2 2.73Å; D241-R244 PolarHBondContact OD1-NH2 3.25Å; D241-K245 WeakPolarHBondContact O-CG 3.22Å; D241-K245 PolarHBondContact O-N 3.07Å; D241-Q423 HydrophobicContact CB-CG 4.27Å
242	L	92.7	Very high	86.2	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.8	-46.3	174.4	-177	62.2	0	0	0	111.2	M62 C66 F169 M203 L205 K238 L239 R244 K245 V246	M62-L242 HydrophobicContact CB-CD2 4.03Å; C66-L242 HydrophobicContact CB-CD2 3.92Å; C66-L242 HydrophobicContact CB-CG 4.2Å; F169-L242 HydrophobicContact CD1-CD1 4.19Å; F169-L242 HydrophobicContact CD1-CD2 4.29Å; F169-L242 HydrophobicContact CE1-CD1 3.97Å; F169-L242 HydrophobicContact CE1-CD2 4.23Å; F169-L242 HydrophobicContact CE1-CG 4.31Å; M203-L242 HydrophobicContact CB-CD1 4.04Å; L205-L242 HydrophobicContact CD2-CD1 3.88Å; L205-L242 HydrophobicContact CD2-CD2 3.87Å; L205-L242 HydrophobicContact CD2-CG 4.44Å; K238-L242 PolarHBondContact O-N 2.82Å; K238-L242 VanDerWaalsContact O-N 3.1Å; L239-L242 PolarHBondContact O-N 3.26Å; L242-R244 VanDerWaalsContact C-N 3.32Å; L242-R244 PolarHBondContact O-N 3.03Å; L242-K245 PolarHBondContact O-N 3.09Å; L242-V246 HydrophobicContact CD1-CG2 4.24Å; L242-V246 HydrophobicContact CG-CG2 4.45Å; L242-V246 WeakPolarHBondContact O-CB 3.26Å; L242-V246 WeakPolarHBondContact O-CG2 3.45Å; L242-V246 PolarHBondContact O-N 2.96Å
243	L	91.1	Very high	86.5	Confident	25 Å²	25	51.1 Å²	51.1	13%	0.131	25%	0.246	C	C	.	.	H	α-helix	trans	-62.6	-40.2	-179.4	-144.7	178.2	0	0	0	111	L239 D241 R247	L239-L243 VanDerWaalsContact O-CB 3.28Å; L239-L243 WeakPolarHBondContact O-CB 3.37Å; L239-L243 PolarHBondContact O-N 3.27Å; D241-L243 VanDerWaalsContact C-N 3.33Å; D241-L243 PolarHBondContact O-N 3.44Å; L243-R247 VanDerWaalsContact CD2-CD 3.48Å; L243-R247 HydrophobicContact CD2-CG 3.74Å; L243-R247 WeakPolarHBondContact O-CB 2.98Å; L243-R247 WeakPolarHBondContact O-CG 3.24Å; L243-R247 PolarHBondContact O-N 2.68Å
244	R	89.7	Confident	86.4	Confident	46 Å²	46	57.9 Å²	57.9	17%	0.174	27%	0.27	C	S	.	.	H	α-helix	trans	-65	-45.5	174.8	-72	-172	-64.3	141.8	1.2	112.5	E240 D241 L242 R247 A248 D421 I425	E240-R244 VanDerWaalsContact O-CG 3.32Å; E240-R244 WeakPolarHBondContact O-CG 3.38Å; E240-R244 PolarHBondContact O-N 3.07Å; E240-R244 VanDerWaalsContact O-N 3.1Å; D241-R244 PolarHBondContact O-N 2.91Å; D241-R244 IonicContact OD1-CZ 2.86Å; D241-R244 IonicContact OD1-NE 3.12Å; D241-R244 IonicContact OD1-NH2 2.73Å; D241-R244 PolarHBondContact OD1-NH2 3.25Å; L242-R244 VanDerWaalsContact C-N 3.32Å; L242-R244 PolarHBondContact O-N 3.03Å; R244-R247 PolarHBondContact O-N 3.24Å; R244-A248 WeakPolarHBondContact O-CB 3.33Å; R244-A248 PolarHBondContact O-N 3.31Å; R244-D421 IonicContact CZ-OD2 3.68Å; R244-D421 IonicContact NH1-OD2 3.74Å; R244-D421 PolarHBondContact NH1-OD2 2.65Å; R244-D421 IonicContact NH2-OD2 2.8Å; R244-I425 HydrophobicContact CB-CD1 3.72Å
245	K	90.8	Very high	86.4	Confident	3 Å²	3	55 Å²	55	1%	0.013	26%	0.262	C	S	.	.	H	α-helix	trans	-62.8	-42.5	177.8	-69.7	169.4	-167.6	171	0	111.8	M203 F233 E234 E235 S236 D241 L242 A248 K249 I425	M203-K245 HydrophobicContact SD-CB 4.37Å; F233-K245 HydrophobicContact CB-CD 3.85Å; F233-K245 HydrophobicContact CB-CG 4.22Å; F233-K245 HydrophobicContact CD1-CG 4.45Å; F233-K245 HydrophobicContact CD2-CB 3.83Å; F233-K245 HydrophobicContact CD2-CD 4.11Å; F233-K245 HydrophobicContact CD2-CG 3.74Å; F233-K245 HydrophobicContact CE2-CB 3.94Å; F233-K245 HydrophobicContact CE2-CG 4.15Å; F233-K245 HydrophobicContact CG-CB 4.5Å; F233-K245 HydrophobicContact CG-CD 4.1Å; F233-K245 HydrophobicContact CG-CG 3.91Å; E234-K245 PolarHBondContact O-NZ 3.29Å; E235-K245 PolarHBondContact O-NZ 2.78Å; S236-K245 VanDerWaalsContact OG-CD 3.3Å; S236-K245 WeakPolarHBondContact OG-CD 3.21Å; S236-K245 PolarHBondContact OG-NZ 3.1Å; D241-K245 WeakPolarHBondContact O-CG 3.22Å; D241-K245 PolarHBondContact O-N 3.07Å; L242-K245 PolarHBondContact O-N 3.09Å; K245-A248 PolarHBondContact O-N 2.62Å; K245-K249 PolarHBondContact O-N 2.95Å; K245-I425 HydrophobicContact CG-CD1 3.69Å; K245-I425 HydrophobicContact CG-CG1 3.87Å
246	V	90.1	Very high	86.5	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.8	-50.4	176.4	171.1	0	0	0	0	110.3	C66 V70 M167 F169 M203 L242 A248 K249 E250	C66-V246 VanDerWaalsContact SG-CG2 3.58Å; V70-V246 HydrophobicContact CG2-CG1 3.51Å; M167-V246 HydrophobicContact SD-CG1 3.95Å; F169-V246 HydrophobicContact CE1-CG2 3.8Å; F169-V246 HydrophobicContact CZ-CG2 3.74Å; M203-V246 HydrophobicContact CG-CG2 3.94Å; M203-V246 HydrophobicContact SD-CG2 3.77Å; L242-V246 HydrophobicContact CD1-CG2 4.24Å; L242-V246 HydrophobicContact CG-CG2 4.45Å; L242-V246 WeakPolarHBondContact O-CB 3.26Å; L242-V246 WeakPolarHBondContact O-CG2 3.45Å; L242-V246 PolarHBondContact O-N 2.96Å; V246-A248 VanDerWaalsContact C-N 3.26Å; V246-A248 PolarHBondContact O-N 3.43Å; V246-K249 CarbonylContact O-C 3.54Å; V246-K249 PolarHBondContact O-N 3.16Å; V246-E250 VanDerWaalsContact O-CB 3.27Å; V246-E250 WeakPolarHBondContact O-CB 3.4Å; V246-E250 PolarHBondContact O-N 3.1Å
247	R	85.9	Confident	86.5	Confident	105 Å²	105	57.6 Å²	57.6	40%	0.396	28%	0.278	S	S	.	.	H	α-helix	trans	-57.9	-37.4	177.3	-79.7	178.1	177.3	161	7.1	112.9	L243 R244 K249	L243-R247 VanDerWaalsContact CD2-CD 3.48Å; L243-R247 HydrophobicContact CD2-CG 3.74Å; L243-R247 WeakPolarHBondContact O-CB 2.98Å; L243-R247 WeakPolarHBondContact O-CG 3.24Å; L243-R247 PolarHBondContact O-N 2.68Å; R244-R247 PolarHBondContact O-N 3.24Å; R247-K249 PolarHBondContact O-N 3.43Å
248	A	85.1	Confident	86.8	Confident	57 Å²	57	60.2 Å²	60.2	47%	0.471	28%	0.284	S	S	.	.	H	α-helix	trans	-64	-24.5	177.3	0	0	0	0	0	113.3	F233 R244 K245 V246	F233-A248 HydrophobicContact CZ-CB 4.38Å; R244-A248 WeakPolarHBondContact O-CB 3.33Å; R244-A248 PolarHBondContact O-N 3.31Å; K245-A248 PolarHBondContact O-N 2.62Å; V246-A248 VanDerWaalsContact C-N 3.26Å; V246-A248 PolarHBondContact O-N 3.43Å
249	K	83.2	Confident	87	Confident	56 Å²	56	55.3 Å²	55.3	24%	0.243	26%	0.263	C	S	.	.	H	α-helix	trans	-110.9	-14.6	-179.5	-71.1	-174.6	164.2	-158.3	0	114.5	R165 M167 D201 M203 F233 K245 V246 R247	R165-K249 PolarHBondContact NE-O 3.28Å; M167-K249 VanDerWaalsContact CE-C 3.5Å; M167-K249 HydrophobicContact CE-CB 3.76Å; D201-K249 HydrophobicContact CB-CD 4.15Å; D201-K249 WeakPolarHBondContact OD1-CD 3.34Å; D201-K249 IonicContact OD1-NZ 3.21Å; D201-K249 PolarHBondContact OD1-NZ 3.31Å; M203-K249 HydrophobicContact CE-CD 3.68Å; F233-K249 HydrophobicContact CE2-CD 3.71Å; F233-K249 VanDerWaalsContact CE2-CE 3.42Å; F233-K249 HydrophobicContact CE2-CG 4.03Å; F233-K249 HydrophobicContact CZ-CD 4.44Å; F233-K249 HydrophobicContact CZ-CG 4.4Å; K245-K249 PolarHBondContact O-N 2.95Å; V246-K249 CarbonylContact O-C 3.54Å; V246-K249 PolarHBondContact O-N 3.16Å; R247-K249 PolarHBondContact O-N 3.43Å
250	E	77.4	Confident	87.3	Confident	15 Å²	15	59.3 Å²	59.3	7%	0.07	28%	0.279	C	S	.	.	H	α-helix	trans	-66	-46.4	179.8	-178.4	-152.2	141.6	0	0	111.1	L38 V70 K74 M167 V246	L38-E250 HydrophobicContact CD2-CG 4.19Å; V70-E250 VanDerWaalsContact CG1-CD 3.44Å; V70-E250 HydrophobicContact CG1-CG 3.79Å; K74-E250 VanDerWaalsContact CD-OE1 3.26Å; K74-E250 WeakPolarHBondContact CD-OE1 3.47Å; K74-E250 WeakPolarHBondContact CE-OE1 3.18Å; K74-E250 IonicContact NZ-OE1 3.95Å; K74-E250 PolarHBondContact NZ-OE1 3.46Å; K74-E250 VanDerWaalsContact NZ-OE1 3.09Å; M167-E250 HydrophobicContact CE-CB 4.33Å; V246-E250 VanDerWaalsContact O-CB 3.27Å; V246-E250 WeakPolarHBondContact O-CB 3.4Å; V246-E250 PolarHBondContact O-N 3.1Å
251	T	71.9	Confident	87.7	Confident	80 Å²	80	53.5 Å²	53.5	49%	0.491	25%	0.252	S	S	.	.	S	Bend	trans	-99.9	130.8	-179.3	53.3	0	0	0	0	110.2
252	R	73.3	Confident	88	Confident	59 Å²	59	54.8 Å²	54.8	22%	0.223	26%	0.257	C	S	.	.			trans	-84	158.4	173.3	-64	-156.4	-166.8	-157.5	-5.7	111.1	H163 F199 R254	H163-R252 VanDerWaalsContact CB-CZ 3.49Å; H163-R252 WeakPolarHBondContact CD2-CD 3.42Å; H163-R252 PolarHBondContact CE1-NH1 3.02Å; H163-R252 PolarHBondContact ND1-NH1 3.43Å; F199-R252 VanDerWaalsContact CE2-NH2 3.35Å; R252-R254 PolarHBondContact O-N 3.25Å
253	K	80.5	Confident	88.2	Confident	126 Å²	126	57 Å²	57	55%	0.548	27%	0.268	S	S	.	.			trans	-58.5	106.1	175	-60.3	176	-172.1	170.3	0	109.1	E227 Y274	E227-K253 IonicContact OE1-NZ 2.87Å; E227-K253 PolarHBondContact OE1-NZ 3.43Å; K253-Y274 HydrophobicContact CB-CE1 3.99Å
254	R	82.7	Confident	88.4	Confident	178 Å²	178	59.5 Å²	59.5	67%	0.672	28%	0.282	S	S	*	.			trans	-101.8	109.4	172.9	-173.3	175.4	179.1	174.9	0.2	109.5	R252 L256 Y274	R252-R254 PolarHBondContact O-N 3.25Å; R254-L256 PolarHBondContact O-N 3.05Å; R254-Y274 WeakPolarHBondContact O-CD1 3.43Å
255	A	88.1	Confident	88.6	Confident	31 Å²	31	66.5 Å²	66.5	26%	0.256	31%	0.314	S	S	.	.			trans	-69.5	130.7	174.6	0	0	0	0	0	109.8	S257 R258 V273 Y274	A255-S257 VanDerWaalsContact C-N 3.34Å; A255-R258 HydrophobicContact CB-CG 4.48Å; A255-V273 CarbonylContact C-O 3.49Å; A255-Y274 HydrophobicContact CB-CD1 4.35Å; A255-Y274 HydrophobicContact CB-CE1 3.84Å
256	L	90.8	Very high	88.8	Confident	85 Å²	85	73.2 Å²	73.2	45%	0.445	35%	0.349	S	S	.	.	S	Bend	trans	-67.8	-39.1	171.1	178	65.2	0	0	0	110.6	R254 V273 L366	R254-L256 PolarHBondContact O-N 3.05Å; L256-V273 WeakPolarHBondContact CA-O 3.44Å; L256-V273 VanDerWaalsContact CB-O 3.31Å; L256-V273 WeakPolarHBondContact CB-O 3.42Å; L256-V273 PolarHBondContact N-O 3.15Å; L256-L366 HydrophobicContact CD2-CD1 4.4Å; L256-L366 HydrophobicContact CD2-CD2 4.19Å
257	S	92.1	Very high	89.1	Confident	22 Å²	22	77.2 Å²	77.2	15%	0.154	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	155.8	174	58.4	0	0	0	0	109.9	A255 V273	A255-S257 VanDerWaalsContact C-N 3.34Å; S257-V273 PolarHBondContact N-O 2.83Å; S257-V273 PolarHBondContact O-N 3.27Å
258	R	94.9	Very high	89.6	Confident	84 Å²	84	74.2 Å²	74.2	32%	0.317	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	118.9	171	-69.3	174.7	167.8	162.5	-11.9	108.3	A255 E371 L374	A255-R258 HydrophobicContact CB-CG 4.48Å; R258-E371 HydrophobicContact CG-CG 4.39Å; R258-E371 IonicContact CZ-OE1 3.87Å; R258-E371 IonicContact CZ-OE2 3.52Å; R258-E371 IonicContact NE-OE1 3.6Å; R258-E371 PolarHBondContact NE-OE1 3.34Å; R258-E371 IonicContact NE-OE2 2.61Å; R258-E371 PolarHBondContact NE-OE2 3.09Å; R258-E371 IonicContact NH2-OE1 3.68Å; R258-E371 PolarHBondContact NH2-OE1 3.23Å; R258-E371 IonicContact NH2-OE2 3.83Å; R258-L374 HydrophobicContact CB-CD1 3.98Å; R258-L374 HydrophobicContact CG-CD1 4.5Å
259	L	95.6	Very high	90.2	Very high	6 Å²	6	71.9 Å²	71.9	3%	0.031	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	156.9	-169.7	-67	-178.4	0	0	0	111.5	V271 V273 P343 Y400	L259-V271 PolarHBondContact N-O 3.5Å; L259-V271 WeakPolarHBondContact O-CG2 3.4Å; L259-V271 PolarHBondContact O-N 2.86Å; L259-V273 HydrophobicContact CD1-CG2 3.99Å; L259-V273 HydrophobicContact CG-CG2 4.41Å; L259-P343 HydrophobicContact CD2-CB 4.19Å; L259-Y400 HydrophobicContact CD1-CD2 4.33Å; L259-Y400 HydrophobicContact CD1-CE2 3.55Å
260	K	97.4	Very high	90.9	Very high	125 Å²	125	69.4 Å²	69.4	54%	0.543	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	120	173.1	-68.1	-179.2	-176.5	-175.3	0	109.4	K262 V268 G344 L345	K260-K262 HydrophobicContact CB-CG 4.38Å; K260-V268 HydrophobicContact CB-CG1 3.64Å; K260-V268 HydrophobicContact CD-CG1 4.18Å; K260-V268 HydrophobicContact CG-CG1 4Å; K260-G344 WeakPolarHBondContact O-CA 3.28Å; K260-L345 PolarHBondContact O-N 3.08Å
261	L	97.9	Very high	91.8	Very high	7 Å²	7	68.7 Å²	68.7	4%	0.037	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	106	167.5	-168.8	165.3	0	0	0	108.3	L263 V268 I269 V271 L345 L413	L261-L263 HydrophobicContact CD2-CD1 3.58Å; L261-L263 HydrophobicContact CD2-CG 4.42Å; L261-V268 WeakPolarHBondContact O-CA 3.45Å; L261-I269 HydrophobicContact CB-CD1 4.45Å; L261-I269 HydrophobicContact CB-CG1 3.82Å; L261-I269 HydrophobicContact CD1-CD1 4.44Å; L261-I269 HydrophobicContact CD2-CD1 4.34Å; L261-I269 HydrophobicContact CD2-CG1 4.22Å; L261-I269 HydrophobicContact CG-CG1 4.44Å; L261-I269 PolarHBondContact N-O 2.95Å; L261-I269 PolarHBondContact O-N 2.65Å; L261-V271 HydrophobicContact CB-CG1 4.11Å; L261-V271 HydrophobicContact CB-CG2 4.07Å; L261-V271 HydrophobicContact CD1-CG1 4.17Å; L261-L345 CarbonylContact C-O 3.55Å; L261-L345 WeakPolarHBondContact CA-O 3.14Å; L261-L345 HydrophobicContact CB-CB 4.29Å; L261-L345 HydrophobicContact CD1-CD1 4.47Å; L261-L345 HydrophobicContact CG-CB 4.1Å; L261-L413 HydrophobicContact CD1-CD1 3.92Å
262	K	97.4	Very high	93	Very high	41 Å²	41	64.9 Å²	64.9	18%	0.178	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	108.6	-175.3	-56.9	176	-174.6	170.5	0	108.7	K260 V268 L345 M346 L347	K260-K262 HydrophobicContact CB-CG 4.38Å; K262-V268 HydrophobicContact CB-CG2 4.37Å; K262-V268 HydrophobicContact CG-CG1 4.12Å; K262-V268 HydrophobicContact CG-CG2 3.99Å; K262-L345 PolarHBondContact N-O 3.46Å; K262-M346 HydrophobicContact CD-CG 4.3Å; K262-L347 PolarHBondContact O-N 3.49Å
263	L	96.3	Very high	94.1	Very high	45 Å²	45	62 Å²	62	24%	0.236	30%	0.295	C	S	.	.	S	Bend	trans	-73	-38.7	171.8	-79.6	78.4	0	0	0	110.1	L261 I267 L347 L381	L261-L263 HydrophobicContact CD2-CD1 3.58Å; L261-L263 HydrophobicContact CD2-CG 4.42Å; L263-I267 HydrophobicContact CB-CB 4.19Å; L263-I267 HydrophobicContact CB-CG2 4.07Å; L263-I267 HydrophobicContact CD1-CG2 4.31Å; L263-I267 HydrophobicContact CD2-CG2 4.24Å; L263-I267 HydrophobicContact CG-CG2 4.44Å; L263-I267 PolarHBondContact N-O 2.94Å; L263-L347 HydrophobicContact CB-CD2 4.41Å; L263-L347 HydrophobicContact CG-CD2 4.11Å; L263-L381 HydrophobicContact CD1-CD2 4Å; L263-L381 HydrophobicContact CD2-CD2 4.1Å
264	N	95.2	Very high	94.7	Very high	78 Å²	78	57.5 Å²	57.5	42%	0.417	28%	0.275	S	S	.	.	S	Bend	trans	-148.1	-160.3	166.8	65.7	21.9	0	0	0	108.4	D266 I267	N264-D266 VanDerWaalsContact C-N 3.32Å; N264-D266 PolarHBondContact O-N 3Å; N264-D266 PolarHBondContact OD1-N 3.13Å; N264-I267 PolarHBondContact N-O 3.04Å; N264-I267 WeakPolarHBondContact OD1-CB 3.24Å; N264-I267 WeakPolarHBondContact OD1-CG1 3.45Å; N264-I267 PolarHBondContact OD1-N 3.35Å
265	K	93.9	Very high	95.2	Very high	194 Å²	194	51.5 Å²	51.5	84%	0.843	26%	0.256	S	S	*	.	S	Bend	trans	-68.5	-29.6	-179.8	-68.4	-175.2	178.1	-178.5	0	113.5
266	D	95.3	Very high	95.4	Very high	143 Å²	143	55 Å²	55	77%	0.765	27%	0.27	S	S	*	.	S	Bend	trans	-104.5	-38.6	-170.2	-50.4	-51.4	0	0	0	111.9	N264 V268	N264-D266 VanDerWaalsContact C-N 3.32Å; N264-D266 PolarHBondContact O-N 3Å; N264-D266 PolarHBondContact OD1-N 3.13Å; D266-V268 PolarHBondContact O-N 3.42Å
267	I	96.2	Very high	95.5	Very high	85 Å²	85	55.4 Å²	55.4	44%	0.436	28%	0.275	S	S	.	.			trans	-88.4	101.8	-179.2	-53	174.3	0	0	0	108.5	L263 N264 L381	L263-I267 HydrophobicContact CB-CB 4.19Å; L263-I267 HydrophobicContact CB-CG2 4.07Å; L263-I267 HydrophobicContact CD1-CG2 4.31Å; L263-I267 HydrophobicContact CD2-CG2 4.24Å; L263-I267 HydrophobicContact CG-CG2 4.44Å; L263-I267 PolarHBondContact N-O 2.94Å; N264-I267 PolarHBondContact N-O 3.04Å; N264-I267 WeakPolarHBondContact OD1-CB 3.24Å; N264-I267 WeakPolarHBondContact OD1-CG1 3.45Å; N264-I267 PolarHBondContact OD1-N 3.35Å; I267-L381 HydrophobicContact CG2-CD2 4.15Å
268	V	97.3	Very high	95.4	Very high	41 Å²	41	61 Å²	61	25%	0.248	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	128.1	-177.3	-175.2	0	0	0	0	109.5	K260 L261 K262 D266	K260-V268 HydrophobicContact CB-CG1 3.64Å; K260-V268 HydrophobicContact CD-CG1 4.18Å; K260-V268 HydrophobicContact CG-CG1 4Å; L261-V268 WeakPolarHBondContact O-CA 3.45Å; K262-V268 HydrophobicContact CB-CG2 4.37Å; K262-V268 HydrophobicContact CG-CG1 4.12Å; K262-V268 HydrophobicContact CG-CG2 3.99Å; D266-V268 PolarHBondContact O-N 3.42Å
269	I	97.4	Very high	95.2	Very high	8 Å²	8	64.8 Å²	64.8	4%	0.041	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	157.3	170	63	177.7	0	0	0	110.1	L261 V271 L381 F382	L261-I269 HydrophobicContact CB-CD1 4.45Å; L261-I269 HydrophobicContact CB-CG1 3.82Å; L261-I269 HydrophobicContact CD1-CD1 4.44Å; L261-I269 HydrophobicContact CD2-CD1 4.34Å; L261-I269 HydrophobicContact CD2-CG1 4.22Å; L261-I269 HydrophobicContact CG-CG1 4.44Å; L261-I269 PolarHBondContact N-O 2.95Å; L261-I269 PolarHBondContact O-N 2.65Å; I269-V271 HydrophobicContact CD1-CG1 4.4Å; I269-V271 HydrophobicContact CG1-CG1 4.39Å; I269-L381 HydrophobicContact CG2-CB 4.11Å; I269-L381 HydrophobicContact CG2-CD2 3.5Å; I269-L381 HydrophobicContact CG2-CG 4.36Å; I269-F382 HydrophobicContact CD1-CB 4.27Å; I269-F382 HydrophobicContact CD1-CD2 4.38Å
270	S	97.4	Very high	94.9	Very high	4 Å²	4	67.2 Å²	67.2	3%	0.028	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	135.8	175.2	-174.7	0	0	0	0	110.5	E371 L374 S378	S270-E371 WeakPolarHBondContact CB-O 3.37Å; S270-E371 PolarHBondContact O-N 2.68Å; S270-L374 WeakPolarHBondContact OG-CB 3.22Å; S270-L374 WeakPolarHBondContact OG-CD1 3.27Å; S270-S378 PolarHBondContact N-OG 3.4Å
271	V	96.9	Very high	94.6	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	139.4	178.2	-63.1	0	0	0	0	111	L259 L261 I269 L345 V368 Y369 F382	L259-V271 PolarHBondContact N-O 3.5Å; L259-V271 WeakPolarHBondContact O-CG2 3.4Å; L259-V271 PolarHBondContact O-N 2.86Å; L261-V271 HydrophobicContact CB-CG1 4.11Å; L261-V271 HydrophobicContact CB-CG2 4.07Å; L261-V271 HydrophobicContact CD1-CG1 4.17Å; I269-V271 HydrophobicContact CD1-CG1 4.4Å; I269-V271 HydrophobicContact CG1-CG1 4.39Å; V271-L345 HydrophobicContact CG2-CD1 4.04Å; V271-V368 HydrophobicContact CB-CG1 3.59Å; V271-V368 HydrophobicContact CG1-CG1 3.91Å; V271-V368 HydrophobicContact CG2-CG1 3.76Å; V271-Y369 CarbonylContact C-O 3.59Å; V271-Y369 VanDerWaalsContact CA-O 3.3Å; V271-Y369 WeakPolarHBondContact CA-O 3.34Å; V271-F382 HydrophobicContact CG1-CD2 4.05Å; V271-F382 HydrophobicContact CG1-CE2 4.2Å
272	G	96.5	Very high	94.2	Very high	0 Å²	0	72.6 Å²	72.6	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	133.9	165.6	0	0	0	0	0	109.9	Y274 V368 Y369	G272-Y274 VanDerWaalsContact C-CE2 3.48Å; G272-Y274 WeakPolarHBondContact O-CD2 3.18Å; G272-Y274 WeakPolarHBondContact O-CE2 3.45Å; G272-V368 WeakPolarHBondContact O-CA 3.46Å; G272-Y369 PolarHBondContact N-O 3.34Å; G272-Y369 PolarHBondContact O-N 2.94Å
273	V	96	Very high	93.9	Very high	0 Å²	0	73.1 Å²	73.1	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	126.9	172.6	-177.3	0	0	0	0	108.3	A255 L256 S257 L259 L366 F367	A255-V273 CarbonylContact C-O 3.49Å; L256-V273 WeakPolarHBondContact CA-O 3.44Å; L256-V273 VanDerWaalsContact CB-O 3.31Å; L256-V273 WeakPolarHBondContact CB-O 3.42Å; L256-V273 PolarHBondContact N-O 3.15Å; S257-V273 PolarHBondContact N-O 2.83Å; S257-V273 PolarHBondContact O-N 3.27Å; L259-V273 HydrophobicContact CD1-CG2 3.99Å; L259-V273 HydrophobicContact CG-CG2 4.41Å; V273-L366 HydrophobicContact CG1-CB 3.79Å; V273-L366 HydrophobicContact CG1-CD1 3.57Å; V273-L366 HydrophobicContact CG1-CG 4.2Å; V273-F367 CarbonylContact C-O 3.13Å; V273-F367 WeakPolarHBondContact CA-O 3.46Å
274	Y	94.1	Very high	93.5	Very high	31 Å²	31	76.2 Å²	76.2	12%	0.122	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	147.8	-174.9	-57.7	-96.2	0	0	0	110.6	K253 R254 A255 G272 F367	K253-Y274 HydrophobicContact CB-CE1 3.99Å; R254-Y274 WeakPolarHBondContact O-CD1 3.43Å; A255-Y274 HydrophobicContact CB-CD1 4.35Å; A255-Y274 HydrophobicContact CB-CE1 3.84Å; G272-Y274 VanDerWaalsContact C-CE2 3.48Å; G272-Y274 WeakPolarHBondContact O-CD2 3.18Å; G272-Y274 WeakPolarHBondContact O-CE2 3.45Å; Y274-F367 HydrophobicContact CD2-CD1 4.28Å; Y274-F367 PolarHBondContact N-O 3.33Å; Y274-F367 PolarHBondContact O-N 3.31Å
275	N	93.2	Very high	93.4	Very high	51 Å²	51	78.7 Å²	78.7	27%	0.273	42%	0.418	S	S	.	.			trans	-104.3	88.8	171.9	60.6	-29.4	0	0	0	110.2	V277 Q278 L366	N275-V277 PolarHBondContact O-N 3.4Å; N275-Q278 PolarHBondContact ND2-OE1 2.96Å; N275-L366 HydrophobicContact CB-CD2 4.2Å
276	L	91.7	Very high	93.3	Very high	105 Å²	105	75.4 Å²	75.4	55%	0.55	41%	0.408	S	S	.	.	S	Bend	trans	-67.4	-23.6	177.3	-56.4	-176.7	0	0	0	112.7	F367 P429	L276-F367 HydrophobicContact CD1-CB 3.68Å; L276-F367 HydrophobicContact CD1-CD1 4.29Å; L276-F367 HydrophobicContact CD1-CD2 4.08Å; L276-F367 HydrophobicContact CD1-CG 3.77Å; L276-F367 HydrophobicContact CD2-CB 4.42Å; L276-F367 HydrophobicContact CG-CB 3.72Å; L276-F367 HydrophobicContact CG-CG 4.23Å; L276-P429 HydrophobicContact CD1-CG 3.86Å
277	V	92.8	Very high	93.2	Very high	93 Å²	93	74.9 Å²	74.9	56%	0.564	40%	0.399	S	S	*	.			trans	-121	122.5	174	-64.4	0	0	0	0	109.6	N275 P364	N275-V277 PolarHBondContact O-N 3.4Å; V277-P364 HydrophobicContact CG2-CB 3.96Å
278	Q	89.4	Confident	93.2	Very high	140 Å²	140	75.1 Å²	75.1	65%	0.654	40%	0.401	S	S	*	.			trans	-131	132.1	176.7	-176.9	61.9	37.6	0	0	108.8	N275 A280	N275-Q278 PolarHBondContact ND2-OE1 2.96Å; Q278-A280 PolarHBondContact O-N 2.79Å; Q278-A280 VanDerWaalsContact O-N 3.08Å
279	K	91.6	Very high	93.2	Very high	163 Å²	163	78.6 Å²	78.6	71%	0.709	41%	0.41	S	S	*	.			trans	-67.6	112.1	176.1	-176.1	177.7	179	-178.6	0	108.8	L281	K279-L281 HydrophobicContact CD-CD2 3.84Å; K279-L281 HydrophobicContact CG-CD2 3.93Å; K279-L281 PolarHBondContact O-N 2.77Å
280	A	89.7	Confident	93.1	Very high	58 Å²	58	89.2 Å²	89.2	48%	0.479	45%	0.45	S	S	.	.			trans	-67	121.9	169.4	0	0	0	0	0	109.3	Q278 L483	Q278-A280 PolarHBondContact O-N 2.79Å; Q278-A280 VanDerWaalsContact O-N 3.08Å; A280-L483 HydrophobicContact CB-CD1 3.56Å
281	L	89.4	Confident	93.1	Very high	118 Å²	118	96.2 Å²	96.2	62%	0.618	48%	0.482	S	S	*	.			trans	-107.5	155.5	-180	-63.8	178	0	0	0	109.7	K279	K279-L281 HydrophobicContact CD-CD2 3.84Å; K279-L281 HydrophobicContact CG-CD2 3.93Å; K279-L281 PolarHBondContact O-N 2.77Å
282	K	91.2	Very high	93.1	Very high	127 Å²	127	99.6 Å²	99.6	55%	0.552	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-62.9	129.1	168.8	-178.5	179.2	175.9	176.7	0	108.2	L483 H486	K282-L483 HydrophobicContact CB-CD2 4.17Å; K282-H486 VanDerWaalsContact CE-CE1 3.44Å; K282-H486 WeakPolarHBondContact CE-CE1 3.33Å
283	P	89.7	Confident	92.9	Very high	52 Å²	52	105 Å²	105	34%	0.338	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-54.3	137.5	176.1	-26.3	34.6	0	0	0	111.2	F487	P283-F487 HydrophobicContact CG-CE1 4.39Å; P283-F487 HydrophobicContact CG-CZ 3.78Å
284	P	89.4	Confident	92.9	Very high	110 Å²	110	111 Å²	111	71%	0.714	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-66.3	147.8	175.1	29.5	-34	0	0	0	110
285	P	91.6	Very high	92.9	Very high	130 Å²	130	114.4 Å²	114.4	84%	0.844	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-67	144.4	176.5	28.5	-34.2	0	0	0	111.2
286	I	92.1	Very high	93	Very high	125 Å²	125	115.2 Å²	115.2	64%	0.641	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-99.5	136	173.9	-58	173.6	0	0	0	108.6	L288 P295	I286-L288 HydrophobicContact CG2-CD2 4.06Å; I286-P295 HydrophobicContact CG2-CB 4.17Å
287	K	94.4	Very high	93.2	Very high	131 Å²	131	115.1 Å²	115.1	57%	0.57	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-77.1	129.5	174.9	-64.8	178.1	-172.1	167	0	109.3	V296 T298	K287-V296 HydrophobicContact CB-CB 4.35Å; K287-V296 PolarHBondContact O-N 3.04Å; K287-T298 PolarHBondContact NZ-OG1 2.87Å
288	L	95.4	Very high	93.3	Very high	91 Å²	91	114.1 Å²	114.1	48%	0.476	58%	0.582	S	S	.	*	B	Isolated β-bridge	trans	-118.3	153	-179.6	-53.6	-179.7	0	0	0	111.2	I286 E294 P295	I286-L288 HydrophobicContact CG2-CD2 4.06Å; L288-E294 CarbonylContact C-O 3.5Å; L288-E294 VanDerWaalsContact CA-O 3.31Å; L288-E294 WeakPolarHBondContact CA-O 3.34Å; L288-P295 HydrophobicContact CD2-CB 4.48Å; L288-P295 HydrophobicContact CD2-CG 4.28Å
289	Y	97.1	Very high	93.5	Very high	113 Å²	113	114.7 Å²	114.7	44%	0.443	58%	0.582	S	S	.	*			trans	-76.8	129.6	169.2	-174	-105.7	0	0	0	109.9	E291 T292 N293 E294	Y289-E291 VanDerWaalsContact C-N 3.29Å; Y289-E291 HydrophobicContact CD1-CB 4.1Å; Y289-E291 HydrophobicContact CE1-CB 3.63Å; Y289-E291 HydrophobicContact CE1-CG 3.87Å; Y289-E291 VanDerWaalsContact CE1-OE2 3.3Å; Y289-E291 WeakPolarHBondContact CE1-OE2 3.27Å; Y289-E291 PolarHBondContact O-N 3.26Å; Y289-E291 PolarHBondContact OH-OE2 3.29Å; Y289-T292 HydrophobicContact CD1-CG2 3.9Å; Y289-T292 WeakPolarHBondContact CD1-OG1 3.48Å; Y289-T292 HydrophobicContact CE1-CG2 4.21Å; Y289-T292 PolarHBondContact O-N 2.64Å; Y289-N293 VanDerWaalsContact O-CA 3.24Å; Y289-N293 WeakPolarHBondContact O-CA 3.45Å; Y289-N293 PolarHBondContact O-N 2.94Å; Y289-E294 PolarHBondContact N-O 2.97Å
290	R	96.4	Very high	93.7	Very high	231 Å²	231	111.9 Å²	111.9	87%	0.872	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.1	-35.1	-168.6	179.9	-179.8	-69.2	179.2	-1.2	114.1
291	E	96.9	Very high	93.9	Very high	152 Å²	152	117.6 Å²	117.6	71%	0.71	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-30.4	-172	-50.7	170.8	157.8	0	0	112.4	Y289	Y289-E291 VanDerWaalsContact C-N 3.29Å; Y289-E291 HydrophobicContact CD1-CB 4.1Å; Y289-E291 HydrophobicContact CE1-CB 3.63Å; Y289-E291 HydrophobicContact CE1-CG 3.87Å; Y289-E291 VanDerWaalsContact CE1-OE2 3.3Å; Y289-E291 WeakPolarHBondContact CE1-OE2 3.27Å; Y289-E291 PolarHBondContact O-N 3.26Å; Y289-E291 PolarHBondContact OH-OE2 3.29Å
292	T	95.8	Very high	94.2	Very high	70 Å²	70	116.6 Å²	116.6	43%	0.429	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.9	-14	-175.1	65	0	0	0	0	113.4	Y289 E294	Y289-T292 HydrophobicContact CD1-CG2 3.9Å; Y289-T292 WeakPolarHBondContact CD1-OG1 3.48Å; Y289-T292 HydrophobicContact CE1-CG2 4.21Å; Y289-T292 PolarHBondContact O-N 2.64Å; T292-E294 PolarHBondContact O-N 2.85Å; T292-E294 WeakPolarHBondContact OG1-CB 3.47Å; T292-E294 WeakPolarHBondContact OG1-CG 3.33Å; T292-E294 PolarHBondContact OG1-N 3.29Å
293	N	93.8	Very high	94.5	Very high	113 Å²	113	116.3 Å²	116.3	60%	0.604	59%	0.586	S	S	*	*			trans	57.3	20.4	-170.9	-60.7	-47.9	0	0	0	114.4	Y289	Y289-N293 VanDerWaalsContact O-CA 3.24Å; Y289-N293 WeakPolarHBondContact O-CA 3.45Å; Y289-N293 PolarHBondContact O-N 2.94Å
294	E	95.3	Very high	94.8	Very high	128 Å²	128	116.7 Å²	116.7	60%	0.598	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-78.3	143.2	177.3	-69.9	176.3	169.2	0	0	111.8	L288 Y289 T292	L288-E294 CarbonylContact C-O 3.5Å; L288-E294 VanDerWaalsContact CA-O 3.31Å; L288-E294 WeakPolarHBondContact CA-O 3.34Å; Y289-E294 PolarHBondContact N-O 2.97Å; T292-E294 PolarHBondContact O-N 2.85Å; T292-E294 WeakPolarHBondContact OG1-CB 3.47Å; T292-E294 WeakPolarHBondContact OG1-CG 3.33Å; T292-E294 PolarHBondContact OG1-N 3.29Å
295	P	93.8	Very high	95.1	Very high	101 Å²	101	118 Å²	118	66%	0.656	59%	0.591	S	S	*	*	B	Isolated β-bridge	trans	-58.9	135.3	175.7	-25.5	35.1	0	0	0	113.8	I286 L288	I286-P295 HydrophobicContact CG2-CB 4.17Å; L288-P295 HydrophobicContact CD2-CB 4.48Å; L288-P295 HydrophobicContact CD2-CG 4.28Å
296	V	95.6	Very high	95.3	Very high	69 Å²	69	116.9 Å²	116.9	42%	0.418	59%	0.586	S	S	.	*	P	Polyproline II helix	trans	-103.9	117.3	-179.3	-179	0	0	0	0	110.8	K287 T298	K287-V296 HydrophobicContact CB-CB 4.35Å; K287-V296 PolarHBondContact O-N 3.04Å; V296-T298 PolarHBondContact O-N 2.7Å
297	K	95.8	Very high	95.5	Very high	102 Å²	102	115.9 Å²	115.9	44%	0.443	59%	0.586	S	S	.	*	P	Polyproline II helix	trans	-66.7	126.4	172.5	-177.6	69	-165.6	-117.3	0	110.5	E15 A16	E15-K297 PolarHBondContact O-NZ 3.28Å; A16-K297 HydrophobicContact CB-CD 3.84Å
298	T	94.4	Very high	95.4	Very high	72 Å²	72	112.2 Å²	112.2	44%	0.442	59%	0.586	S	S	.	*	P	Polyproline II helix	trans	-94.1	127.2	172.6	-59.5	0	0	0	0	109.4	K287 V296	K287-T298 PolarHBondContact NZ-OG1 2.87Å; V296-T298 PolarHBondContact O-N 2.7Å
299	K	95.3	Very high	95.4	Very high	152 Å²	152	109.4 Å²	109.4	66%	0.661	58%	0.578	S	S	*	*			trans	-114.2	117.9	169.6	-68.3	-170.4	176.6	-167.9	0	108.9
300	T	95.3	Very high	95.4	Very high	104 Å²	104	108.9 Å²	108.9	64%	0.638	58%	0.583	S	S	*	*			trans	-95.3	127.5	178.7	-56	0	0	0	0	109.4
301	R	94.1	Very high	95.3	Very high	179 Å²	179	100.4 Å²	100.4	68%	0.675	55%	0.554	S	S	*	*			trans	-126.7	134.6	177.6	-69.3	-178.1	177.2	178.4	-2	110.1	L310	R301-L310 HydrophobicContact CB-CD1 3.9Å; R301-L310 HydrophobicContact CG-CD1 4.15Å
302	T	95.5	Very high	95.1	Very high	96 Å²	96	97.7 Å²	97.7	59%	0.589	54%	0.544	S	S	*	.			trans	-102.5	131	174.1	-46.3	0	0	0	0	109	L310 L311	T302-L310 WeakPolarHBondContact O-CD1 3.44Å; T302-L311 HydrophobicContact CG2-CD1 4.1Å; T302-L311 PolarHBondContact O-N 3.04Å
303	F	96.2	Very high	95	Very high	122 Å²	122	99.1 Å²	99.1	54%	0.535	56%	0.555	S	S	.	*	B	Isolated β-bridge	trans	-136.5	159.1	-177.8	56.6	-91.6	0	0	0	110.6	G309	F303-G309 CarbonylContact C-O 3.58Å; F303-G309 WeakPolarHBondContact CA-O 3.32Å; F303-G309 WeakPolarHBondContact CB-O 3.09Å
304	N	96.4	Very high	95	Very high	60 Å²	60	98.4 Å²	98.4	32%	0.321	56%	0.558	S	S	.	*			trans	-77.4	126.9	176.7	-174.6	-33.3	0	0	0	109.9	S306 T307 G308 G309 L311	N304-S306 VanDerWaalsContact C-N 3.29Å; N304-S306 PolarHBondContact O-N 3.45Å; N304-S306 PolarHBondContact OD1-N 3.02Å; N304-S306 PolarHBondContact OD1-OG 3.33Å; N304-T307 WeakPolarHBondContact CB-OG1 3.3Å; N304-G308 VanDerWaalsContact O-CA 3.26Å; N304-G308 WeakPolarHBondContact O-CA 3.33Å; N304-G308 PolarHBondContact O-N 3.2Å; N304-G309 PolarHBondContact N-O 3.2Å; N304-L311 HydrophobicContact CB-CD2 4.08Å; N304-L311 HydrophobicContact CB-CG 4.28Å
305	T	97.3	Very high	94.9	Very high	136 Å²	136	96.7 Å²	96.7	83%	0.834	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-32.1	-178.2	-45.9	0	0	0	0	113.7
306	S	95.8	Very high	94.9	Very high	107 Å²	107	94.4 Å²	94.4	75%	0.748	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-37.9	-177	62.1	0	0	0	0	113.2	N304	N304-S306 VanDerWaalsContact C-N 3.29Å; N304-S306 PolarHBondContact O-N 3.45Å; N304-S306 PolarHBondContact OD1-N 3.02Å; N304-S306 PolarHBondContact OD1-OG 3.33Å
307	T	94.4	Very high	94.9	Very high	104 Å²	104	97 Å²	97	64%	0.638	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-18	-178	65.2	0	0	0	0	113.3	N304 G309	N304-T307 WeakPolarHBondContact CB-OG1 3.3Å; T307-G309 PolarHBondContact O-N 3.01Å; T307-G309 VanDerWaalsContact O-N 3.15Å; T307-G309 PolarHBondContact OG1-N 3.01Å
308	G	94.1	Very high	94.9	Very high	55 Å²	55	96.5 Å²	96.5	57%	0.567	54%	0.539	S	S	*	.			trans	67.4	2.1	-170.4	0	0	0	0	0	114	N304	N304-G308 VanDerWaalsContact O-CA 3.26Å; N304-G308 WeakPolarHBondContact O-CA 3.33Å; N304-G308 PolarHBondContact O-N 3.2Å
309	G	94.8	Very high	95	Very high	31 Å²	31	96 Å²	96	32%	0.32	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-74.8	141.1	-179.2	0	0	0	0	0	112	F303 N304 T307 L311	F303-G309 CarbonylContact C-O 3.58Å; F303-G309 WeakPolarHBondContact CA-O 3.32Å; F303-G309 WeakPolarHBondContact CB-O 3.09Å; N304-G309 PolarHBondContact N-O 3.2Å; T307-G309 PolarHBondContact O-N 3.01Å; T307-G309 VanDerWaalsContact O-N 3.15Å; T307-G309 PolarHBondContact OG1-N 3.01Å; G309-L311 PolarHBondContact O-N 3.2Å
310	L	95.8	Very high	95.1	Very high	103 Å²	103	94.1 Å²	94.1	54%	0.539	53%	0.531	S	S	.	.	B	Isolated β-bridge	trans	-58.4	134.1	172.4	-177	68.9	0	0	0	110	R301 T302	R301-L310 HydrophobicContact CB-CD1 3.9Å; R301-L310 HydrophobicContact CG-CD1 4.15Å; T302-L310 WeakPolarHBondContact O-CD1 3.44Å
311	L	94.8	Very high	95.2	Very high	52 Å²	52	94.6 Å²	94.6	27%	0.272	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-91.3	124.1	177.2	-72.9	170.9	0	0	0	110.1	T302 N304 G309 D315	T302-L311 HydrophobicContact CG2-CD1 4.1Å; T302-L311 PolarHBondContact O-N 3.04Å; N304-L311 HydrophobicContact CB-CD2 4.08Å; N304-L311 HydrophobicContact CB-CG 4.28Å; G309-L311 PolarHBondContact O-N 3.2Å; L311-D315 HydrophobicContact CD2-CB 3.75Å
312	L	94.1	Very high	95.4	Very high	96 Å²	96	93.3 Å²	93.3	50%	0.503	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-79.4	159.7	169.7	-60.3	175.8	0	0	0	110.2	S314 D315	L312-S314 PolarHBondContact O-N 3.4Å; L312-S314 VanDerWaalsContact O-N 3.11Å; L312-D315 WeakPolarHBondContact CB-OD2 3.35Å; L312-D315 PolarHBondContact N-OD2 3.25Å; L312-D315 WeakPolarHBondContact O-CB 3.41Å; L312-D315 PolarHBondContact O-N 2.89Å
313	P	92.8	Very high	95.4	Very high	100 Å²	100	92.5 Å²	92.5	65%	0.649	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-55.7	-28.3	175.1	-26.9	35.7	0	0	0	114	D315 T316	P313-D315 VanDerWaalsContact C-N 3.34Å; P313-T316 WeakPolarHBondContact O-CG2 3.11Å
314	S	93.1	Very high	95.3	Very high	97 Å²	97	93 Å²	93	68%	0.678	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-75.6	-17.4	175.5	54	0	0	0	0	114.3	L312 T316	L312-S314 PolarHBondContact O-N 3.4Å; L312-S314 VanDerWaalsContact O-N 3.11Å; S314-T316 VanDerWaalsContact C-N 3.31Å
315	D	93	Very high	95.4	Very high	93 Å²	93	99.3 Å²	99.3	50%	0.497	57%	0.574	S	S	.	*	G	3₁₀ helix	trans	-87.8	-3.7	-177.9	-57.6	-30.8	0	0	0	112.2	L311 L312 P313	L311-D315 HydrophobicContact CD2-CB 3.75Å; L312-D315 WeakPolarHBondContact CB-OD2 3.35Å; L312-D315 PolarHBondContact N-OD2 3.25Å; L312-D315 WeakPolarHBondContact O-CB 3.41Å; L312-D315 PolarHBondContact O-N 2.89Å; P313-D315 VanDerWaalsContact C-N 3.34Å
316	T	94.3	Very high	95.4	Very high	52 Å²	52	98.5 Å²	98.5	32%	0.319	56%	0.561	S	S	.	*			trans	-122.7	138.1	-176.3	-178.6	0	0	0	0	112	P313 S314 R318	P313-T316 WeakPolarHBondContact O-CG2 3.11Å; S314-T316 VanDerWaalsContact C-N 3.31Å; T316-R318 PolarHBondContact OG1-NH1 2.94Å
317	K	95.3	Very high	95.5	Very high	123 Å²	123	97 Å²	97	54%	0.535	54%	0.544	S	S	.	.			trans	-112.3	163.1	170.6	-56.5	-164.7	-178.2	-146.4	0	110.9	I328 E330	K317-I328 HydrophobicContact CB-CG2 3.74Å; K317-I328 HydrophobicContact CD-CG2 3.54Å; K317-I328 HydrophobicContact CG-CG2 4.28Å; K317-E330 WeakPolarHBondContact CD-OE1 3.1Å; K317-E330 WeakPolarHBondContact CE-OE1 3.37Å; K317-E330 IonicContact NZ-OE1 2.64Å; K317-E330 PolarHBondContact NZ-OE1 2.76Å
318	R	96.3	Very high	95.6	Very high	93 Å²	93	95.8 Å²	95.8	35%	0.351	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	141.5	172.7	-58.4	-63.3	176.5	-95.6	2.4	109.2	T316 I328 L329 T334	T316-R318 PolarHBondContact OG1-NH1 2.94Å; R318-I328 WeakPolarHBondContact O-CA 3.45Å; R318-L329 WeakPolarHBondContact CA-O 3.28Å; R318-L329 WeakPolarHBondContact CB-O 3.32Å; R318-L329 PolarHBondContact N-O 3.34Å; R318-L329 PolarHBondContact O-N 2.77Å; R318-T334 HydrophobicContact CB-CG2 3.93Å; R318-T334 HydrophobicContact CG-CG2 4.02Å
319	S	96.6	Very high	95.7	Very high	60 Å²	60	95.7 Å²	95.7	42%	0.42	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	138.4	-177.3	175.6	0	0	0	0	110.5	Q326 I327	S319-Q326 WeakPolarHBondContact OG-CG 3.13Å; S319-Q326 PolarHBondContact OG-NE2 3.01Å; S319-I327 WeakPolarHBondContact CA-O 3.28Å
320	Q	97.1	Very high	95.8	Very high	113 Å²	113	97.2 Å²	97.2	53%	0.528	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	139.1	167.2	-65.7	-177.3	9.5	0	0	109.4	Y322 I327	Q320-Y322 HydrophobicContact CB-CD2 4.41Å; Q320-Y322 HydrophobicContact CB-CE2 3.87Å; Q320-Y322 PolarHBondContact OE1-OH 3.37Å; Q320-I327 PolarHBondContact N-O 2.61Å; Q320-I327 PolarHBondContact O-N 2.94Å
321	I	97.8	Very high	95.7	Very high	115 Å²	115	97.6 Å²	97.6	59%	0.59	52%	0.515	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.3	123.4	-176.4	-58.5	172.6	0	0	0	108.6	Q326	I321-Q326 HydrophobicContact CG1-CB 4.41Å; I321-Q326 HydrophobicContact CG1-CG 4.16Å
322	Y	97.1	Very high	95.7	Very high	151 Å²	151	102.7 Å²	102.7	59%	0.592	54%	0.537	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.7	112.3	175.6	-69.9	-87.3	0	0	0	109.3	Q320 S324 R325 I327	Q320-Y322 HydrophobicContact CB-CD2 4.41Å; Q320-Y322 HydrophobicContact CB-CE2 3.87Å; Q320-Y322 PolarHBondContact OE1-OH 3.37Å; Y322-S324 PolarHBondContact O-N 3.37Å; Y322-R325 PolarHBondContact N-O 3.37Å; Y322-R325 PolarHBondContact O-N 3.06Å; Y322-R325 VanDerWaalsContact O-N 3.1Å; Y322-I327 HydrophobicContact CD2-CD1 3.96Å; Y322-I327 HydrophobicContact CE2-CD1 4.46Å
323	G	95.8	Very high	95.8	Very high	80 Å²	80	102.3 Å²	102.3	83%	0.825	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	-119.3	-172.9	0	0	0	0	0	111.1
324	S	95.7	Very high	95.9	Very high	132 Å²	132	98.8 Å²	98.8	92%	0.923	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	10	177.2	56.7	0	0	0	0	114	Y322	Y322-S324 PolarHBondContact O-N 3.37Å
325	R	96.9	Very high	95.9	Very high	193 Å²	193	97.2 Å²	97.2	73%	0.728	49%	0.491	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.1	-177.7	-163.8	171.3	-175	172.6	0.5	111.2	Y322	Y322-R325 PolarHBondContact N-O 3.37Å; Y322-R325 PolarHBondContact O-N 3.06Å; Y322-R325 VanDerWaalsContact O-N 3.1Å
326	Q	97.5	Very high	96	Very high	119 Å²	119	98.2 Å²	98.2	56%	0.556	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.9	129.9	172	-172.2	174.1	20.6	0	0	109.8	S319 I321 I328	S319-Q326 WeakPolarHBondContact OG-CG 3.13Å; S319-Q326 PolarHBondContact OG-NE2 3.01Å; I321-Q326 HydrophobicContact CG1-CB 4.41Å; I321-Q326 HydrophobicContact CG1-CG 4.16Å; Q326-I328 HydrophobicContact CG-CD1 3.7Å; Q326-I328 HydrophobicContact CG-CG1 4.33Å
327	I	97.9	Very high	96	Very high	76 Å²	76	100.7 Å²	100.7	39%	0.39	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	121.2	175.8	-56.6	176	0	0	0	107	S319 Q320 Y322 L329	S319-I327 WeakPolarHBondContact CA-O 3.28Å; Q320-I327 PolarHBondContact N-O 2.61Å; Q320-I327 PolarHBondContact O-N 2.94Å; Y322-I327 HydrophobicContact CD2-CD1 3.96Å; Y322-I327 HydrophobicContact CE2-CD1 4.46Å; I327-L329 HydrophobicContact CG2-CG 4.36Å
328	I	97.2	Very high	96	Very high	78 Å²	78	98.5 Å²	98.5	40%	0.4	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	132.8	178.6	-55.2	-59.8	0	0	0	108.3	K317 R318 Q326	K317-I328 HydrophobicContact CB-CG2 3.74Å; K317-I328 HydrophobicContact CD-CG2 3.54Å; K317-I328 HydrophobicContact CG-CG2 4.28Å; R318-I328 WeakPolarHBondContact O-CA 3.45Å; Q326-I328 HydrophobicContact CG-CD1 3.7Å; Q326-I328 HydrophobicContact CG-CG1 4.33Å
329	L	96.4	Very high	96	Very high	52 Å²	52	101 Å²	101	27%	0.272	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	150	175.8	-63.8	174.8	0	0	0	109.5	R318 I327 E333 T334 L337	R318-L329 WeakPolarHBondContact CA-O 3.28Å; R318-L329 WeakPolarHBondContact CB-O 3.32Å; R318-L329 PolarHBondContact N-O 3.34Å; R318-L329 PolarHBondContact O-N 2.77Å; I327-L329 HydrophobicContact CG2-CG 4.36Å; L329-E333 VanDerWaalsContact CA-OE2 3.24Å; L329-E333 WeakPolarHBondContact CA-OE2 3.21Å; L329-E333 HydrophobicContact CB-CB 4.26Å; L329-E333 HydrophobicContact CD2-CB 4.38Å; L329-T334 HydrophobicContact CB-CG2 3.95Å; L329-T334 HydrophobicContact CD1-CG2 4.13Å; L329-L337 HydrophobicContact CD1-CD2 4.19Å
330	E	95.8	Very high	95.9	Very high	64 Å²	64	104.5 Å²	104.5	30%	0.299	51%	0.512	S	S	.	.			trans	-71.9	159.1	166.9	-60	-58.1	160.6	0	0	110.9	K317 E332 E333 T334	K317-E330 WeakPolarHBondContact CD-OE1 3.1Å; K317-E330 WeakPolarHBondContact CE-OE1 3.37Å; K317-E330 IonicContact NZ-OE1 2.64Å; K317-E330 PolarHBondContact NZ-OE1 2.76Å; E330-E332 PolarHBondContact O-N 3Å; E330-E333 HydrophobicContact CB-CG 4.17Å; E330-E333 PolarHBondContact N-OE2 2.94Å; E330-E333 PolarHBondContact O-N 2.99Å; E330-T334 PolarHBondContact O-N 3.41Å
331	K	94.6	Very high	95.7	Very high	111 Å²	111	100.6 Å²	100.6	48%	0.483	49%	0.494	S	S	.	.	H	α-helix	trans	-55.8	-40.9	175	-177.2	-175.4	174.8	-175	0	110.8	T334 E335	K331-T334 PolarHBondContact O-N 2.91Å; K331-T334 PolarHBondContact O-OG1 3.29Å; K331-E335 PolarHBondContact O-N 2.92Å
332	E	94.6	Very high	95.5	Very high	159 Å²	159	100.2 Å²	100.2	74%	0.743	49%	0.493	S	S	*	.	H	α-helix	trans	-62.7	-44	-180	-64.1	169.4	174.6	0	0	112	E330 T334 E335 E336	E330-E332 PolarHBondContact O-N 3Å; E332-T334 VanDerWaalsContact C-N 3.28Å; E332-T334 PolarHBondContact O-N 2.88Å; E332-E335 PolarHBondContact O-N 3Å; E332-E335 VanDerWaalsContact O-N 3.09Å; E332-E336 WeakPolarHBondContact O-CB 3.4Å; E332-E336 PolarHBondContact O-N 2.8Å
333	E	95.4	Very high	95.5	Very high	87 Å²	87	94.3 Å²	94.3	41%	0.407	47%	0.473	S	S	.	.	H	α-helix	trans	-62.9	-35.5	177.4	-65.3	178.6	132.2	0	0	111.6	L329 E330 E335 E336 L337	L329-E333 VanDerWaalsContact CA-OE2 3.24Å; L329-E333 WeakPolarHBondContact CA-OE2 3.21Å; L329-E333 HydrophobicContact CB-CB 4.26Å; L329-E333 HydrophobicContact CD2-CB 4.38Å; E330-E333 HydrophobicContact CB-CG 4.17Å; E330-E333 PolarHBondContact N-OE2 2.94Å; E330-E333 PolarHBondContact O-N 2.99Å; E333-E335 VanDerWaalsContact C-N 3.25Å; E333-E335 PolarHBondContact O-N 3.37Å; E333-E336 PolarHBondContact O-N 3.27Å; E333-L337 WeakPolarHBondContact O-CG 3.2Å; E333-L337 PolarHBondContact O-N 3.45Å
334	T	94.8	Very high	95.5	Very high	26 Å²	26	90.5 Å²	90.5	16%	0.16	44%	0.435	C	S	.	.	H	α-helix	trans	-68.9	-21.8	176.4	64.1	0	0	0	0	114.2	R318 L329 E330 K331 E332 L337 K338	R318-T334 HydrophobicContact CB-CG2 3.93Å; R318-T334 HydrophobicContact CG-CG2 4.02Å; L329-T334 HydrophobicContact CB-CG2 3.95Å; L329-T334 HydrophobicContact CD1-CG2 4.13Å; E330-T334 PolarHBondContact O-N 3.41Å; K331-T334 PolarHBondContact O-N 2.91Å; K331-T334 PolarHBondContact O-OG1 3.29Å; E332-T334 VanDerWaalsContact C-N 3.28Å; E332-T334 PolarHBondContact O-N 2.88Å; T334-L337 WeakPolarHBondContact O-CG 3.46Å; T334-K338 WeakPolarHBondContact O-CE 3.4Å
335	E	94.1	Very high	95.6	Very high	65 Å²	65	84.2 Å²	84.2	30%	0.304	39%	0.391	S	S	.	.	H	α-helix	trans	-90.9	-35.1	172.7	-67.1	-57	124.2	0	0	111.4	K331 E332 E333 L337 K338 R339 N405	K331-E335 PolarHBondContact O-N 2.92Å; E332-E335 PolarHBondContact O-N 3Å; E332-E335 VanDerWaalsContact O-N 3.09Å; E333-E335 VanDerWaalsContact C-N 3.25Å; E333-E335 PolarHBondContact O-N 3.37Å; E335-L337 PolarHBondContact O-N 3.17Å; E335-K338 WeakPolarHBondContact O-CB 3.36Å; E335-K338 PolarHBondContact O-N 3.33Å; E335-K338 VanDerWaalsContact O-N 3.11Å; E335-K338 IonicContact OE1-NZ 2.66Å; E335-K338 PolarHBondContact OE1-NZ 3.32Å; E335-K338 IonicContact OE2-NZ 3.78Å; E335-R339 PolarHBondContact O-N 2.98Å; E335-N405 HydrophobicContact CB-CB 4.33Å
336	E	95.8	Very high	95.6	Very high	113 Å²	113	78.1 Å²	78.1	53%	0.528	37%	0.371	S	S	.	.	H	α-helix	trans	-62.4	-41.5	177	-177.5	168	-150.3	0	0	112.1	E332 E333 K338 R339	E332-E336 WeakPolarHBondContact O-CB 3.4Å; E332-E336 PolarHBondContact O-N 2.8Å; E333-E336 PolarHBondContact O-N 3.27Å; E336-K338 PolarHBondContact O-N 2.97Å; E336-R339 WeakPolarHBondContact O-CB 3.4Å; E336-R339 PolarHBondContact O-N 3.26Å; E336-R339 IonicContact OE1-NH2 2.8Å
337	L	94.6	Very high	95.7	Very high	105 Å²	105	74.3 Å²	74.3	55%	0.55	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-16.4	177	67.2	83.5	0	0	0	113.6	L329 E333 T334 E335	L329-L337 HydrophobicContact CD1-CD2 4.19Å; E333-L337 WeakPolarHBondContact O-CG 3.2Å; E333-L337 PolarHBondContact O-N 3.45Å; T334-L337 WeakPolarHBondContact O-CG 3.46Å; E335-L337 PolarHBondContact O-N 3.17Å
338	K	95.1	Very high	95.7	Very high	76 Å²	76	75.2 Å²	75.2	33%	0.33	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-8.4	176	-60.8	176.6	-169.1	159.3	0	112.7	T334 E335 E336 F340 N405 I406 P407	T334-K338 WeakPolarHBondContact O-CE 3.4Å; E335-K338 WeakPolarHBondContact O-CB 3.36Å; E335-K338 PolarHBondContact O-N 3.33Å; E335-K338 VanDerWaalsContact O-N 3.11Å; E335-K338 IonicContact OE1-NZ 2.66Å; E335-K338 PolarHBondContact OE1-NZ 3.32Å; E335-K338 IonicContact OE2-NZ 3.78Å; E336-K338 PolarHBondContact O-N 2.97Å; K338-F340 WeakPolarHBondContact O-CD2 3.4Å; K338-N405 WeakPolarHBondContact CB-O 3.44Å; K338-I406 CarbonylContact O-C 3.57Å; K338-P407 HydrophobicContact CB-CG 4.43Å
339	R	95.2	Very high	95.6	Very high	147 Å²	147	72.8 Å²	72.8	56%	0.555	35%	0.352	S	S	*	.			trans	-85.7	120.3	-175.8	-170.4	-179.7	70.3	-177	-4.5	110.6	E335 E336	E335-R339 PolarHBondContact O-N 2.98Å; E336-R339 WeakPolarHBondContact O-CB 3.4Å; E336-R339 PolarHBondContact O-N 3.26Å; E336-R339 IonicContact OE1-NH2 2.8Å
340	F	94.3	Very high	95.7	Very high	133 Å²	133	75.2 Å²	75.2	58%	0.583	36%	0.361	S	S	*	.			trans	-122.9	-67.1	176.6	-71.4	-100.5	0	0	0	111.3	K338 P407 P408	K338-F340 WeakPolarHBondContact O-CD2 3.4Å; F340-P407 HydrophobicContact CD2-CB 4.18Å; F340-P407 HydrophobicContact CE2-CB 4.05Å; F340-P407 HydrophobicContact CE2-CG 4.21Å; F340-P408 HydrophobicContact CB-CG 4.1Å; F340-P408 HydrophobicContact CG-CG 4.32Å
341	D	93.3	Very high	95.8	Very high	31 Å²	31	76 Å²	76	17%	0.166	36%	0.363	C	S	.	.	S	Bend	trans	-111.8	163.1	178.6	-63.3	-49.2	0	0	0	111	R399	D341-R399 VanDerWaalsContact CG-NH2 3.3Å; D341-R399 IonicContact OD1-CZ 3.22Å; D341-R399 IonicContact OD1-NE 2.65Å; D341-R399 IonicContact OD1-NH2 3.15Å; D341-R399 PolarHBondContact OD1-NH2 2.85Å; D341-R399 IonicContact OD2-CZ 3.56Å; D341-R399 VanDerWaalsContact OD2-CZ 3.22Å; D341-R399 IonicContact OD2-NE 2.71Å; D341-R399 PolarHBondContact OD2-NE 2.94Å; D341-R399 IonicContact OD2-NH2 3.56Å; D341-R399 PolarHBondContact OD2-NH2 3.44Å; D341-R399 VanDerWaalsContact OD2-NH2 3.15Å
342	D	93.9	Very high	95.9	Very high	106 Å²	106	73.7 Å²	73.7	57%	0.567	36%	0.36	S	S	*	.			trans	-71.4	154.1	164.7	-67.5	-44.3	0	0	0	111.5	G344	D342-G344 PolarHBondContact O-N 3.46Å
343	P	96.4	Very high	96	Very high	27 Å²	27	68.7 Å²	68.7	18%	0.175	34%	0.338	C	S	.	.	S	Bend	trans	-53.4	132.1	177	-25.7	34.6	0	0	0	112.9	L259 T401 R404	L259-P343 HydrophobicContact CD2-CB 4.19Å; P343-T401 CarbonylContact C-O 3.54Å; P343-T401 VanDerWaalsContact CA-O 3.31Å; P343-T401 WeakPolarHBondContact CA-O 3.28Å; P343-R404 HydrophobicContact CG-CG 3.71Å
344	G	95.5	Very high	96	Very high	1 Å²	1	70.6 Å²	70.6	1%	0.01	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	150.5	-173	-178.6	0	0	0	0	0	114.6	K260 D342 T401	K260-G344 WeakPolarHBondContact O-CA 3.28Å; D342-G344 PolarHBondContact O-N 3.46Å; G344-T401 PolarHBondContact N-O 3.31Å; G344-T401 PolarHBondContact O-N 2.81Å
345	L	97.9	Very high	96.1	Very high	0 Å²	0	74.3 Å²	74.3	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	114.2	173.8	-74.5	157.7	0	0	0	108.1	K260 L261 K262 V271 C398 Y400 V411 L434	K260-L345 PolarHBondContact O-N 3.08Å; L261-L345 CarbonylContact C-O 3.55Å; L261-L345 WeakPolarHBondContact CA-O 3.14Å; L261-L345 HydrophobicContact CB-CB 4.29Å; L261-L345 HydrophobicContact CD1-CD1 4.47Å; L261-L345 HydrophobicContact CG-CB 4.1Å; K262-L345 PolarHBondContact N-O 3.46Å; V271-L345 HydrophobicContact CG2-CD1 4.04Å; L345-C398 HydrophobicContact CB-CB 4.48Å; L345-C398 HydrophobicContact CD2-CB 3.88Å; L345-Y400 HydrophobicContact CD2-CD2 3.55Å; L345-Y400 HydrophobicContact CD2-CG 4.05Å; L345-Y400 HydrophobicContact CG-CD2 3.98Å; L345-V411 HydrophobicContact CD2-CG2 3.86Å; L345-L434 HydrophobicContact CD2-CD1 4.17Å
346	M	97.9	Very high	96.2	Very high	64 Å²	64	73.3 Å²	73.3	32%	0.315	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	119.2	174.1	-61.5	-172.1	73.5	0	0	109.6	K262 M348 C398 R399	K262-M346 HydrophobicContact CD-CG 4.3Å; M346-M348 PolarHBondContact O-N 3.41Å; M346-C398 CarbonylContact O-C 3.57Å; M346-C398 WeakPolarHBondContact O-CA 3.49Å; M346-R399 HydrophobicContact CB-CB 4.4Å; M346-R399 PolarHBondContact N-O 3.1Å; M346-R399 PolarHBondContact O-N 2.83Å
347	L	98.3	Very high	96.2	Very high	39 Å²	39	73.5 Å²	73.5	20%	0.204	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	125	177.8	-176.4	64.9	0	0	0	110.4	K262 L263 F350 A396	K262-L347 PolarHBondContact O-N 3.49Å; L263-L347 HydrophobicContact CB-CD2 4.41Å; L263-L347 HydrophobicContact CG-CD2 4.11Å; L347-F350 HydrophobicContact CD2-CE2 4.21Å; L347-F350 HydrophobicContact CD2-CZ 4.23Å; L347-A396 HydrophobicContact CD1-CB 3.76Å
348	M	97.8	Very high	96.2	Very high	95 Å²	95	78.4 Å²	78.4	47%	0.468	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-29.6	175.8	-56.6	-60.3	-59.5	0	0	111.6	M346 L397 R399 F410	M346-M348 PolarHBondContact O-N 3.41Å; M348-L397 WeakPolarHBondContact CA-O 2.87Å; M348-L397 HydrophobicContact CB-CB 4.41Å; M348-L397 HydrophobicContact CB-CD2 4.26Å; M348-L397 HydrophobicContact CB-CG 4.18Å; M348-L397 VanDerWaalsContact CB-O 3.31Å; M348-L397 WeakPolarHBondContact CB-O 3.45Å; M348-L397 PolarHBondContact N-O 3.47Å; M348-R399 HydrophobicContact CG-CB 4.33Å; M348-R399 HydrophobicContact SD-CB 4Å; M348-F410 HydrophobicContact CE-CE1 4.28Å; M348-F410 HydrophobicContact CG-CD1 4.47Å; M348-F410 HydrophobicContact CG-CE1 4.09Å; M348-F410 HydrophobicContact SD-CE1 4.43Å
349	G	96.8	Very high	96.2	Very high	27 Å²	27	81.6 Å²	81.6	28%	0.278	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	150.5	-168.3	-178.5	0	0	0	0	0	111.6	L397	G349-L397 PolarHBondContact N-O 3Å; G349-L397 PolarHBondContact O-N 3.42Å
350	F	98.1	Very high	96.3	Very high	104 Å²	104	77 Å²	77	46%	0.456	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	140.2	-179.9	-61.6	-91.1	0	0	0	110.6	L347 L385 V394 A395 A396	L347-F350 HydrophobicContact CD2-CE2 4.21Å; L347-F350 HydrophobicContact CD2-CZ 4.23Å; F350-L385 HydrophobicContact CE1-CD2 4.36Å; F350-L385 HydrophobicContact CZ-CD2 3.97Å; F350-V394 HydrophobicContact CB-CB 4.34Å; F350-V394 HydrophobicContact CB-CG2 4.29Å; F350-V394 HydrophobicContact CD1-CG2 4.13Å; F350-A395 CarbonylContact C-O 3.6Å; F350-A395 WeakPolarHBondContact CA-O 3.26Å; F350-A396 HydrophobicContact CD1-CB 4.09Å; F350-A396 HydrophobicContact CE1-CB 3.88Å
351	K	96.8	Very high	96.4	Very high	79 Å²	79	78.1 Å²	78.1	34%	0.343	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	133.1	-179.1	-173.7	173.2	-74	178.5	0	110	L355 V394 A395	K351-L355 HydrophobicContact CD-CB 4.04Å; K351-L355 HydrophobicContact CD-CD1 4.07Å; K351-L355 HydrophobicContact CG-CB 4.1Å; K351-L355 HydrophobicContact CG-CD1 3.73Å; K351-L355 HydrophobicContact CG-CG 4.48Å; K351-V394 WeakPolarHBondContact O-CA 3.33Å; K351-A395 PolarHBondContact N-O 3.05Å; K351-A395 PolarHBondContact O-N 3.48Å
352	P	98	Very high	96.4	Very high	63 Å²	63	79.2 Å²	79.2	41%	0.409	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	139.3	174.8	-26.9	34.5	0	0	0	113	V354 L355	P352-V354 HydrophobicContact CB-CG2 3.99Å; P352-V354 PolarHBondContact O-N 3.35Å; P352-L355 PolarHBondContact O-N 3.19Å; P352-L355 VanDerWaalsContact O-N 3.12Å
353	L	95.6	Very high	96.5	Very high	55 Å²	55	80.6 Å²	80.6	29%	0.288	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-59.7	-31.7	-177.5	-68.7	174.3	0	0	0	112.9	L355 L356 E393 A395 V414	L353-L355 PolarHBondContact O-N 3.3Å; L353-L355 VanDerWaalsContact O-N 3.09Å; L353-L356 HydrophobicContact CD2-CD1 4.12Å; L353-L356 WeakPolarHBondContact O-CB 3.43Å; L353-L356 PolarHBondContact O-N 3.15Å; L353-E393 HydrophobicContact CD1-CB 4.32Å; L353-E393 WeakPolarHBondContact CG-O 3.32Å; L353-E393 PolarHBondContact N-O 3.2Å; L353-A395 HydrophobicContact CD2-CB 3.74Å; L353-V414 HydrophobicContact CD2-CB 4.47Å; L353-V414 HydrophobicContact CD2-CG1 3.89Å; L353-V414 HydrophobicContact CD2-CG2 4.22Å
354	V	96.7	Very high	96.5	Very high	127 Å²	127	82.1 Å²	82.1	77%	0.77	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-59.9	-21.8	178	-59.6	0	0	0	0	114.1	P352 L356	P352-V354 HydrophobicContact CB-CG2 3.99Å; P352-V354 PolarHBondContact O-N 3.35Å; V354-L356 VanDerWaalsContact C-N 3.33Å
355	L	96.3	Very high	96.6	Very high	104 Å²	104	83.3 Å²	83.3	55%	0.545	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-82.1	-14.7	176.8	-62.6	179.6	0	0	0	112.5	K351 P352 L353	K351-L355 HydrophobicContact CD-CB 4.04Å; K351-L355 HydrophobicContact CD-CD1 4.07Å; K351-L355 HydrophobicContact CG-CB 4.1Å; K351-L355 HydrophobicContact CG-CD1 3.73Å; K351-L355 HydrophobicContact CG-CG 4.48Å; P352-L355 PolarHBondContact O-N 3.19Å; P352-L355 VanDerWaalsContact O-N 3.12Å; L353-L355 PolarHBondContact O-N 3.3Å; L353-L355 VanDerWaalsContact O-N 3.09Å
356	L	95.6	Very high	96.6	Very high	43 Å²	43	84 Å²	84	23%	0.225	41%	0.412	C	S	.	.	S	Bend	trans	-85.3	111.3	175.2	-57.7	-179.3	0	0	0	109.1	L353 V354 A395 A412 V414 L437	L353-L356 HydrophobicContact CD2-CD1 4.12Å; L353-L356 WeakPolarHBondContact O-CB 3.43Å; L353-L356 PolarHBondContact O-N 3.15Å; V354-L356 VanDerWaalsContact C-N 3.33Å; L356-A395 HydrophobicContact CD1-CB 3.85Å; L356-A412 HydrophobicContact CD1-CB 3.72Å; L356-A412 HydrophobicContact CD2-CB 3.99Å; L356-V414 HydrophobicContact CD1-CG2 3.78Å; L356-L437 HydrophobicContact CD2-CD2 4.01Å
357	K	95.4	Very high	96.6	Very high	118 Å²	118	81.6 Å²	81.6	51%	0.513	40%	0.4	S	S	.	.			trans	-89.3	132	-177.2	-59.1	-173.5	-176.1	-178.7	0	110.6	H359 H360	K357-H359 WeakPolarHBondContact CD-NE2 3.4Å; K357-H359 PolarHBondContact O-N 3.28Å; K357-H360 WeakPolarHBondContact O-CB 3.45Å; K357-H360 PolarHBondContact O-N 3.38Å
358	K	95.6	Very high	96.6	Very high	208 Å²	208	79.7 Å²	79.7	90%	0.904	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-34.8	178.4	-169.1	173.3	-176.6	175.1	0	114	H360	K358-H360 VanDerWaalsContact C-N 3.29Å; K358-H360 PolarHBondContact O-N 3.2Å
359	H	95.1	Very high	96.5	Very high	142 Å²	142	79 Å²	79	66%	0.657	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-2.6	-179.8	58.2	-99.4	0	0	0	114.3	K357 Y361	K357-H359 WeakPolarHBondContact CD-NE2 3.4Å; K357-H359 PolarHBondContact O-N 3.28Å; H359-Y361 PolarHBondContact O-N 2.88Å
360	H	96.3	Very high	96.4	Very high	52 Å²	52	78.2 Å²	78.2	24%	0.241	37%	0.373	C	S	.	.			trans	-86.7	35.8	172.6	-69.7	174.8	0	0	0	111.9	K357 K358 P438	K357-H360 WeakPolarHBondContact O-CB 3.45Å; K357-H360 PolarHBondContact O-N 3.38Å; K358-H360 VanDerWaalsContact C-N 3.29Å; K358-H360 PolarHBondContact O-N 3.2Å; H360-P438 HydrophobicContact CB-CG 3.93Å; H360-P438 WeakPolarHBondContact O-CD 3.44Å
361	Y	96.8	Very high	96.2	Very high	155 Å²	155	74.2 Å²	74.2	61%	0.608	36%	0.356	S	S	*	.			trans	-72.6	130	172.7	169.3	-96	0	0	0	110.1	H359 R363 P364	H359-Y361 PolarHBondContact O-N 2.88Å; Y361-R363 WeakPolarHBondContact CE2-O 3.22Å; Y361-P364 WeakPolarHBondContact OH-CD 3.43Å
362	L	94.6	Very high	95.9	Very high	55 Å²	55	73.6 Å²	73.6	29%	0.288	35%	0.354	S	S	.	.			trans	-109.5	-52.6	177.6	-179	65.7	0	0	0	112.1	Y409 F436 D442	L362-Y409 HydrophobicContact CD2-CD1 4.35Å; L362-Y409 HydrophobicContact CD2-CE1 3.97Å; L362-F436 HydrophobicContact CB-CB 4.33Å; L362-F436 HydrophobicContact CD2-CB 4.32Å; L362-D442 HydrophobicContact CD1-CB 4.11Å
363	R	95.3	Very high	95.5	Very high	135 Å²	135	74.6 Å²	74.6	51%	0.509	36%	0.363	S	S	.	.	S	Bend	trans	-154.7	164.8	-174.1	66.3	174.7	-78.1	165.6	-2.4	108.9	Y361 S365 F436	Y361-R363 WeakPolarHBondContact CE2-O 3.22Å; R363-S365 PolarHBondContact O-N 3.37Å; R363-F436 HydrophobicContact CG-CB 3.88Å; R363-F436 HydrophobicContact CG-CD1 4.1Å; R363-F436 HydrophobicContact CG-CD2 3.41Å; R363-F436 VanDerWaalsContact CG-CD2 3.41Å; R363-F436 HydrophobicContact CG-CE2 3.91Å; R363-F436 HydrophobicContact CG-CG 3.52Å; R363-F436 HydrophobicContact CG-CZ 4.44Å
364	P	96.1	Very high	95.2	Very high	58 Å²	58	75.9 Å²	75.9	38%	0.377	37%	0.369	S	S	.	.			trans	-56.8	136.7	-176.5	22.1	-34.5	0	0	0	111.6	V277 Y361 F436	V277-P364 HydrophobicContact CG2-CB 3.96Å; Y361-P364 WeakPolarHBondContact OH-CD 3.43Å; P364-F436 WeakPolarHBondContact O-CE2 3.44Å
365	S	97.3	Very high	95	Very high	26 Å²	26	72.4 Å²	72.4	18%	0.182	35%	0.348	C	S	.	.			trans	-65.6	152	174.9	-55.7	0	0	0	0	110.8	R363 L434	R363-S365 PolarHBondContact O-N 3.37Å; S365-L434 VanDerWaalsContact CA-O 3.24Å; S365-L434 WeakPolarHBondContact CA-O 3.34Å; S365-L434 WeakPolarHBondContact CB-O 3.35Å
366	L	97.6	Very high	95	Very high	15 Å²	15	75 Å²	75	8%	0.079	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	170.5	170.8	-56	173	0	0	0	109.5	L256 V273 N275 L434 F436	L256-L366 HydrophobicContact CD2-CD1 4.4Å; L256-L366 HydrophobicContact CD2-CD2 4.19Å; V273-L366 HydrophobicContact CG1-CB 3.79Å; V273-L366 HydrophobicContact CG1-CD1 3.57Å; V273-L366 HydrophobicContact CG1-CG 4.2Å; N275-L366 HydrophobicContact CB-CD2 4.2Å; L366-L434 HydrophobicContact CB-CB 4.1Å; L366-L434 HydrophobicContact CB-CD2 4.38Å; L366-L434 HydrophobicContact CD1-CD2 4.4Å; L366-L434 PolarHBondContact N-O 3.32Å; L366-L434 PolarHBondContact O-N 3.09Å; L366-F436 HydrophobicContact CD1-CE2 4.2Å; L366-F436 HydrophobicContact CD1-CZ 3.91Å; L366-F436 HydrophobicContact CG-CE2 4.06Å; L366-F436 HydrophobicContact CG-CZ 4.29Å
367	F	98.1	Very high	94.9	Very high	13 Å²	13	74.5 Å²	74.5	6%	0.057	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	136.4	174.6	-178.2	-107.3	0	0	0	109.8	V273 Y274 L276 Y369 P429 P430	V273-F367 CarbonylContact C-O 3.13Å; V273-F367 WeakPolarHBondContact CA-O 3.46Å; Y274-F367 HydrophobicContact CD2-CD1 4.28Å; Y274-F367 PolarHBondContact N-O 3.33Å; Y274-F367 PolarHBondContact O-N 3.31Å; L276-F367 HydrophobicContact CD1-CB 3.68Å; L276-F367 HydrophobicContact CD1-CD1 4.29Å; L276-F367 HydrophobicContact CD1-CD2 4.08Å; L276-F367 HydrophobicContact CD1-CG 3.77Å; L276-F367 HydrophobicContact CD2-CB 4.42Å; L276-F367 HydrophobicContact CG-CB 3.72Å; L276-F367 HydrophobicContact CG-CG 4.23Å; F367-Y369 AromaticContact CE1-CD2 3.97Å; F367-Y369 HydrophobicContact CE1-CD2 3.97Å; F367-Y369 HydrophobicContact CE1-CG 4.35Å; F367-Y369 HydrophobicContact CZ-CD2 4.24Å; F367-P429 HydrophobicContact CD2-CG 4.37Å; F367-P429 HydrophobicContact CE1-CB 4.17Å; F367-P429 HydrophobicContact CE1-CG 4.09Å; F367-P429 HydrophobicContact CE2-CB 4.31Å; F367-P429 HydrophobicContact CE2-CG 3.83Å; F367-P429 HydrophobicContact CZ-CB 3.72Å; F367-P429 HydrophobicContact CZ-CG 3.66Å; F367-P430 WeakPolarHBondContact CZ-O 3.31Å
368	V	97.8	Very high	94.8	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	128.8	-177.9	-173.2	0	0	0	0	108.4	V271 G272 F382 L413 F432 L434	V271-V368 HydrophobicContact CB-CG1 3.59Å; V271-V368 HydrophobicContact CG1-CG1 3.91Å; V271-V368 HydrophobicContact CG2-CG1 3.76Å; G272-V368 WeakPolarHBondContact O-CA 3.46Å; V368-F382 HydrophobicContact CG1-CE2 4.1Å; V368-F382 WeakPolarHBondContact O-CZ 3.47Å; V368-L413 HydrophobicContact CG2-CD2 3.92Å; V368-F432 HydrophobicContact CB-CB 4.3Å; V368-F432 PolarHBondContact N-O 2.68Å; V368-F432 PolarHBondContact O-N 3.01Å; V368-F432 VanDerWaalsContact O-N 3.17Å; V368-L434 HydrophobicContact CG2-CB 3.91Å; V368-L434 HydrophobicContact CG2-CD1 3.98Å
369	Y	96.4	Very high	94.8	Very high	79 Å²	79	60.8 Å²	60.8	31%	0.31	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	147.7	179.2	-163.2	-100.1	0	0	0	109.6	V271 G272 F367 P430	V271-Y369 CarbonylContact C-O 3.59Å; V271-Y369 VanDerWaalsContact CA-O 3.3Å; V271-Y369 WeakPolarHBondContact CA-O 3.34Å; G272-Y369 PolarHBondContact N-O 3.34Å; G272-Y369 PolarHBondContact O-N 2.94Å; F367-Y369 AromaticContact CE1-CD2 3.97Å; F367-Y369 HydrophobicContact CE1-CD2 3.97Å; F367-Y369 HydrophobicContact CE1-CG 4.35Å; F367-Y369 HydrophobicContact CZ-CD2 4.24Å; Y369-P430 WeakPolarHBondContact CD2-O 3.41Å; Y369-P430 WeakPolarHBondContact CE2-O 3.44Å
370	P	95.9	Very high	94.8	Very high	11 Å²	11	59.1 Å²	59.1	7%	0.071	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	144.1	-178.7	27.4	-34.7	0	0	0	111.5	F382	P370-F382 HydrophobicContact CB-CB 3.94Å; P370-F382 HydrophobicContact CB-CD1 4.35Å; P370-F382 HydrophobicContact CB-CD2 4.26Å; P370-F382 HydrophobicContact CB-CG 3.94Å; P370-F382 HydrophobicContact CG-CB 4.29Å; P370-F382 HydrophobicContact CG-CD1 3.93Å; P370-F382 HydrophobicContact CG-CE1 4.39Å; P370-F382 HydrophobicContact CG-CG 4.04Å
371	E	92.4	Very high	94.8	Very high	20 Å²	20	59.6 Å²	59.6	9%	0.093	32%	0.315	C	S	.	.			trans	-117.1	87.9	177	-177.3	81	-135.8	0	0	109.1	R258 S270 S373 L374	R258-E371 HydrophobicContact CG-CG 4.39Å; R258-E371 IonicContact CZ-OE1 3.87Å; R258-E371 IonicContact CZ-OE2 3.52Å; R258-E371 IonicContact NE-OE1 3.6Å; R258-E371 PolarHBondContact NE-OE1 3.34Å; R258-E371 IonicContact NE-OE2 2.61Å; R258-E371 PolarHBondContact NE-OE2 3.09Å; R258-E371 IonicContact NH2-OE1 3.68Å; R258-E371 PolarHBondContact NH2-OE1 3.23Å; R258-E371 IonicContact NH2-OE2 3.83Å; S270-E371 WeakPolarHBondContact CB-O 3.37Å; S270-E371 PolarHBondContact O-N 2.68Å; E371-S373 WeakPolarHBondContact CG-OG 3.32Å; E371-S373 PolarHBondContact O-N 3.1Å; E371-S373 PolarHBondContact OE1-OG 2.89Å; E371-L374 HydrophobicContact CG-CD1 4.16Å; E371-L374 HydrophobicContact CG-CG 4.15Å; E371-L374 PolarHBondContact O-N 3.32Å
372	E	90.9	Very high	94.9	Very high	66 Å²	66	52.4 Å²	52.4	31%	0.308	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-27.6	-175.9	-160.8	64.1	-162.4	0	0	113	L374 I376 G377 S378 S379	E372-L374 PolarHBondContact O-N 3.46Å; E372-L374 VanDerWaalsContact O-N 3.14Å; E372-I376 WeakPolarHBondContact OE1-CA 3.42Å; E372-G377 PolarHBondContact OE1-N 3.12Å; E372-S378 PolarHBondContact OE2-N 3.4Å; E372-S379 VanDerWaalsContact OE2-CB 3.24Å; E372-S379 WeakPolarHBondContact OE2-CB 3.44Å; E372-S379 PolarHBondContact OE2-N 3.25Å; E372-S379 PolarHBondContact OE2-OG 2.88Å
373	S	89.4	Confident	94.9	Very high	84 Å²	84	52.5 Å²	52.5	59%	0.587	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-25.4	-177.4	68.7	0	0	0	0	114.2	E371	E371-S373 WeakPolarHBondContact CG-OG 3.32Å; E371-S373 PolarHBondContact O-N 3.1Å; E371-S373 PolarHBondContact OE1-OG 2.89Å
374	L	90.2	Very high	95	Very high	82 Å²	82	48.4 Å²	48.4	43%	0.429	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-38.9	-176.8	-66.8	-179.8	0	0	0	113.1	R258 S270 E371 E372	R258-L374 HydrophobicContact CB-CD1 3.98Å; R258-L374 HydrophobicContact CG-CD1 4.5Å; S270-L374 WeakPolarHBondContact OG-CB 3.22Å; S270-L374 WeakPolarHBondContact OG-CD1 3.27Å; E371-L374 HydrophobicContact CG-CD1 4.16Å; E371-L374 HydrophobicContact CG-CG 4.15Å; E371-L374 PolarHBondContact O-N 3.32Å; E372-L374 PolarHBondContact O-N 3.46Å; E372-L374 VanDerWaalsContact O-N 3.14Å
375	V	92.9	Very high	95.1	Very high	55 Å²	55	47.3 Å²	47.3	33%	0.333	28%	0.278	S	S	.	.	S	Bend	trans	-138.6	107.1	-179.5	178.1	0	0	0	0	108.6	S378	V375-S378 WeakPolarHBondContact CB-OG 3.2Å; V375-S378 VanDerWaalsContact O-CB 3.25Å; V375-S378 WeakPolarHBondContact O-CB 3.14Å; V375-S378 PolarHBondContact O-N 2.96Å; V375-S378 PolarHBondContact O-OG 3.24Å
376	I	95.2	Very high	95.1	Very high	157 Å²	157	46.8 Å²	46.8	81%	0.805	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	135.4	179	-56.5	170.5	0	0	0	109.6	E372	E372-I376 WeakPolarHBondContact OE1-CA 3.42Å
377	G	93.1	Very high	95.1	Very high	33 Å²	33	50.5 Å²	50.5	34%	0.34	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.2	-0.7	-172.5	0	0	0	0	0	114.2	E372 T380 L381	E372-G377 PolarHBondContact OE1-N 3.12Å; G377-T380 PolarHBondContact O-N 3.21Å; G377-L381 PolarHBondContact O-N 3.01Å
378	S	94.3	Very high	95.1	Very high	0 Å²	0	55 Å²	55	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63.1	-45.3	179.3	-68.3	0	0	0	0	111.4	S270 E372 V375 T380 L381 F382	S270-S378 PolarHBondContact N-OG 3.4Å; E372-S378 PolarHBondContact OE2-N 3.4Å; V375-S378 WeakPolarHBondContact CB-OG 3.2Å; V375-S378 VanDerWaalsContact O-CB 3.25Å; V375-S378 WeakPolarHBondContact O-CB 3.14Å; V375-S378 PolarHBondContact O-N 2.96Å; V375-S378 PolarHBondContact O-OG 3.24Å; S378-T380 VanDerWaalsContact C-N 3.34Å; S378-T380 PolarHBondContact O-N 3.19Å; S378-L381 PolarHBondContact O-N 2.67Å; S378-F382 WeakPolarHBondContact O-CB 3.39Å; S378-F382 PolarHBondContact O-N 3.33Å
379	S	94.8	Very high	95	Very high	38 Å²	38	55.1 Å²	55.1	27%	0.266	31%	0.313	S	S	.	.	H	α-helix	trans	-62.1	-41	-178.4	-55.4	0	0	0	0	111.5	E372 F382 S383	E372-S379 VanDerWaalsContact OE2-CB 3.24Å; E372-S379 WeakPolarHBondContact OE2-CB 3.44Å; E372-S379 PolarHBondContact OE2-N 3.25Å; E372-S379 PolarHBondContact OE2-OG 2.88Å; S379-F382 PolarHBondContact O-N 2.83Å; S379-S383 WeakPolarHBondContact O-CB 3.23Å; S379-S383 PolarHBondContact O-N 3.14Å; S379-S383 PolarHBondContact O-OG 3.33Å
380	T	95.8	Very high	95.1	Very high	108 Å²	108	54.1 Å²	54.1	66%	0.663	31%	0.313	S	S	*	.	H	α-helix	trans	-62.5	-48.7	178	-48.5	0	0	0	0	112.3	G377 S378 A384	G377-T380 PolarHBondContact O-N 3.21Å; S378-T380 VanDerWaalsContact C-N 3.34Å; S378-T380 PolarHBondContact O-N 3.19Å; T380-A384 PolarHBondContact O-N 2.94Å; T380-A384 VanDerWaalsContact O-N 3.1Å
381	L	96.5	Very high	95.1	Very high	61 Å²	61	59.1 Å²	59.1	32%	0.319	34%	0.335	S	S	.	.	H	α-helix	trans	-69	-38.9	179.5	-171.7	70	0	0	0	111.5	L263 I267 I269 G377 S378 A384 L385	L263-L381 HydrophobicContact CD1-CD2 4Å; L263-L381 HydrophobicContact CD2-CD2 4.1Å; I267-L381 HydrophobicContact CG2-CD2 4.15Å; I269-L381 HydrophobicContact CG2-CB 4.11Å; I269-L381 HydrophobicContact CG2-CD2 3.5Å; I269-L381 HydrophobicContact CG2-CG 4.36Å; G377-L381 PolarHBondContact O-N 3.01Å; S378-L381 PolarHBondContact O-N 2.67Å; L381-A384 PolarHBondContact O-N 2.88Å; L381-L385 WeakPolarHBondContact O-CG 3.41Å; L381-L385 PolarHBondContact O-N 2.77Å
382	F	97.5	Very high	95.3	Very high	4 Å²	4	65 Å²	65	2%	0.018	36%	0.361	C	S	.	.	H	α-helix	trans	-61.1	-47.5	176.8	-175.8	-80.8	0	0	0	111.5	I269 V271 V368 P370 S378 S379 A384 L385 L386 F432	I269-F382 HydrophobicContact CD1-CB 4.27Å; I269-F382 HydrophobicContact CD1-CD2 4.38Å; V271-F382 HydrophobicContact CG1-CD2 4.05Å; V271-F382 HydrophobicContact CG1-CE2 4.2Å; V368-F382 HydrophobicContact CG1-CE2 4.1Å; V368-F382 WeakPolarHBondContact O-CZ 3.47Å; P370-F382 HydrophobicContact CB-CB 3.94Å; P370-F382 HydrophobicContact CB-CD1 4.35Å; P370-F382 HydrophobicContact CB-CD2 4.26Å; P370-F382 HydrophobicContact CB-CG 3.94Å; P370-F382 HydrophobicContact CG-CB 4.29Å; P370-F382 HydrophobicContact CG-CD1 3.93Å; P370-F382 HydrophobicContact CG-CE1 4.39Å; P370-F382 HydrophobicContact CG-CG 4.04Å; S378-F382 WeakPolarHBondContact O-CB 3.39Å; S378-F382 PolarHBondContact O-N 3.33Å; S379-F382 PolarHBondContact O-N 2.83Å; F382-A384 VanDerWaalsContact C-N 3.35Å; F382-A384 PolarHBondContact O-N 2.67Å; F382-L385 WeakPolarHBondContact O-CB 3.28Å; F382-L385 PolarHBondContact O-N 3.32Å; F382-L386 PolarHBondContact O-N 3.09Å; F382-F432 HydrophobicContact CD1-CE2 4.48Å; F382-F432 HydrophobicContact CD2-CD2 4.37Å; F382-F432 HydrophobicContact CD2-CE2 4.31Å; F382-F432 HydrophobicContact CE1-CD2 4.02Å; F382-F432 HydrophobicContact CE1-CE2 4.08Å; F382-F432 AromaticContact CE2-CD2 3.55Å; F382-F432 HydrophobicContact CE2-CD2 3.55Å; F382-F432 AromaticContact CE2-CE2 3.9Å; F382-F432 HydrophobicContact CE2-CE2 3.9Å; F382-F432 AromaticContact CZ-CD2 3.35Å; F382-F432 HydrophobicContact CZ-CD2 3.35Å; F382-F432 AromaticContact CZ-CE2 3.79Å; F382-F432 HydrophobicContact CZ-CE2 3.79Å; F382-F432 HydrophobicContact CZ-CG 4.48Å
383	S	96.3	Very high	95.7	Very high	57 Å²	57	68.4 Å²	68.4	40%	0.399	38%	0.376	S	S	.	.	H	α-helix	trans	-62	-41.4	176.7	-65.2	0	0	0	0	111.9	S379 L385 L386 I387	S379-S383 WeakPolarHBondContact O-CB 3.23Å; S379-S383 PolarHBondContact O-N 3.14Å; S379-S383 PolarHBondContact O-OG 3.33Å; S383-L385 VanDerWaalsContact C-N 3.34Å; S383-L385 PolarHBondContact O-N 3.29Å; S383-L386 PolarHBondContact O-N 3.34Å; S383-I387 VanDerWaalsContact O-CG1 3.28Å; S383-I387 WeakPolarHBondContact O-CG1 3.44Å; S383-I387 PolarHBondContact O-N 3.38Å
384	A	97.3	Very high	96.1	Very high	49 Å²	49	65.5 Å²	65.5	41%	0.405	36%	0.355	S	S	.	.	H	α-helix	trans	-61.7	-41.3	174.9	0	0	0	0	0	112.3	T380 L381 F382 K388	T380-A384 PolarHBondContact O-N 2.94Å; T380-A384 VanDerWaalsContact O-N 3.1Å; L381-A384 PolarHBondContact O-N 2.88Å; F382-A384 VanDerWaalsContact C-N 3.35Å; F382-A384 PolarHBondContact O-N 2.67Å; A384-K388 WeakPolarHBondContact O-CB 3.42Å; A384-K388 WeakPolarHBondContact O-CG 3.45Å; A384-K388 PolarHBondContact O-N 2.69Å; A384-K388 VanDerWaalsContact O-N 3.09Å
385	L	97	Very high	96.4	Very high	35 Å²	35	61.6 Å²	61.6	18%	0.183	34%	0.335	C	S	.	.	H	α-helix	trans	-63.5	-44.1	174.3	-76.2	169.6	0	0	0	111.5	F350 L381 F382 S383 K388 C389 F432	F350-L385 HydrophobicContact CE1-CD2 4.36Å; F350-L385 HydrophobicContact CZ-CD2 3.97Å; L381-L385 WeakPolarHBondContact O-CG 3.41Å; L381-L385 PolarHBondContact O-N 2.77Å; F382-L385 WeakPolarHBondContact O-CB 3.28Å; F382-L385 PolarHBondContact O-N 3.32Å; S383-L385 VanDerWaalsContact C-N 3.34Å; S383-L385 PolarHBondContact O-N 3.29Å; L385-K388 PolarHBondContact O-N 2.98Å; L385-C389 VanDerWaalsContact O-CB 3.25Å; L385-C389 WeakPolarHBondContact O-CB 3.07Å; L385-C389 PolarHBondContact O-N 2.93Å; L385-C389 PolarHBondContact O-SG 2.93Å; L385-F432 HydrophobicContact CB-CE2 4.44Å; L385-F432 HydrophobicContact CB-CZ 4.1Å
386	L	97.5	Very high	96.7	Very high	15 Å²	15	59.4 Å²	59.4	8%	0.079	32%	0.322	C	S	.	.	H	α-helix	trans	-60.2	-53.8	179.9	178.6	56.8	0	0	0	110.9	F382 S383 K388 C389 L390 P415 P430 G431 F432	F382-L386 PolarHBondContact O-N 3.09Å; S383-L386 PolarHBondContact O-N 3.34Å; L386-K388 VanDerWaalsContact C-N 3.34Å; L386-K388 PolarHBondContact O-N 3.31Å; L386-C389 PolarHBondContact O-N 3.35Å; L386-L390 HydrophobicContact CD1-CD1 4.15Å; L386-L390 HydrophobicContact CD1-CG 4.3Å; L386-L390 HydrophobicContact CG-CD1 4.21Å; L386-L390 WeakPolarHBondContact O-CG 3.42Å; L386-L390 PolarHBondContact O-N 2.83Å; L386-P415 HydrophobicContact CD1-CB 3.76Å; L386-P430 HydrophobicContact CD2-CB 4.42Å; L386-G431 WeakPolarHBondContact CD1-O 3.42Å; L386-F432 HydrophobicContact CB-CE2 4.13Å; L386-F432 HydrophobicContact CB-CZ 4.05Å; L386-F432 HydrophobicContact CD1-CE1 4.35Å; L386-F432 HydrophobicContact CD1-CE2 4.48Å; L386-F432 HydrophobicContact CD1-CZ 4.24Å
387	I	97.4	Very high	96.8	Very high	94 Å²	94	53.3 Å²	53.3	48%	0.482	29%	0.291	S	S	.	.	H	α-helix	trans	-56.6	-47.8	179.3	-66	165.2	0	0	0	110.5	S383 C389 L390 E391	S383-I387 VanDerWaalsContact O-CG1 3.28Å; S383-I387 WeakPolarHBondContact O-CG1 3.44Å; S383-I387 PolarHBondContact O-N 3.38Å; I387-C389 PolarHBondContact O-N 3.41Å; I387-L390 PolarHBondContact O-N 2.84Å; I387-E391 WeakPolarHBondContact CG2-OE1 3.48Å; I387-E391 WeakPolarHBondContact O-CG 3.36Å; I387-E391 PolarHBondContact O-N 2.68Å
388	K	97.7	Very high	97.1	Very high	106 Å²	106	51.8 Å²	51.8	46%	0.461	28%	0.275	S	S	.	.	H	α-helix	trans	-71.7	-28.3	-178.9	-67.9	-53.7	-178.9	-157.7	0	114.3	A384 L385 L386 E391 K392	A384-K388 WeakPolarHBondContact O-CB 3.42Å; A384-K388 WeakPolarHBondContact O-CG 3.45Å; A384-K388 PolarHBondContact O-N 2.69Å; A384-K388 VanDerWaalsContact O-N 3.09Å; L385-K388 PolarHBondContact O-N 2.98Å; L386-K388 VanDerWaalsContact C-N 3.34Å; L386-K388 PolarHBondContact O-N 3.31Å; K388-E391 VanDerWaalsContact CD-OE2 3.23Å; K388-E391 WeakPolarHBondContact CD-OE2 3.48Å; K388-E391 IonicContact NZ-OE1 2.68Å; K388-E391 PolarHBondContact NZ-OE1 2.86Å; K388-E391 IonicContact NZ-OE2 3.26Å; K388-E391 PolarHBondContact NZ-OE2 3.11Å; K388-K392 WeakPolarHBondContact O-CB 3.45Å; K388-K392 WeakPolarHBondContact O-CG 3.27Å; K388-K392 PolarHBondContact O-N 3.1Å
389	C	97.4	Very high	97.2	Very high	3 Å²	3	55.3 Å²	55.3	2%	0.02	29%	0.289	C	S	.	.	H	α-helix	trans	-72.6	-38.4	173.8	-71.8	0	0	0	0	111.6	L385 L386 I387 E393 V394 P415 F432	L385-C389 VanDerWaalsContact O-CB 3.25Å; L385-C389 WeakPolarHBondContact O-CB 3.07Å; L385-C389 PolarHBondContact O-N 2.93Å; L385-C389 PolarHBondContact O-SG 2.93Å; L386-C389 PolarHBondContact O-N 3.35Å; I387-C389 PolarHBondContact O-N 3.41Å; C389-E393 PolarHBondContact O-N 2.96Å; C389-V394 HydrophobicContact CB-CG2 4.34Å; C389-V394 WeakPolarHBondContact CB-O 3.48Å; C389-V394 PolarHBondContact O-N 3.37Å; C389-V394 VanDerWaalsContact O-N 3.12Å; C389-P415 HydrophobicContact CB-CB 3.75Å; C389-P415 HydrophobicContact CB-CG 3.81Å; C389-F432 HydrophobicContact CB-CE1 4.13Å
390	L	96.9	Very high	97.4	Very high	59 Å²	59	54 Å²	54	31%	0.309	28%	0.278	S	S	.	.	H	α-helix	trans	-62.5	-53	172.7	-70.8	170.1	0	0	0	111	L386 I387 K392 E393 P415 D417	L386-L390 HydrophobicContact CD1-CD1 4.15Å; L386-L390 HydrophobicContact CD1-CG 4.3Å; L386-L390 HydrophobicContact CG-CD1 4.21Å; L386-L390 WeakPolarHBondContact O-CG 3.42Å; L386-L390 PolarHBondContact O-N 2.83Å; I387-L390 PolarHBondContact O-N 2.84Å; L390-K392 PolarHBondContact O-N 3.2Å; L390-K392 VanDerWaalsContact O-N 3.11Å; L390-E393 PolarHBondContact O-N 2.87Å; L390-P415 HydrophobicContact CD2-CB 3.75Å; L390-P415 HydrophobicContact CD2-CG 4.09Å; L390-P415 HydrophobicContact CG-CB 3.87Å; L390-P415 HydrophobicContact CG-CG 4.47Å; L390-D417 HydrophobicContact CD1-CB 4.05Å; L390-D417 HydrophobicContact CD2-CB 4.3Å
391	E	97.2	Very high	97.5	Very high	115 Å²	115	48.9 Å²	48.9	54%	0.537	25%	0.246	S	C	.	.	H	α-helix	trans	-55.5	-32.7	179.6	-76.8	177.4	-158.9	0	0	113.5	I387 K388	I387-E391 WeakPolarHBondContact CG2-OE1 3.48Å; I387-E391 WeakPolarHBondContact O-CG 3.36Å; I387-E391 PolarHBondContact O-N 2.68Å; K388-E391 VanDerWaalsContact CD-OE2 3.23Å; K388-E391 WeakPolarHBondContact CD-OE2 3.48Å; K388-E391 IonicContact NZ-OE1 2.68Å; K388-E391 PolarHBondContact NZ-OE1 2.86Å; K388-E391 IonicContact NZ-OE2 3.26Å; K388-E391 PolarHBondContact NZ-OE2 3.11Å
392	K	97.1	Very high	97.2	Very high	145 Å²	145	48 Å²	48	63%	0.63	24%	0.244	S	C	*	.	H	α-helix	trans	-101.6	-2.4	-174.7	-67.6	179.6	179.7	-65.4	0	113.8	K388 L390 V394	K388-K392 WeakPolarHBondContact O-CB 3.45Å; K388-K392 WeakPolarHBondContact O-CG 3.27Å; K388-K392 PolarHBondContact O-N 3.1Å; L390-K392 PolarHBondContact O-N 3.2Å; L390-K392 VanDerWaalsContact O-N 3.11Å; K392-V394 VanDerWaalsContact C-N 3.27Å; K392-V394 HydrophobicContact CB-CG1 4.2Å; K392-V394 HydrophobicContact CB-CG2 3.94Å; K392-V394 WeakPolarHBondContact O-CG1 3.2Å; K392-V394 PolarHBondContact O-N 2.96Å
393	E	97.4	Very high	96.9	Very high	136 Å²	136	51.5 Å²	51.5	64%	0.636	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	46.1	-174.6	-56.5	-176.9	152.5	0	0	112.8	L353 C389 L390	L353-E393 HydrophobicContact CD1-CB 4.32Å; L353-E393 WeakPolarHBondContact CG-O 3.32Å; L353-E393 PolarHBondContact N-O 3.2Å; C389-E393 PolarHBondContact O-N 2.96Å; L390-E393 PolarHBondContact O-N 2.87Å
394	V	97.9	Very high	96.8	Very high	23 Å²	23	56.1 Å²	56.1	14%	0.139	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	148.6	179.5	-63.4	0	0	0	0	111.6	F350 K351 C389 K392 P415	F350-V394 HydrophobicContact CB-CB 4.34Å; F350-V394 HydrophobicContact CB-CG2 4.29Å; F350-V394 HydrophobicContact CD1-CG2 4.13Å; K351-V394 WeakPolarHBondContact O-CA 3.33Å; C389-V394 HydrophobicContact CB-CG2 4.34Å; C389-V394 WeakPolarHBondContact CB-O 3.48Å; C389-V394 PolarHBondContact O-N 3.37Å; C389-V394 VanDerWaalsContact O-N 3.12Å; K392-V394 VanDerWaalsContact C-N 3.27Å; K392-V394 HydrophobicContact CB-CG1 4.2Å; K392-V394 HydrophobicContact CB-CG2 3.94Å; K392-V394 WeakPolarHBondContact O-CG1 3.2Å; K392-V394 PolarHBondContact O-N 2.96Å; V394-P415 WeakPolarHBondContact O-CD 3.39Å
395	A	97.8	Very high	96.6	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.008	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	145.1	167.8	0	0	0	0	0	110.8	F350 K351 L353 L356 L397 A412 L413 V414	F350-A395 CarbonylContact C-O 3.6Å; F350-A395 WeakPolarHBondContact CA-O 3.26Å; K351-A395 PolarHBondContact N-O 3.05Å; K351-A395 PolarHBondContact O-N 3.48Å; L353-A395 HydrophobicContact CD2-CB 3.74Å; L356-A395 HydrophobicContact CD1-CB 3.85Å; A395-L397 PolarHBondContact O-N 3.11Å; A395-A412 HydrophobicContact CB-CB 4.26Å; A395-L413 VanDerWaalsContact CA-O 3.31Å; A395-L413 WeakPolarHBondContact CA-O 3.19Å; A395-L413 WeakPolarHBondContact CB-O 3.3Å; A395-V414 HydrophobicContact CB-CG2 4.26Å
396	A	98.1	Very high	96.4	Very high	8 Å²	8	56.7 Å²	56.7	7%	0.066	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	116.4	169.3	0	0	0	0	0	109.6	L347 F350 L413	L347-A396 HydrophobicContact CD1-CB 3.76Å; F350-A396 HydrophobicContact CD1-CB 4.09Å; F350-A396 HydrophobicContact CE1-CB 3.88Å; A396-L413 HydrophobicContact CB-CB 4.06Å; A396-L413 HydrophobicContact CB-CD1 4.44Å; A396-L413 PolarHBondContact N-O 3.5Å; A396-L413 WeakPolarHBondContact O-CB 3.43Å; A396-L413 PolarHBondContact O-N 2.9Å
397	L	98.4	Very high	96.3	Very high	30 Å²	30	58.6 Å²	58.6	16%	0.157	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	123.7	174.1	-177.7	68.1	0	0	0	108.6	M348 G349 A395 L437	M348-L397 WeakPolarHBondContact CA-O 2.87Å; M348-L397 HydrophobicContact CB-CB 4.41Å; M348-L397 HydrophobicContact CB-CD2 4.26Å; M348-L397 HydrophobicContact CB-CG 4.18Å; M348-L397 VanDerWaalsContact CB-O 3.31Å; M348-L397 WeakPolarHBondContact CB-O 3.45Å; M348-L397 PolarHBondContact N-O 3.47Å; G349-L397 PolarHBondContact N-O 3Å; G349-L397 PolarHBondContact O-N 3.42Å; A395-L397 PolarHBondContact O-N 3.11Å; L397-L437 HydrophobicContact CD1-CD1 3.52Å
398	C	98.1	Very high	96.3	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.007	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	153	-179.9	-65.1	0	0	0	0	111.4	L345 M346 F410 V411	L345-C398 HydrophobicContact CB-CB 4.48Å; L345-C398 HydrophobicContact CD2-CB 3.88Å; M346-C398 CarbonylContact O-C 3.57Å; M346-C398 WeakPolarHBondContact O-CA 3.49Å; C398-F410 WeakPolarHBondContact O-CA 3.25Å; C398-V411 HydrophobicContact CB-CG2 3.85Å; C398-V411 PolarHBondContact N-O 3.36Å; C398-V411 PolarHBondContact O-N 3.37Å
399	R	98.1	Very high	96.3	Very high	73 Å²	73	54.4 Å²	54.4	28%	0.275	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	116.8	162.8	-167.3	165.3	71.9	-161.6	7.1	108	D341 M346 M348 P408 F410	D341-R399 VanDerWaalsContact CG-NH2 3.3Å; D341-R399 IonicContact OD1-CZ 3.22Å; D341-R399 IonicContact OD1-NE 2.65Å; D341-R399 IonicContact OD1-NH2 3.15Å; D341-R399 PolarHBondContact OD1-NH2 2.85Å; D341-R399 IonicContact OD2-CZ 3.56Å; D341-R399 VanDerWaalsContact OD2-CZ 3.22Å; D341-R399 IonicContact OD2-NE 2.71Å; D341-R399 PolarHBondContact OD2-NE 2.94Å; D341-R399 IonicContact OD2-NH2 3.56Å; D341-R399 PolarHBondContact OD2-NH2 3.44Å; D341-R399 VanDerWaalsContact OD2-NH2 3.15Å; M346-R399 HydrophobicContact CB-CB 4.4Å; M346-R399 PolarHBondContact N-O 3.1Å; M346-R399 PolarHBondContact O-N 2.83Å; M348-R399 HydrophobicContact CG-CB 4.33Å; M348-R399 HydrophobicContact SD-CB 4Å; R399-P408 HydrophobicContact CG-CB 3.55Å; R399-P408 HydrophobicContact CG-CG 4.31Å; R399-F410 HydrophobicContact CB-CE1 4.44Å
400	Y	97.9	Very high	96.3	Very high	10 Å²	10	57.8 Å²	57.8	4%	0.039	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	125.1	-170.3	173.5	-123.8	0	0	0	111	L259 L345 P402 P408 Y409 V411 L434 F436	L259-Y400 HydrophobicContact CD1-CD2 4.33Å; L259-Y400 HydrophobicContact CD1-CE2 3.55Å; L345-Y400 HydrophobicContact CD2-CD2 3.55Å; L345-Y400 HydrophobicContact CD2-CG 4.05Å; L345-Y400 HydrophobicContact CG-CD2 3.98Å; Y400-P402 HydrophobicContact CD1-CG 4.24Å; Y400-P402 HydrophobicContact CE1-CB 4.27Å; Y400-P402 HydrophobicContact CE1-CG 3.58Å; Y400-P402 HydrophobicContact CE2-CB 4.49Å; Y400-P402 HydrophobicContact CE2-CG 4.46Å; Y400-P408 WeakPolarHBondContact O-CA 3.36Å; Y400-Y409 PolarHBondContact N-O 3.12Å; Y400-Y409 PolarHBondContact O-N 2.61Å; Y400-V411 HydrophobicContact CD1-CG1 4Å; Y400-V411 HydrophobicContact CG-CG1 4.12Å; Y400-V411 HydrophobicContact CG-CG2 4.48Å; Y400-L434 HydrophobicContact CD2-CD1 4.36Å; Y400-L434 HydrophobicContact CE2-CD1 4.36Å; Y400-F436 AromaticContact CD1-CE1 3.78Å; Y400-F436 HydrophobicContact CD1-CE1 3.78Å; Y400-F436 HydrophobicContact CD1-CZ 4.32Å; Y400-F436 AromaticContact CE1-CE1 3.76Å; Y400-F436 HydrophobicContact CE1-CE1 3.76Å; Y400-F436 AromaticContact CE1-CZ 3.91Å; Y400-F436 HydrophobicContact CE1-CZ 3.91Å
401	T	97	Very high	96.4	Very high	1 Å²	1	55 Å²	55	1%	0.006	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	105.9	174.8	-57.5	0	0	0	0	108.2	P343 G344 R403	P343-T401 CarbonylContact C-O 3.54Å; P343-T401 VanDerWaalsContact CA-O 3.31Å; P343-T401 WeakPolarHBondContact CA-O 3.28Å; G344-T401 PolarHBondContact N-O 3.31Å; G344-T401 PolarHBondContact O-N 2.81Å; T401-R403 WeakPolarHBondContact CG2-O 3.49Å
402	P	91.3	Very high	96.4	Very high	42 Å²	42	49.6 Å²	49.6	27%	0.273	23%	0.229	S	C	.	.			trans	-65.8	-42.7	-173.3	-14.7	21	0	0	0	114.3	Y400 I406	Y400-P402 HydrophobicContact CD1-CG 4.24Å; Y400-P402 HydrophobicContact CE1-CB 4.27Å; Y400-P402 HydrophobicContact CE1-CG 3.58Å; Y400-P402 HydrophobicContact CE2-CB 4.49Å; Y400-P402 HydrophobicContact CE2-CG 4.46Å; P402-I406 HydrophobicContact CG-CG2 4.45Å
403	R	92.1	Very high	96.5	Very high	78 Å²	78	42.8 Å²	42.8	29%	0.294	20%	0.2	S	C	.	.	S	Bend	trans	-150.6	172	-175	62.9	177.6	-168.7	-147.3	2.4	110	N23 T401 I406	N23-R403 VanDerWaalsContact CB-NH1 3.28Å; N23-R403 WeakPolarHBondContact O-CD 3.34Å; N23-R403 PolarHBondContact O-NE 2.76Å; N23-R403 PolarHBondContact O-NH1 2.86Å; N23-R403 PolarHBondContact OD1-NH1 3.1Å; N23-R403 PolarHBondContact OD1-NH2 3.32Å; T401-R403 WeakPolarHBondContact CG2-O 3.49Å; R403-I406 HydrophobicContact CG-CD1 3.61Å; R403-I406 HydrophobicContact CG-CG1 4Å; R403-I406 VanDerWaalsContact NE-CD1 3.29Å
404	R	92.4	Very high	96.5	Very high	155 Å²	155	37.6 Å²	37.6	59%	0.585	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	153	-179.5	-62.1	-172	174.4	-151	-3.1	110.6	A26 P343 I406	A26-R404 HydrophobicContact CB-CB 3.86Å; A26-R404 HydrophobicContact CB-CG 4.02Å; P343-R404 HydrophobicContact CG-CG 3.71Å; R404-I406 VanDerWaalsContact C-N 3.28Å; R404-I406 PolarHBondContact O-N 3.35Å
405	N	92.9	Very high	96.5	Very high	54 Å²	54	37.1 Å²	37.1	29%	0.289	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	36.2	176.1	-50.3	-23.1	0	0	0	113.8	E335 K338	E335-N405 HydrophobicContact CB-CB 4.33Å; K338-N405 WeakPolarHBondContact CB-O 3.44Å
406	I	94.3	Very high	96.5	Very high	42 Å²	42	38.8 Å²	38.8	22%	0.215	18%	0.182	C	C	.	.			trans	-121.4	137.9	172.8	-80	-163.5	0	0	0	110.7	K338 P402 R403 R404	K338-I406 CarbonylContact O-C 3.57Å; P402-I406 HydrophobicContact CG-CG2 4.45Å; R403-I406 HydrophobicContact CG-CD1 3.61Å; R403-I406 HydrophobicContact CG-CG1 4Å; R403-I406 VanDerWaalsContact NE-CD1 3.29Å; R404-I406 VanDerWaalsContact C-N 3.28Å; R404-I406 PolarHBondContact O-N 3.35Å
407	P	95.5	Very high	96.4	Very high	55 Å²	55	43.5 Å²	43.5	36%	0.357	21%	0.206	S	C	.	.			trans	-62.9	141.8	171	-22.7	35	0	0	0	112.2	K338 F340	K338-P407 HydrophobicContact CB-CG 4.43Å; F340-P407 HydrophobicContact CD2-CB 4.18Å; F340-P407 HydrophobicContact CE2-CB 4.05Å; F340-P407 HydrophobicContact CE2-CG 4.21Å
408	P	96.5	Very high	96.1	Very high	23 Å²	23	45.6 Å²	45.6	15%	0.149	22%	0.215	C	C	.	.			trans	-75.6	151.5	-175.6	30.4	-32.9	0	0	0	111.3	F340 R399 Y400	F340-P408 HydrophobicContact CB-CG 4.1Å; F340-P408 HydrophobicContact CG-CG 4.32Å; R399-P408 HydrophobicContact CG-CB 3.55Å; R399-P408 HydrophobicContact CG-CG 4.31Å; Y400-P408 WeakPolarHBondContact O-CA 3.36Å
409	Y	97.3	Very high	95.8	Very high	88 Å²	88	51.1 Å²	51.1	35%	0.345	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	145.1	171	-90.3	-96	0	0	0	111.3	L362 Y400 F439	L362-Y409 HydrophobicContact CD2-CD1 4.35Å; L362-Y409 HydrophobicContact CD2-CE1 3.97Å; Y400-Y409 PolarHBondContact N-O 3.12Å; Y400-Y409 PolarHBondContact O-N 2.61Å; Y409-F439 AromaticContact CD1-CD2 3.92Å; Y409-F439 HydrophobicContact CD1-CD2 3.92Å; Y409-F439 AromaticContact CD1-CE2 3.57Å; Y409-F439 HydrophobicContact CD1-CE2 3.57Å; Y409-F439 HydrophobicContact CD2-CE2 4.45Å; Y409-F439 AromaticContact CE1-CD2 3.65Å; Y409-F439 HydrophobicContact CE1-CD2 3.65Å; Y409-F439 AromaticContact CE1-CE2 3.68Å; Y409-F439 HydrophobicContact CE1-CE2 3.68Å; Y409-F439 AromaticContact CG-CE2 3.99Å; Y409-F439 HydrophobicContact CG-CE2 3.99Å
410	F	98.3	Very high	95.4	Very high	74 Å²	74	50.5 Å²	50.5	33%	0.325	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	131.5	166.9	-73.1	-67.4	0	0	0	110.1	M348 C398 R399 L437 F439	M348-F410 HydrophobicContact CE-CE1 4.28Å; M348-F410 HydrophobicContact CG-CD1 4.47Å; M348-F410 HydrophobicContact CG-CE1 4.09Å; M348-F410 HydrophobicContact SD-CE1 4.43Å; C398-F410 WeakPolarHBondContact O-CA 3.25Å; R399-F410 HydrophobicContact CB-CE1 4.44Å; F410-L437 HydrophobicContact CB-CB 4.35Å; F410-L437 HydrophobicContact CB-CD1 4.36Å; F410-L437 WeakPolarHBondContact O-CB 3.18Å; F410-L437 PolarHBondContact O-N 3.37Å; F410-F439 AromaticContact CD2-CE1 3.71Å; F410-F439 HydrophobicContact CD2-CE1 3.71Å; F410-F439 HydrophobicContact CD2-CZ 4.11Å; F410-F439 HydrophobicContact CE2-CE1 4.03Å
411	V	98.3	Very high	95	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	147.3	178.1	-55.9	0	0	0	0	109.6	L345 C398 Y400 L434 V435 F436	L345-V411 HydrophobicContact CD2-CG2 3.86Å; C398-V411 HydrophobicContact CB-CG2 3.85Å; C398-V411 PolarHBondContact N-O 3.36Å; C398-V411 PolarHBondContact O-N 3.37Å; Y400-V411 HydrophobicContact CD1-CG1 4Å; Y400-V411 HydrophobicContact CG-CG1 4.12Å; Y400-V411 HydrophobicContact CG-CG2 4.48Å; V411-L434 HydrophobicContact CB-CD2 3.87Å; V411-L434 HydrophobicContact CB-CG 4.03Å; V411-L434 HydrophobicContact CG1-CD2 3.7Å; V411-L434 HydrophobicContact CG1-CG 4.33Å; V411-L434 HydrophobicContact CG2-CD1 4.41Å; V411-L434 HydrophobicContact CG2-CD2 4.31Å; V411-L434 HydrophobicContact CG2-CG 4.01Å; V411-V435 CarbonylContact C-O 3.52Å; V411-V435 VanDerWaalsContact CA-O 3.23Å; V411-V435 WeakPolarHBondContact CA-O 3.44Å; V411-F436 HydrophobicContact CG1-CD1 3.87Å; V411-F436 HydrophobicContact CG1-CE1 4.16Å; V411-F436 HydrophobicContact CG1-CG 4.43Å
412	A	98.4	Very high	94.7	Very high	2 Å²	2	57.1 Å²	57.1	2%	0.017	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	121.4	171	0	0	0	0	0	109	L356 A395 V414 V435 L437	L356-A412 HydrophobicContact CD1-CB 3.72Å; L356-A412 HydrophobicContact CD2-CB 3.99Å; A395-A412 HydrophobicContact CB-CB 4.26Å; A412-V414 HydrophobicContact CB-CG2 4.49Å; A412-V414 PolarHBondContact O-N 2.98Å; A412-V435 PolarHBondContact N-O 3.12Å; A412-V435 PolarHBondContact O-N 3.44Å; A412-L437 HydrophobicContact CB-CD1 4.42Å; A412-L437 HydrophobicContact CB-CD2 4.38Å
413	L	98.4	Very high	94.5	Very high	3 Å²	3	56.3 Å²	56.3	2%	0.016	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	95.3	168.6	-59.8	-174.8	0	0	0	107.7	L261 V368 A395 A396 F432 Q433 L434	L261-L413 HydrophobicContact CD1-CD1 3.92Å; V368-L413 HydrophobicContact CG2-CD2 3.92Å; A395-L413 VanDerWaalsContact CA-O 3.31Å; A395-L413 WeakPolarHBondContact CA-O 3.19Å; A395-L413 WeakPolarHBondContact CB-O 3.3Å; A396-L413 HydrophobicContact CB-CB 4.06Å; A396-L413 HydrophobicContact CB-CD1 4.44Å; A396-L413 PolarHBondContact N-O 3.5Å; A396-L413 WeakPolarHBondContact O-CB 3.43Å; A396-L413 PolarHBondContact O-N 2.9Å; L413-F432 HydrophobicContact CB-CB 3.94Å; L413-F432 HydrophobicContact CB-CD1 3.88Å; L413-F432 HydrophobicContact CB-CG 4.05Å; L413-F432 HydrophobicContact CD2-CB 4.44Å; L413-Q433 WeakPolarHBondContact CA-O 3.38Å; L413-L434 HydrophobicContact CD2-CB 3.83Å; L413-L434 HydrophobicContact CD2-CD1 4.2Å; L413-L434 HydrophobicContact CD2-CG 3.94Å
414	V	98.4	Very high	94.3	Very high	26 Å²	26	56.6 Å²	56.6	16%	0.158	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	123.7	177.9	176.4	0	0	0	0	108	L353 L356 A395 A412 Q416 F432 Q433 V435	L353-V414 HydrophobicContact CD2-CB 4.47Å; L353-V414 HydrophobicContact CD2-CG1 3.89Å; L353-V414 HydrophobicContact CD2-CG2 4.22Å; L356-V414 HydrophobicContact CD1-CG2 3.78Å; A395-V414 HydrophobicContact CB-CG2 4.26Å; A412-V414 HydrophobicContact CB-CG2 4.49Å; A412-V414 PolarHBondContact O-N 2.98Å; V414-Q416 PolarHBondContact O-N 3.27Å; V414-F432 CarbonylContact O-C 3.59Å; V414-F432 WeakPolarHBondContact O-CA 3.41Å; V414-Q433 HydrophobicContact CB-CB 4.33Å; V414-Q433 PolarHBondContact N-O 3.02Å; V414-Q433 PolarHBondContact O-N 3.03Å; V414-V435 HydrophobicContact CG2-CG2 3.84Å
415	P	97.9	Very high	94.1	Very high	13 Å²	13	49.8 Å²	49.8	8%	0.084	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	134.7	178.8	29.9	-36.4	0	0	0	110.1	L386 C389 L390 V394 F432	L386-P415 HydrophobicContact CD1-CB 3.76Å; C389-P415 HydrophobicContact CB-CB 3.75Å; C389-P415 HydrophobicContact CB-CG 3.81Å; L390-P415 HydrophobicContact CD2-CB 3.75Å; L390-P415 HydrophobicContact CD2-CG 4.09Å; L390-P415 HydrophobicContact CG-CB 3.87Å; L390-P415 HydrophobicContact CG-CG 4.47Å; V394-P415 WeakPolarHBondContact O-CD 3.39Å; P415-F432 HydrophobicContact CB-CD1 4.23Å; P415-F432 HydrophobicContact CB-CE1 3.95Å
416	Q	97	Very high	93.9	Very high	37 Å²	37	51.1 Å²	51.1	17%	0.173	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	118.5	-177.2	-173.7	178.3	-71.4	0	0	108.7	V414 T428 P429 G431	V414-Q416 PolarHBondContact O-N 3.27Å; Q416-T428 VanDerWaalsContact CD-CG2 3.44Å; Q416-T428 HydrophobicContact CG-CG2 3.4Å; Q416-T428 VanDerWaalsContact NE2-CG2 3.33Å; Q416-P429 PolarHBondContact NE2-O 3.13Å; Q416-G431 WeakPolarHBondContact CB-O 3.34Å; Q416-G431 PolarHBondContact N-O 3.43Å; Q416-G431 PolarHBondContact O-N 3.02Å
417	D	94.9	Very high	93.7	Very high	107 Å²	107	53 Å²	53	57%	0.572	27%	0.268	S	S	*	.			trans	-83.7	157.8	178.9	-155.3	6.4	0	0	0	111.3	L390 T428	L390-D417 HydrophobicContact CD1-CB 4.05Å; L390-D417 HydrophobicContact CD2-CB 4.3Å; D417-T428 WeakPolarHBondContact O-CG2 3.44Å
418	E	93.3	Very high	93.6	Very high	74 Å²	74	52 Å²	52	35%	0.346	26%	0.26	S	S	.	.			trans	-74.5	133.9	178.1	-176.4	169.2	-148.7	0	0	111.4	L420 Q426 T428 P430	E418-L420 HydrophobicContact CG-CD2 4.23Å; E418-L420 HydrophobicContact CG-CG 4.47Å; E418-Q426 PolarHBondContact OE1-NE2 3.06Å; E418-T428 WeakPolarHBondContact CA-O 3.32Å; E418-P430 HydrophobicContact CB-CB 4Å; E418-P430 HydrophobicContact CB-CG 4.11Å; E418-P430 HydrophobicContact CG-CG 4.49Å
419	E	92.3	Very high	93.4	Very high	116 Å²	116	52 Å²	52	54%	0.542	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	122.3	174.4	-167.5	-179.2	176.9	0	0	110.1	V427 T428	E419-V427 PolarHBondContact O-N 3.28Å; E419-T428 PolarHBondContact N-O 3.13Å; E419-T428 PolarHBondContact O-N 2.93Å; E419-T428 PolarHBondContact OE2-OG1 3.38Å
420	L	89.9	Confident	93.3	Very high	60 Å²	60	49.2 Å²	49.2	31%	0.314	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	138.2	174.1	-55.1	-178.4	0	0	0	109.3	V231 E418 I425 Q426	V231-L420 HydrophobicContact CG1-CD1 4.2Å; V231-L420 HydrophobicContact CG2-CD1 4.32Å; E418-L420 HydrophobicContact CG-CD2 4.23Å; E418-L420 HydrophobicContact CG-CG 4.47Å; L420-I425 WeakPolarHBondContact CA-O 3.29Å; L420-Q426 HydrophobicContact CD2-CB 3.83Å; L420-Q426 HydrophobicContact CD2-CG 4.16Å
421	D	89.4	Confident	93.2	Very high	29 Å²	29	45.7 Å²	45.7	16%	0.155	24%	0.238	C	C	.	.			trans	-80.4	-175.2	173.6	72.2	4.8	0	0	0	113	R244 Q423 K424 I425 V427	R244-D421 IonicContact CZ-OD2 3.68Å; R244-D421 IonicContact NH1-OD2 3.74Å; R244-D421 PolarHBondContact NH1-OD2 2.65Å; R244-D421 IonicContact NH2-OD2 2.8Å; D421-Q423 PolarHBondContact O-N 3.38Å; D421-Q423 WeakPolarHBondContact OD1-CA 3.37Å; D421-Q423 WeakPolarHBondContact OD1-CB 3.42Å; D421-Q423 PolarHBondContact OD1-N 2.88Å; D421-K424 PolarHBondContact O-N 2.84Å; D421-K424 PolarHBondContact OD1-N 3.13Å; D421-K424 VanDerWaalsContact OD1-N 3.1Å; D421-I425 PolarHBondContact N-O 2.85Å; D421-I425 WeakPolarHBondContact OD1-CA 3.27Å; D421-I425 WeakPolarHBondContact OD1-CB 3.2Å; D421-I425 PolarHBondContact OD1-N 2.93Å; D421-V427 HydrophobicContact CB-CG2 3.78Å
422	D	89.6	Confident	93.2	Very high	121 Å²	121	46 Å²	46	65%	0.647	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-29.4	176.3	60.1	-24.4	0	0	0	113.2	K424	D422-K424 VanDerWaalsContact C-N 3.28Å
423	Q	87.4	Confident	93.2	Very high	25 Å²	25	49.3 Å²	49.3	12%	0.117	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	6	176.2	-65.7	-62.9	-53.9	0	0	113.4	E234 E235 D241 D421 I425	E234-Q423 PolarHBondContact N-O 3.05Å; E235-Q423 PolarHBondContact O-OE1 2.9Å; D241-Q423 HydrophobicContact CB-CG 4.27Å; D421-Q423 PolarHBondContact O-N 3.38Å; D421-Q423 WeakPolarHBondContact OD1-CA 3.37Å; D421-Q423 WeakPolarHBondContact OD1-CB 3.42Å; D421-Q423 PolarHBondContact OD1-N 2.88Å; Q423-I425 HydrophobicContact CB-CD1 3.85Å; Q423-I425 HydrophobicContact CB-CG1 3.85Å; Q423-I425 PolarHBondContact O-N 3.35Å
424	K	87.8	Confident	93.2	Very high	84 Å²	84	49.1 Å²	49.1	37%	0.365	25%	0.254	S	S	.	.			trans	60	22.9	-173.1	-53.7	-60.2	-177.1	-172.4	0	113.8	V231 E234 D421 D422	V231-K424 HydrophobicContact CG1-CB 3.62Å; V231-K424 HydrophobicContact CG1-CD 3.75Å; V231-K424 HydrophobicContact CG1-CG 3.71Å; E234-K424 HydrophobicContact CG-CG 4Å; D421-K424 PolarHBondContact O-N 2.84Å; D421-K424 PolarHBondContact OD1-N 3.13Å; D421-K424 VanDerWaalsContact OD1-N 3.1Å; D422-K424 VanDerWaalsContact C-N 3.28Å
425	I	87.8	Confident	93.2	Very high	13 Å²	13	49.6 Å²	49.6	7%	0.067	26%	0.256	C	S	.	.			trans	-80.1	130.9	173.5	-54.9	172.5	0	0	0	107.4	F233 R244 K245 L420 D421 Q423 V427	F233-I425 HydrophobicContact CD1-CG1 4.29Å; F233-I425 HydrophobicContact CE1-CG1 4.35Å; R244-I425 HydrophobicContact CB-CD1 3.72Å; K245-I425 HydrophobicContact CG-CD1 3.69Å; K245-I425 HydrophobicContact CG-CG1 3.87Å; L420-I425 WeakPolarHBondContact CA-O 3.29Å; D421-I425 PolarHBondContact N-O 2.85Å; D421-I425 WeakPolarHBondContact OD1-CA 3.27Å; D421-I425 WeakPolarHBondContact OD1-CB 3.2Å; D421-I425 PolarHBondContact OD1-N 2.93Å; Q423-I425 HydrophobicContact CB-CD1 3.85Å; Q423-I425 HydrophobicContact CB-CG1 3.85Å; Q423-I425 PolarHBondContact O-N 3.35Å; I425-V427 PolarHBondContact O-N 3.49Å; I425-V427 VanDerWaalsContact O-N 3.07Å
426	Q	89	Confident	93.2	Very high	81 Å²	81	49.3 Å²	49.3	38%	0.379	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	104.6	175.3	-171.6	-178.6	74.7	0	0	109.9	E418 L420	E418-Q426 PolarHBondContact OE1-NE2 3.06Å; L420-Q426 HydrophobicContact CD2-CB 3.83Å; L420-Q426 HydrophobicContact CD2-CG 4.16Å
427	V	90.4	Very high	93.2	Very high	83 Å²	83	49.1 Å²	49.1	50%	0.503	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-44	177.2	179.3	0	0	0	0	110	E419 D421 I425	E419-V427 PolarHBondContact O-N 3.28Å; D421-V427 HydrophobicContact CB-CG2 3.78Å; I425-V427 PolarHBondContact O-N 3.49Å; I425-V427 VanDerWaalsContact O-N 3.07Å
428	T	92.8	Very high	93.3	Very high	32 Å²	32	45.1 Å²	45.1	20%	0.196	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	115.9	-178.3	-54.5	0	0	0	0	108.7	Q416 D417 E418 E419	Q416-T428 VanDerWaalsContact CD-CG2 3.44Å; Q416-T428 HydrophobicContact CG-CG2 3.4Å; Q416-T428 VanDerWaalsContact NE2-CG2 3.33Å; D417-T428 WeakPolarHBondContact O-CG2 3.44Å; E418-T428 WeakPolarHBondContact CA-O 3.32Å; E419-T428 PolarHBondContact N-O 3.13Å; E419-T428 PolarHBondContact O-N 2.93Å; E419-T428 PolarHBondContact OE2-OG1 3.38Å
429	P	93	Very high	93.5	Very high	24 Å²	24	45.1 Å²	45.1	16%	0.156	23%	0.233	C	C	.	.			trans	-77.3	148.9	179.8	29.2	-34.5	0	0	0	112.2	L276 F367 Q416	L276-P429 HydrophobicContact CD1-CG 3.86Å; F367-P429 HydrophobicContact CD2-CG 4.37Å; F367-P429 HydrophobicContact CE1-CB 4.17Å; F367-P429 HydrophobicContact CE1-CG 4.09Å; F367-P429 HydrophobicContact CE2-CB 4.31Å; F367-P429 HydrophobicContact CE2-CG 3.83Å; F367-P429 HydrophobicContact CZ-CB 3.72Å; F367-P429 HydrophobicContact CZ-CG 3.66Å; Q416-P429 PolarHBondContact NE2-O 3.13Å
430	P	94.8	Very high	93.7	Very high	30 Å²	30	43.4 Å²	43.4	20%	0.195	24%	0.238	C	C	.	.	S	Bend	trans	-74	127.7	177.2	26.7	-30.4	0	0	0	111.5	F367 Y369 L386 E418	F367-P430 WeakPolarHBondContact CZ-O 3.31Å; Y369-P430 WeakPolarHBondContact CD2-O 3.41Å; Y369-P430 WeakPolarHBondContact CE2-O 3.44Å; L386-P430 HydrophobicContact CD2-CB 4.42Å; E418-P430 HydrophobicContact CB-CB 4Å; E418-P430 HydrophobicContact CB-CG 4.11Å; E418-P430 HydrophobicContact CG-CG 4.49Å
431	G	96.4	Very high	94	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.5	-150.2	178.9	0	0	0	0	0	113.7	L386 Q416	L386-G431 WeakPolarHBondContact CD1-O 3.42Å; Q416-G431 WeakPolarHBondContact CB-O 3.34Å; Q416-G431 PolarHBondContact N-O 3.43Å; Q416-G431 PolarHBondContact O-N 3.02Å
432	F	98.1	Very high	94.3	Very high	6 Å²	6	49 Å²	49	3%	0.026	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	130.9	173.5	-67.3	-86.5	0	0	0	111.7	V368 F382 L385 L386 C389 L413 V414 P415 L434	V368-F432 HydrophobicContact CB-CB 4.3Å; V368-F432 PolarHBondContact N-O 2.68Å; V368-F432 PolarHBondContact O-N 3.01Å; V368-F432 VanDerWaalsContact O-N 3.17Å; F382-F432 HydrophobicContact CD1-CE2 4.48Å; F382-F432 HydrophobicContact CD2-CD2 4.37Å; F382-F432 HydrophobicContact CD2-CE2 4.31Å; F382-F432 HydrophobicContact CE1-CD2 4.02Å; F382-F432 HydrophobicContact CE1-CE2 4.08Å; F382-F432 AromaticContact CE2-CD2 3.55Å; F382-F432 HydrophobicContact CE2-CD2 3.55Å; F382-F432 AromaticContact CE2-CE2 3.9Å; F382-F432 HydrophobicContact CE2-CE2 3.9Å; F382-F432 AromaticContact CZ-CD2 3.35Å; F382-F432 HydrophobicContact CZ-CD2 3.35Å; F382-F432 AromaticContact CZ-CE2 3.79Å; F382-F432 HydrophobicContact CZ-CE2 3.79Å; F382-F432 HydrophobicContact CZ-CG 4.48Å; L385-F432 HydrophobicContact CB-CE2 4.44Å; L385-F432 HydrophobicContact CB-CZ 4.1Å; L386-F432 HydrophobicContact CB-CE2 4.13Å; L386-F432 HydrophobicContact CB-CZ 4.05Å; L386-F432 HydrophobicContact CD1-CE1 4.35Å; L386-F432 HydrophobicContact CD1-CE2 4.48Å; L386-F432 HydrophobicContact CD1-CZ 4.24Å; C389-F432 HydrophobicContact CB-CE1 4.13Å; L413-F432 HydrophobicContact CB-CB 3.94Å; L413-F432 HydrophobicContact CB-CD1 3.88Å; L413-F432 HydrophobicContact CB-CG 4.05Å; L413-F432 HydrophobicContact CD2-CB 4.44Å; V414-F432 CarbonylContact O-C 3.59Å; V414-F432 WeakPolarHBondContact O-CA 3.41Å; P415-F432 HydrophobicContact CB-CD1 4.23Å; P415-F432 HydrophobicContact CB-CE1 3.95Å; F432-L434 PolarHBondContact O-N 3.48Å
433	Q	98.2	Very high	94.5	Very high	71 Å²	71	48.6 Å²	48.6	33%	0.332	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	116.6	166.2	-172.1	-175.1	36.3	0	0	109.2	L413 V414 V435	L413-Q433 WeakPolarHBondContact CA-O 3.38Å; V414-Q433 HydrophobicContact CB-CB 4.33Å; V414-Q433 PolarHBondContact N-O 3.02Å; V414-Q433 PolarHBondContact O-N 3.03Å; Q433-V435 HydrophobicContact CG-CG2 4.03Å; Q433-V435 PolarHBondContact O-N 2.85Å
434	L	98.3	Very high	94.8	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	101.4	176.4	-176.1	164	0	0	0	109.3	L345 S365 L366 V368 Y400 V411 L413 F432 F436	L345-L434 HydrophobicContact CD2-CD1 4.17Å; S365-L434 VanDerWaalsContact CA-O 3.24Å; S365-L434 WeakPolarHBondContact CA-O 3.34Å; S365-L434 WeakPolarHBondContact CB-O 3.35Å; L366-L434 HydrophobicContact CB-CB 4.1Å; L366-L434 HydrophobicContact CB-CD2 4.38Å; L366-L434 HydrophobicContact CD1-CD2 4.4Å; L366-L434 PolarHBondContact N-O 3.32Å; L366-L434 PolarHBondContact O-N 3.09Å; V368-L434 HydrophobicContact CG2-CB 3.91Å; V368-L434 HydrophobicContact CG2-CD1 3.98Å; Y400-L434 HydrophobicContact CD2-CD1 4.36Å; Y400-L434 HydrophobicContact CE2-CD1 4.36Å; V411-L434 HydrophobicContact CB-CD2 3.87Å; V411-L434 HydrophobicContact CB-CG 4.03Å; V411-L434 HydrophobicContact CG1-CD2 3.7Å; V411-L434 HydrophobicContact CG1-CG 4.33Å; V411-L434 HydrophobicContact CG2-CD1 4.41Å; V411-L434 HydrophobicContact CG2-CD2 4.31Å; V411-L434 HydrophobicContact CG2-CG 4.01Å; L413-L434 HydrophobicContact CD2-CB 3.83Å; L413-L434 HydrophobicContact CD2-CD1 4.2Å; L413-L434 HydrophobicContact CD2-CG 3.94Å; F432-L434 PolarHBondContact O-N 3.48Å; L434-F436 HydrophobicContact CD2-CD2 4.07Å; L434-F436 HydrophobicContact CD2-CE1 4.14Å; L434-F436 HydrophobicContact CD2-CE2 3.66Å; L434-F436 HydrophobicContact CD2-CG 4.48Å; L434-F436 HydrophobicContact CD2-CZ 3.7Å
435	V	98.3	Very high	95.1	Very high	35 Å²	35	63.5 Å²	63.5	21%	0.212	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	120.9	-179.1	-178.4	0	0	0	0	110	V411 A412 V414 Q433	V411-V435 CarbonylContact C-O 3.52Å; V411-V435 VanDerWaalsContact CA-O 3.23Å; V411-V435 WeakPolarHBondContact CA-O 3.44Å; A412-V435 PolarHBondContact N-O 3.12Å; A412-V435 PolarHBondContact O-N 3.44Å; V414-V435 HydrophobicContact CG2-CG2 3.84Å; Q433-V435 HydrophobicContact CG-CG2 4.03Å; Q433-V435 PolarHBondContact O-N 2.85Å
436	F	98.1	Very high	95.2	Very high	7 Å²	7	70.1 Å²	70.1	3%	0.031	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	130.7	176.9	-67.5	-91.2	0	0	0	111.6	L362 R363 P364 L366 Y400 V411 L434	L362-F436 HydrophobicContact CB-CB 4.33Å; L362-F436 HydrophobicContact CD2-CB 4.32Å; R363-F436 HydrophobicContact CG-CB 3.88Å; R363-F436 HydrophobicContact CG-CD1 4.1Å; R363-F436 HydrophobicContact CG-CD2 3.41Å; R363-F436 VanDerWaalsContact CG-CD2 3.41Å; R363-F436 HydrophobicContact CG-CE2 3.91Å; R363-F436 HydrophobicContact CG-CG 3.52Å; R363-F436 HydrophobicContact CG-CZ 4.44Å; P364-F436 WeakPolarHBondContact O-CE2 3.44Å; L366-F436 HydrophobicContact CD1-CE2 4.2Å; L366-F436 HydrophobicContact CD1-CZ 3.91Å; L366-F436 HydrophobicContact CG-CE2 4.06Å; L366-F436 HydrophobicContact CG-CZ 4.29Å; Y400-F436 AromaticContact CD1-CE1 3.78Å; Y400-F436 HydrophobicContact CD1-CE1 3.78Å; Y400-F436 HydrophobicContact CD1-CZ 4.32Å; Y400-F436 AromaticContact CE1-CE1 3.76Å; Y400-F436 HydrophobicContact CE1-CE1 3.76Å; Y400-F436 AromaticContact CE1-CZ 3.91Å; Y400-F436 HydrophobicContact CE1-CZ 3.91Å; V411-F436 HydrophobicContact CG1-CD1 3.87Å; V411-F436 HydrophobicContact CG1-CE1 4.16Å; V411-F436 HydrophobicContact CG1-CG 4.43Å; L434-F436 HydrophobicContact CD2-CD2 4.07Å; L434-F436 HydrophobicContact CD2-CE1 4.14Å; L434-F436 HydrophobicContact CD2-CE2 3.66Å; L434-F436 HydrophobicContact CD2-CG 4.48Å; L434-F436 HydrophobicContact CD2-CZ 3.7Å
437	L	97.4	Very high	95.4	Very high	33 Å²	33	71.9 Å²	71.9	17%	0.173	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-99.6	130.7	177.5	-57.1	179.9	0	0	0	110.5	L356 L397 F410 A412	L356-L437 HydrophobicContact CD2-CD2 4.01Å; L397-L437 HydrophobicContact CD1-CD1 3.52Å; F410-L437 HydrophobicContact CB-CB 4.35Å; F410-L437 HydrophobicContact CB-CD1 4.36Å; F410-L437 WeakPolarHBondContact O-CB 3.18Å; F410-L437 PolarHBondContact O-N 3.37Å; A412-L437 HydrophobicContact CB-CD1 4.42Å; A412-L437 HydrophobicContact CB-CD2 4.38Å
438	P	97.6	Very high	95.3	Very high	24 Å²	24	77 Å²	77	16%	0.156	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-69.3	138.4	178.3	26.5	-32.9	0	0	0	111.3	H360 D442	H360-P438 HydrophobicContact CB-CG 3.93Å; H360-P438 WeakPolarHBondContact O-CD 3.44Å; P438-D442 HydrophobicContact CB-CB 3.67Å
439	F	96.9	Very high	95.2	Very high	73 Å²	73	81.6 Å²	81.6	32%	0.32	42%	0.415	S	S	.	.			trans	-70.6	178.6	165.8	-76.6	-68.9	0	0	0	110.7	Y409 F410 D441 D442	Y409-F439 AromaticContact CD1-CD2 3.92Å; Y409-F439 HydrophobicContact CD1-CD2 3.92Å; Y409-F439 AromaticContact CD1-CE2 3.57Å; Y409-F439 HydrophobicContact CD1-CE2 3.57Å; Y409-F439 HydrophobicContact CD2-CE2 4.45Å; Y409-F439 AromaticContact CE1-CD2 3.65Å; Y409-F439 HydrophobicContact CE1-CD2 3.65Å; Y409-F439 AromaticContact CE1-CE2 3.68Å; Y409-F439 HydrophobicContact CE1-CE2 3.68Å; Y409-F439 AromaticContact CG-CE2 3.99Å; Y409-F439 HydrophobicContact CG-CE2 3.99Å; F410-F439 AromaticContact CD2-CE1 3.71Å; F410-F439 HydrophobicContact CD2-CE1 3.71Å; F410-F439 HydrophobicContact CD2-CZ 4.11Å; F410-F439 HydrophobicContact CE2-CE1 4.03Å; F439-D441 VanDerWaalsContact C-N 3.27Å; F439-D441 PolarHBondContact O-N 2.81Å; F439-D442 PolarHBondContact N-OD2 3.38Å; F439-D442 PolarHBondContact O-N 3.42Å
440	A	96.6	Very high	95.2	Very high	80 Å²	80	88.6 Å²	88.6	66%	0.661	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-39.1	177.1	0	0	0	0	0	111.4	D442 K443	A440-D442 VanDerWaalsContact C-N 3.26Å; A440-D442 PolarHBondContact O-N 3.49Å; A440-K443 PolarHBondContact O-N 3.33Å; A440-K443 VanDerWaalsContact O-N 3.15Å
441	D	95.9	Very high	95.1	Very high	144 Å²	144	95.3 Å²	95.3	77%	0.77	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-28.8	-178.1	-52.1	-81.5	0	0	0	113.3	F439 K443	F439-D441 VanDerWaalsContact C-N 3.27Å; F439-D441 PolarHBondContact O-N 2.81Å; D441-K443 VanDerWaalsContact C-N 3.29Å; D441-K443 PolarHBondContact O-N 3.47Å
442	D	95.1	Very high	94.9	Very high	63 Å²	63	102.9 Å²	102.9	34%	0.337	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-19.2	178.9	-59.3	-47	0	0	0	112.3	L362 P438 F439 A440	L362-D442 HydrophobicContact CD1-CB 4.11Å; P438-D442 HydrophobicContact CB-CB 3.67Å; F439-D442 PolarHBondContact N-OD2 3.38Å; F439-D442 PolarHBondContact O-N 3.42Å; A440-D442 VanDerWaalsContact C-N 3.26Å; A440-D442 PolarHBondContact O-N 3.49Å
443	K	94.5	Very high	94.7	Very high	113 Å²	113	109.4 Å²	109.4	49%	0.491	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-87.4	116.1	-176.5	-68.2	176.6	-177	171.5	0	110.8	A440 D441	A440-K443 PolarHBondContact O-N 3.33Å; A440-K443 VanDerWaalsContact O-N 3.15Å; D441-K443 VanDerWaalsContact C-N 3.29Å; D441-K443 PolarHBondContact O-N 3.47Å
444	R	93.9	Very high	94.6	Very high	217 Å²	217	108.9 Å²	108.9	82%	0.819	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-89.8	122.2	176.4	-60.6	-62.9	-175.5	142.9	-1.2	111.1	M446	R444-M446 PolarHBondContact O-N 3.42Å
445	K	93.4	Very high	94.5	Very high	205 Å²	205	112.1 Å²	112.1	89%	0.891	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-74.5	123.2	173.5	-168.3	176.4	-177.2	-178.4	0	109.4
446	M	90.6	Very high	94.4	Very high	151 Å²	151	115.1 Å²	115.1	74%	0.744	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-94.3	138.8	177.2	-67.6	-71.1	-75.6	0	0	110.3	R444 F448	R444-M446 PolarHBondContact O-N 3.42Å; M446-F448 PolarHBondContact O-N 3.11Å
447	P	92.9	Very high	94.2	Very high	118 Å²	118	121.1 Å²	121.1	77%	0.766	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-68	129	166.4	29.9	-31.9	0	0	0	108.5
448	F	88.1	Confident	94	Very high	192 Å²	192	121.4 Å²	121.4	84%	0.842	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-90	134.4	175.2	55.6	-90	0	0	0	109.3	M446	M446-F448 PolarHBondContact O-N 3.11Å
449	T	91.4	Very high	94	Very high	128 Å²	128	123.2 Å²	123.2	79%	0.785	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-88	169.4	163.5	53.9	0	0	0	0	109.4	K451	T449-K451 PolarHBondContact O-N 3.24Å
450	E	92.5	Very high	93.9	Very high	171 Å²	171	123.8 Å²	123.8	80%	0.799	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-53.7	134.4	168.2	-68.4	177.3	-168.8	0	0	110.2	I452	E450-I452 PolarHBondContact O-N 3.13Å; E450-I452 VanDerWaalsContact O-N 3.1Å
451	K	93.4	Very high	93.8	Very high	171 Å²	171	123.4 Å²	123.4	74%	0.743	62%	0.619	S	S	*	*			trans	-80.1	94.6	-178.7	-175	-172.7	177	-170	0	108.9	T449 M453	T449-K451 PolarHBondContact O-N 3.24Å; K451-M453 HydrophobicContact CD-CG 4.3Å; K451-M453 HydrophobicContact CD-SD 4.38Å; K451-M453 HydrophobicContact CG-CG 4.2Å; K451-M453 PolarHBondContact O-N 3.49Å
452	I	92.8	Very high	93.7	Very high	159 Å²	159	120 Å²	120	82%	0.815	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-80.5	116.9	172.7	-56.4	171.4	0	0	0	108.1	E450	E450-I452 PolarHBondContact O-N 3.13Å; E450-I452 VanDerWaalsContact O-N 3.1Å
453	M	93.8	Very high	93.8	Very high	142 Å²	142	122.3 Å²	122.3	70%	0.7	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-97.8	138.9	179.1	-70.4	-174.1	56.1	0	0	110.7	K451	K451-M453 HydrophobicContact CD-CG 4.3Å; K451-M453 HydrophobicContact CD-SD 4.38Å; K451-M453 HydrophobicContact CG-CG 4.2Å; K451-M453 PolarHBondContact O-N 3.49Å
454	A	95.1	Very high	93.9	Very high	61 Å²	61	118.3 Å²	118.3	50%	0.504	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-71.5	153.8	173.7	0	0	0	0	0	111.5	Q458 V459	A454-Q458 VanDerWaalsContact CA-OE1 3.32Å; A454-Q458 HydrophobicContact CB-CB 4.26Å; A454-V459 HydrophobicContact CB-CG2 4.04Å
455	T	95.9	Very high	94	Very high	67 Å²	67	109 Å²	109	41%	0.411	56%	0.561	S	S	.	*	P	Polyproline II helix	trans	-73.7	156.2	172.2	65.4	0	0	0	0	110.5	E457 Q458 V459	T455-E457 PolarHBondContact O-N 2.93Å; T455-Q458 PolarHBondContact O-N 2.87Å; T455-Q458 VanDerWaalsContact OG1-CD 3.31Å; T455-Q458 VanDerWaalsContact OG1-CG 3.29Å; T455-Q458 WeakPolarHBondContact OG1-CG 3.5Å; T455-Q458 PolarHBondContact OG1-N 2.99Å; T455-Q458 PolarHBondContact OG1-OE1 3.15Å; T455-V459 WeakPolarHBondContact O-CG2 3.44Å; T455-V459 PolarHBondContact O-N 3.45Å; T455-V459 VanDerWaalsContact O-N 3.11Å
456	P	95.8	Very high	94.1	Very high	98 Å²	98	103.5 Å²	103.5	64%	0.636	55%	0.545	S	S	*	.	H	α-helix	trans	-56.5	-36.4	177.2	21.5	-33.4	0	0	0	112.8	V459 D460	P456-V459 WeakPolarHBondContact O-CB 3.46Å; P456-V459 PolarHBondContact O-N 2.99Å; P456-D460 PolarHBondContact O-N 2.98Å
457	E	94.3	Very high	94.4	Very high	133 Å²	133	103.1 Å²	103.1	62%	0.621	54%	0.541	S	S	*	.	H	α-helix	trans	-63.4	-43.4	178.1	-64.8	-179.2	174.5	0	0	112.7	T455 V459 D460 K461	T455-E457 PolarHBondContact O-N 2.93Å; E457-V459 VanDerWaalsContact C-N 3.31Å; E457-V459 PolarHBondContact O-N 3.39Å; E457-D460 PolarHBondContact O-N 3.06Å; E457-K461 PolarHBondContact O-N 3.29Å; E457-K461 VanDerWaalsContact O-N 3.07Å
458	Q	93.7	Very high	94.5	Very high	40 Å²	40	102.5 Å²	102.5	19%	0.187	53%	0.526	C	S	.	.	H	α-helix	trans	-62.5	-41.6	174.8	-70.3	165.9	-14.6	0	0	111	A454 T455 M462 F525 L528 V529	A454-Q458 VanDerWaalsContact CA-OE1 3.32Å; A454-Q458 HydrophobicContact CB-CB 4.26Å; T455-Q458 PolarHBondContact O-N 2.87Å; T455-Q458 VanDerWaalsContact OG1-CD 3.31Å; T455-Q458 VanDerWaalsContact OG1-CG 3.29Å; T455-Q458 WeakPolarHBondContact OG1-CG 3.5Å; T455-Q458 PolarHBondContact OG1-N 2.99Å; T455-Q458 PolarHBondContact OG1-OE1 3.15Å; Q458-M462 PolarHBondContact O-N 3.5Å; Q458-F525 WeakPolarHBondContact O-CE2 3.34Å; Q458-L528 HydrophobicContact CG-CB 4.12Å; Q458-L528 PolarHBondContact NE2-O 3.19Å; Q458-V529 HydrophobicContact CB-CG2 4.43Å; Q458-V529 HydrophobicContact CG-CG2 3.9Å
459	V	96.6	Very high	94.8	Very high	61 Å²	61	96 Å²	96	37%	0.37	50%	0.5	S	S	.	.	H	α-helix	trans	-63.2	-43	177.6	172.1	0	0	0	0	110.9	A454 T455 P456 E457 M462 K463	A454-V459 HydrophobicContact CB-CG2 4.04Å; T455-V459 WeakPolarHBondContact O-CG2 3.44Å; T455-V459 PolarHBondContact O-N 3.45Å; T455-V459 VanDerWaalsContact O-N 3.11Å; P456-V459 WeakPolarHBondContact O-CB 3.46Å; P456-V459 PolarHBondContact O-N 2.99Å; E457-V459 VanDerWaalsContact C-N 3.31Å; E457-V459 PolarHBondContact O-N 3.39Å; V459-M462 PolarHBondContact O-N 3.08Å; V459-K463 WeakPolarHBondContact O-CG 3.4Å; V459-K463 PolarHBondContact O-N 3.01Å
460	D	95.8	Very high	95.1	Very high	86 Å²	86	99.4 Å²	99.4	46%	0.46	50%	0.498	S	S	.	.	H	α-helix	trans	-69	-37.3	-178.3	-70.9	-22.3	0	0	0	112.5	P456 E457 K463 A464	P456-D460 PolarHBondContact O-N 2.98Å; E457-D460 PolarHBondContact O-N 3.06Å; D460-K463 WeakPolarHBondContact O-CB 3.19Å; D460-K463 PolarHBondContact O-N 2.98Å; D460-K463 IonicContact OD1-NZ 2.74Å; D460-K463 PolarHBondContact OD1-NZ 2.89Å; D460-A464 PolarHBondContact O-N 3.13Å; D460-A464 VanDerWaalsContact O-N 3.1Å
461	K	93.6	Very high	95.2	Very high	71 Å²	71	97.8 Å²	97.8	31%	0.309	49%	0.489	S	S	.	.	H	α-helix	trans	-63.7	-40.5	170.5	-71.2	-64.4	-173.6	176.2	0	112.3	E457 A464 I465 E524 F525 L528	E457-K461 PolarHBondContact O-N 3.29Å; E457-K461 VanDerWaalsContact O-N 3.07Å; K461-A464 PolarHBondContact O-N 3.16Å; K461-I465 WeakPolarHBondContact O-CG1 3.38Å; K461-I465 PolarHBondContact O-N 3.24Å; K461-I465 VanDerWaalsContact O-N 3.15Å; K461-E524 IonicContact NZ-OE2 3.57Å; K461-E524 PolarHBondContact NZ-OE2 3.45Å; K461-F525 HydrophobicContact CB-CD2 3.97Å; K461-L528 HydrophobicContact CB-CD1 4.37Å; K461-L528 HydrophobicContact CG-CD1 3.61Å
462	M	95.6	Very high	95.2	Very high	74 Å²	74	95.6 Å²	95.6	37%	0.365	49%	0.49	S	S	.	.	H	α-helix	trans	-65.1	-38.2	174.6	-176.9	56.1	63.1	0	0	112.2	Q458 V459 A464 I465 V466 F525	Q458-M462 PolarHBondContact O-N 3.5Å; V459-M462 PolarHBondContact O-N 3.08Å; M462-A464 VanDerWaalsContact C-N 3.34Å; M462-A464 PolarHBondContact O-N 3.34Å; M462-I465 WeakPolarHBondContact O-CB 3.46Å; M462-I465 PolarHBondContact O-N 3.04Å; M462-I465 HydrophobicContact SD-CB 4.43Å; M462-I465 HydrophobicContact SD-CG2 4.43Å; M462-V466 WeakPolarHBondContact O-CG2 3.35Å; M462-V466 PolarHBondContact O-N 3.32Å; M462-V466 HydrophobicContact SD-CG2 4.4Å; M462-F525 HydrophobicContact CB-CE2 3.98Å; M462-F525 HydrophobicContact CE-CD1 4.02Å; M462-F525 HydrophobicContact CE-CD2 4.24Å; M462-F525 HydrophobicContact CE-CE1 3.43Å; M462-F525 VanDerWaalsContact CE-CE1 3.43Å; M462-F525 HydrophobicContact CE-CE2 3.68Å; M462-F525 HydrophobicContact CE-CG 4.4Å; M462-F525 HydrophobicContact CE-CZ 3.23Å
463	K	96.6	Very high	95.3	Very high	110 Å²	110	95.4 Å²	95.4	48%	0.478	48%	0.48	S	S	.	.	H	α-helix	trans	-58.6	-44.8	173.3	-72.9	174.7	-170.3	153.1	0	111.6	V459 D460 I465 V466 E467	V459-K463 WeakPolarHBondContact O-CG 3.4Å; V459-K463 PolarHBondContact O-N 3.01Å; D460-K463 WeakPolarHBondContact O-CB 3.19Å; D460-K463 PolarHBondContact O-N 2.98Å; D460-K463 IonicContact OD1-NZ 2.74Å; D460-K463 PolarHBondContact OD1-NZ 2.89Å; K463-I465 VanDerWaalsContact C-N 3.31Å; K463-I465 PolarHBondContact O-N 3.16Å; K463-V466 PolarHBondContact O-N 3.3Å; K463-V466 VanDerWaalsContact O-N 3.15Å; K463-E467 WeakPolarHBondContact O-CG 3.39Å; K463-E467 PolarHBondContact O-N 3.1Å
464	A	95.8	Very high	95.1	Very high	30 Å²	30	93 Å²	93	25%	0.248	46%	0.463	C	S	.	.	H	α-helix	trans	-60.6	-40.1	177.5	0	0	0	0	0	112.2	D460 K461 M462 E467 K468 L521	D460-A464 PolarHBondContact O-N 3.13Å; D460-A464 VanDerWaalsContact O-N 3.1Å; K461-A464 PolarHBondContact O-N 3.16Å; M462-A464 VanDerWaalsContact C-N 3.34Å; M462-A464 PolarHBondContact O-N 3.34Å; A464-E467 PolarHBondContact O-N 3.48Å; A464-K468 VanDerWaalsContact O-CG 3.32Å; A464-K468 WeakPolarHBondContact O-CG 3.41Å; A464-K468 PolarHBondContact O-N 3.02Å; A464-K468 VanDerWaalsContact O-N 3.08Å; A464-L521 HydrophobicContact CB-CD1 4.46Å; A464-L521 HydrophobicContact CB-CD2 4.41Å
465	I	96.2	Very high	95	Very high	20 Å²	20	95.4 Å²	95.4	10%	0.103	48%	0.476	C	S	.	.	H	α-helix	trans	-61.4	-47.3	173.3	-68.7	172.1	0	0	0	110.7	K461 M462 K463 E467 K468 L469 L518 L521 F525	K461-I465 WeakPolarHBondContact O-CG1 3.38Å; K461-I465 PolarHBondContact O-N 3.24Å; K461-I465 VanDerWaalsContact O-N 3.15Å; M462-I465 WeakPolarHBondContact O-CB 3.46Å; M462-I465 PolarHBondContact O-N 3.04Å; M462-I465 HydrophobicContact SD-CB 4.43Å; M462-I465 HydrophobicContact SD-CG2 4.43Å; K463-I465 VanDerWaalsContact C-N 3.31Å; K463-I465 PolarHBondContact O-N 3.16Å; I465-E467 PolarHBondContact O-N 2.9Å; I465-K468 PolarHBondContact O-N 3.48Å; I465-L469 HydrophobicContact CG2-CD1 4.23Å; I465-L469 PolarHBondContact O-N 3.44Å; I465-L518 HydrophobicContact CB-CD2 4.24Å; I465-L518 HydrophobicContact CG1-CD2 4.28Å; I465-L518 HydrophobicContact CG2-CD2 3.82Å; I465-L521 HydrophobicContact CG1-CB 3.99Å; I465-F525 HydrophobicContact CD1-CB 3.86Å; I465-F525 HydrophobicContact CD1-CG 4.09Å
466	V	96.8	Very high	94.6	Very high	91 Å²	91	96 Å²	96	55%	0.552	48%	0.477	S	S	*	.	H	α-helix	trans	-61.6	-42.5	179.7	170.8	0	0	0	0	111.5	M462 K463 L469 R470	M462-V466 WeakPolarHBondContact O-CG2 3.35Å; M462-V466 PolarHBondContact O-N 3.32Å; M462-V466 HydrophobicContact SD-CG2 4.4Å; K463-V466 PolarHBondContact O-N 3.3Å; K463-V466 VanDerWaalsContact O-N 3.15Å; V466-L469 CarbonylContact O-C 3.49Å; V466-L469 PolarHBondContact O-N 2.82Å; V466-R470 PolarHBondContact O-N 2.84Å; V466-R470 VanDerWaalsContact O-N 3.1Å
467	E	95.7	Very high	94.4	Very high	142 Å²	142	93.6 Å²	93.6	66%	0.664	46%	0.463	S	S	*	.	H	α-helix	trans	-63.6	-41.1	177.1	-74.3	178.9	-177.1	0	0	112.2	K463 A464 I465 L469 R470	K463-E467 WeakPolarHBondContact O-CG 3.39Å; K463-E467 PolarHBondContact O-N 3.1Å; A464-E467 PolarHBondContact O-N 3.48Å; I465-E467 PolarHBondContact O-N 2.9Å; E467-L469 VanDerWaalsContact C-N 3.3Å; E467-L469 PolarHBondContact O-N 2.87Å; E467-R470 VanDerWaalsContact O-CB 3.29Å; E467-R470 WeakPolarHBondContact O-CB 3.48Å; E467-R470 PolarHBondContact O-N 3.31Å
468	K	94.9	Very high	94.3	Very high	105 Å²	105	92.1 Å²	92.1	46%	0.457	45%	0.454	S	S	.	.	H	α-helix	trans	-65	-32.4	175.5	-72.2	-71.4	-174.4	177.3	0	112.5	A464 I465 R517 L518 L521	A464-K468 VanDerWaalsContact O-CG 3.32Å; A464-K468 WeakPolarHBondContact O-CG 3.41Å; A464-K468 PolarHBondContact O-N 3.02Å; A464-K468 VanDerWaalsContact O-N 3.08Å; I465-K468 PolarHBondContact O-N 3.48Å; K468-R517 WeakPolarHBondContact O-CD 3.37Å; K468-R517 PolarHBondContact O-NE 3.41Å; K468-R517 PolarHBondContact O-NH1 2.93Å; K468-R517 VanDerWaalsContact O-NH1 3.1Å; K468-R517 PolarHBondContact O-NH2 3.27Å; K468-L518 HydrophobicContact CB-CD2 3.97Å; K468-L521 HydrophobicContact CG-CD1 3.88Å
469	L	95.8	Very high	94.2	Very high	55 Å²	55	95.1 Å²	95.1	29%	0.288	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	9.3	178.7	-63.2	179.7	0	0	0	113.8	I465 V466 E467 F471 M514 L518	I465-L469 HydrophobicContact CG2-CD1 4.23Å; I465-L469 PolarHBondContact O-N 3.44Å; V466-L469 CarbonylContact O-C 3.49Å; V466-L469 PolarHBondContact O-N 2.82Å; E467-L469 VanDerWaalsContact C-N 3.3Å; E467-L469 PolarHBondContact O-N 2.87Å; L469-F471 PolarHBondContact O-N 2.93Å; L469-M514 HydrophobicContact CD1-CE 4.07Å; L469-M514 HydrophobicContact CD2-CB 4.1Å; L469-M514 HydrophobicContact CD2-CE 4.28Å; L469-M514 HydrophobicContact CD2-CG 4Å; L469-L518 HydrophobicContact CD1-CD1 4.16Å; L469-L518 HydrophobicContact CD1-CD2 4.35Å; L469-L518 HydrophobicContact CD2-CD1 4.22Å; L469-L518 HydrophobicContact CD2-CD2 4.21Å; L469-L518 HydrophobicContact CD2-CG 4.09Å; L469-L518 HydrophobicContact CG-CD1 4.4Å; L469-L518 HydrophobicContact CG-CD2 3.97Å; L469-L518 HydrophobicContact CG-CG 4.35Å
470	R	95.9	Very high	94.1	Very high	200 Å²	200	95.7 Å²	95.7	76%	0.755	47%	0.469	S	S	*	.			trans	-62.7	134.5	178.7	-170.2	176	177.8	-178.8	-1.5	111.1	V466 E467	V466-R470 PolarHBondContact O-N 2.84Å; V466-R470 VanDerWaalsContact O-N 3.1Å; E467-R470 VanDerWaalsContact O-CB 3.29Å; E467-R470 WeakPolarHBondContact O-CB 3.48Å; E467-R470 PolarHBondContact O-N 3.31Å
471	F	95.2	Very high	94.1	Very high	137 Å²	137	93.4 Å²	93.4	60%	0.601	46%	0.459	S	S	*	.			trans	-144.8	162.3	172.1	74.7	-79.5	0	0	0	109.9	L469	L469-F471 PolarHBondContact O-N 2.93Å
472	T	94.6	Very high	94.1	Very high	125 Å²	125	94.9 Å²	94.9	77%	0.767	47%	0.474	S	S	*	.			trans	-88.4	109.2	178.1	-52.5	0	0	0	0	109.4
473	Y	94.3	Very high	94	Very high	155 Å²	155	92 Å²	92	61%	0.608	46%	0.46	S	S	*	.			trans	-77.3	135	175.6	172.1	-99.6	0	0	0	110.9	F478	Y473-F478 HydrophobicContact CD2-CE2 4.23Å; Y473-F478 HydrophobicContact CE2-CD2 4.47Å; Y473-F478 HydrophobicContact CE2-CE2 4.16Å
474	R	90.2	Very high	93.8	Very high	91 Å²	91	88.3 Å²	88.3	34%	0.343	45%	0.445	S	S	.	.			trans	-127	152.8	164.8	-59	168	49.2	152.4	0.3	109.7	D476 S477	R474-D476 WeakPolarHBondContact CB-OD1 3.48Å; R474-D476 IonicContact CZ-OD1 2.83Å; R474-D476 IonicContact CZ-OD2 3.09Å; R474-D476 IonicContact NE-OD1 3.82Å; R474-D476 PolarHBondContact NE-OD1 3.01Å; R474-D476 IonicContact NE-OD2 3.55Å; R474-D476 IonicContact NH2-OD1 3.93Å; R474-D476 IonicContact NH2-OD2 2.65Å; R474-D476 PolarHBondContact NH2-OD2 3.29Å; R474-D476 PolarHBondContact O-N 3.13Å; R474-S477 WeakPolarHBondContact CB-OG 3.33Å; R474-S477 PolarHBondContact N-OG 3.08Å; R474-S477 WeakPolarHBondContact O-CB 3.2Å; R474-S477 PolarHBondContact O-N 2.96Å; R474-S477 PolarHBondContact O-OG 3.38Å; R474-S477 VanDerWaalsContact O-OG 3.07Å
475	S	91.4	Very high	93.7	Very high	112 Å²	112	89 Å²	89	78%	0.783	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-23.9	-179.9	51.6	0	0	0	0	113.5
476	D	89.1	Confident	93.5	Very high	80 Å²	80	89.7 Å²	89.7	43%	0.428	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	6.2	-179.5	60.4	-5.6	0	0	0	113.7	R474 F478	R474-D476 WeakPolarHBondContact CB-OD1 3.48Å; R474-D476 IonicContact CZ-OD1 2.83Å; R474-D476 IonicContact CZ-OD2 3.09Å; R474-D476 IonicContact NE-OD1 3.82Å; R474-D476 PolarHBondContact NE-OD1 3.01Å; R474-D476 IonicContact NE-OD2 3.55Å; R474-D476 IonicContact NH2-OD1 3.93Å; R474-D476 IonicContact NH2-OD2 2.65Å; R474-D476 PolarHBondContact NH2-OD2 3.29Å; R474-D476 PolarHBondContact O-N 3.13Å; D476-F478 VanDerWaalsContact C-N 3.31Å; D476-F478 PolarHBondContact O-N 3.43Å
477	S	90.3	Very high	93.2	Very high	47 Å²	47	86.4 Å²	86.4	33%	0.329	42%	0.424	S	S	.	.	S	Bend	trans	-70.7	-20.4	-175	-61.8	0	0	0	0	115.2	R474	R474-S477 WeakPolarHBondContact CB-OG 3.33Å; R474-S477 PolarHBondContact N-OG 3.08Å; R474-S477 WeakPolarHBondContact O-CB 3.2Å; R474-S477 PolarHBondContact O-N 2.96Å; R474-S477 PolarHBondContact O-OG 3.38Å; R474-S477 VanDerWaalsContact O-OG 3.07Å
478	F	92.9	Very high	93	Very high	102 Å²	102	82.3 Å²	82.3	45%	0.447	40%	0.402	S	S	.	.			trans	-127.6	129.1	-172.4	-57.4	-81.8	0	0	0	110.8	Y473 D476 L506	Y473-F478 HydrophobicContact CD2-CE2 4.23Å; Y473-F478 HydrophobicContact CE2-CD2 4.47Å; Y473-F478 HydrophobicContact CE2-CE2 4.16Å; D476-F478 VanDerWaalsContact C-N 3.31Å; D476-F478 PolarHBondContact O-N 3.43Å; F478-L506 HydrophobicContact CD1-CB 4.44Å; F478-L506 WeakPolarHBondContact CD1-O 3.48Å; F478-L506 WeakPolarHBondContact CE1-O 3.28Å
479	E	91.4	Very high	92.8	Very high	103 Å²	103	80.2 Å²	80.2	48%	0.481	40%	0.396	S	S	.	.			trans	-90.3	156.8	170.3	-59.4	-172.6	168.2	0	0	110.7	P481 Q484	E479-P481 VanDerWaalsContact O-CD 3.22Å; E479-P481 WeakPolarHBondContact O-CD 3.37Å; E479-Q484 HydrophobicContact CB-CG 4.01Å; E479-Q484 WeakPolarHBondContact OE2-CG 3.42Å; E479-Q484 PolarHBondContact OE2-NE2 3.13Å
480	N	94.4	Very high	92.5	Very high	73 Å²	73	81.4 Å²	81.4	39%	0.39	40%	0.402	S	S	.	.			trans	-80.6	111.4	177.8	-177.2	-24	0	0	0	110	V482 L483 Q484	N480-V482 PolarHBondContact O-N 3.41Å; N480-V482 WeakPolarHBondContact OD1-CB 3.46Å; N480-V482 PolarHBondContact OD1-N 2.97Å; N480-V482 VanDerWaalsContact OD1-N 3.1Å; N480-L483 HydrophobicContact CB-CB 4.16Å; N480-L483 HydrophobicContact CB-CD1 4.09Å; N480-L483 HydrophobicContact CB-CG 4.14Å; N480-L483 PolarHBondContact O-N 2.96Å; N480-L483 VanDerWaalsContact O-N 3.11Å; N480-Q484 PolarHBondContact O-N 3.03Å
481	P	94.8	Very high	92	Very high	39 Å²	39	74 Å²	74	25%	0.253	38%	0.376	S	S	.	.	H	α-helix	trans	-61	-34	-174.3	-22.8	34.6	0	0	0	113	E479 Q484 Q485 D505 T507	E479-P481 VanDerWaalsContact O-CD 3.22Å; E479-P481 WeakPolarHBondContact O-CD 3.37Å; P481-Q484 PolarHBondContact O-N 3.49Å; P481-Q485 WeakPolarHBondContact O-CB 3.48Å; P481-Q485 PolarHBondContact O-N 3.35Å; P481-D505 WeakPolarHBondContact CG-OD1 3.39Å; P481-T507 HydrophobicContact CG-CG2 3.74Å
482	V	95.3	Very high	91.8	Very high	101 Å²	101	67.8 Å²	67.8	61%	0.612	35%	0.35	S	S	*	.	H	α-helix	trans	-67.6	-40.2	180	179.3	0	0	0	0	111.1	N480 H486	N480-V482 PolarHBondContact O-N 3.41Å; N480-V482 WeakPolarHBondContact OD1-CB 3.46Å; N480-V482 PolarHBondContact OD1-N 2.97Å; N480-V482 VanDerWaalsContact OD1-N 3.1Å; V482-H486 VanDerWaalsContact O-CB 3.29Å; V482-H486 WeakPolarHBondContact O-CB 3.45Å; V482-H486 PolarHBondContact O-N 2.88Å; V482-H486 VanDerWaalsContact O-N 3.16Å
483	L	92.8	Very high	91.5	Very high	13 Å²	13	67.9 Å²	67.9	7%	0.068	35%	0.345	C	S	.	.	H	α-helix	trans	-72.3	-45.4	176.9	-66.4	-179.1	0	0	0	110.6	A280 K282 N480 Q485 H486 F487	A280-L483 HydrophobicContact CB-CD1 3.56Å; K282-L483 HydrophobicContact CB-CD2 4.17Å; N480-L483 HydrophobicContact CB-CB 4.16Å; N480-L483 HydrophobicContact CB-CD1 4.09Å; N480-L483 HydrophobicContact CB-CG 4.14Å; N480-L483 PolarHBondContact O-N 2.96Å; N480-L483 VanDerWaalsContact O-N 3.11Å; L483-Q485 PolarHBondContact O-N 2.8Å; L483-H486 WeakPolarHBondContact O-CB 3.48Å; L483-H486 PolarHBondContact O-N 2.9Å; L483-H486 VanDerWaalsContact O-N 3.1Å; L483-F487 HydrophobicContact CB-CD2 4.45Å; L483-F487 HydrophobicContact CB-CE2 4.46Å; L483-F487 HydrophobicContact CD2-CE2 4.38Å; L483-F487 WeakPolarHBondContact O-CD2 3.5Å; L483-F487 PolarHBondContact O-N 3.27Å
484	Q	91.6	Very high	91.2	Very high	34 Å²	34	63.3 Å²	63.3	16%	0.159	34%	0.339	C	S	.	.	H	α-helix	trans	-56	-51.7	178.6	-71.2	-58.1	-16.6	0	0	111.4	E479 N480 P481 H486 F487 R488 A503	E479-Q484 HydrophobicContact CB-CG 4.01Å; E479-Q484 WeakPolarHBondContact OE2-CG 3.42Å; E479-Q484 PolarHBondContact OE2-NE2 3.13Å; N480-Q484 PolarHBondContact O-N 3.03Å; P481-Q484 PolarHBondContact O-N 3.49Å; Q484-H486 VanDerWaalsContact C-N 3.27Å; Q484-H486 PolarHBondContact O-N 2.91Å; Q484-F487 PolarHBondContact O-N 3.23Å; Q484-R488 WeakPolarHBondContact O-CB 3.47Å; Q484-R488 WeakPolarHBondContact O-CG 3.21Å; Q484-R488 PolarHBondContact O-N 3.19Å; Q484-A503 HydrophobicContact CB-CB 3.88Å
485	Q	93.5	Very high	90.9	Very high	45 Å²	45	60.4 Å²	60.4	21%	0.21	33%	0.331	C	S	.	.	H	α-helix	trans	-62.9	-35.7	178.4	-166.7	60.2	51.8	0	0	112.4	P481 L483 N489 E501	P481-Q485 WeakPolarHBondContact O-CB 3.48Å; P481-Q485 PolarHBondContact O-N 3.35Å; L483-Q485 PolarHBondContact O-N 2.8Å; Q485-N489 PolarHBondContact NE2-OD1 3.24Å; Q485-N489 WeakPolarHBondContact O-CB 3.21Å; Q485-N489 PolarHBondContact O-N 2.79Å; Q485-N489 VanDerWaalsContact O-N 3.09Å; Q485-N489 PolarHBondContact O-ND2 2.73Å; Q485-N489 PolarHBondContact O-OD1 3Å; Q485-E501 PolarHBondContact NE2-O 3.4Å
486	H	93.5	Very high	90.7	Very high	34 Å²	34	62.3 Å²	62.3	16%	0.157	33%	0.332	C	S	.	.	H	α-helix	trans	-62.7	-48.6	177.7	178.2	46.7	0	0	0	112.3	K282 V482 L483 Q484 N489 L490	K282-H486 VanDerWaalsContact CE-CE1 3.44Å; K282-H486 WeakPolarHBondContact CE-CE1 3.33Å; V482-H486 VanDerWaalsContact O-CB 3.29Å; V482-H486 WeakPolarHBondContact O-CB 3.45Å; V482-H486 PolarHBondContact O-N 2.88Å; V482-H486 VanDerWaalsContact O-N 3.16Å; L483-H486 WeakPolarHBondContact O-CB 3.48Å; L483-H486 PolarHBondContact O-N 2.9Å; L483-H486 VanDerWaalsContact O-N 3.1Å; Q484-H486 VanDerWaalsContact C-N 3.27Å; Q484-H486 PolarHBondContact O-N 2.91Å; H486-N489 PolarHBondContact O-N 2.96Å; H486-L490 WeakPolarHBondContact O-CG 3.31Å; H486-L490 PolarHBondContact O-N 2.96Å; H486-L490 VanDerWaalsContact O-N 3.11Å
487	F	90	Very high	90.5	Very high	22 Å²	22	63.3 Å²	63.3	10%	0.096	34%	0.336	C	S	.	.	H	α-helix	trans	-73.9	-34.2	-178.4	-72.9	-75.9	0	0	0	112.5	I75 I76 P283 L483 Q484 N489 L490 E491	I75-F487 HydrophobicContact CG2-CD1 4.14Å; I75-F487 HydrophobicContact CG2-CE1 4.13Å; I76-F487 HydrophobicContact CB-CE2 4.08Å; I76-F487 HydrophobicContact CB-CZ 4.14Å; I76-F487 HydrophobicContact CD1-CD2 4.28Å; I76-F487 HydrophobicContact CG1-CD1 4.21Å; I76-F487 HydrophobicContact CG1-CD2 3.66Å; I76-F487 HydrophobicContact CG1-CE1 4.22Å; I76-F487 HydrophobicContact CG1-CE2 3.69Å; I76-F487 HydrophobicContact CG1-CG 3.94Å; I76-F487 HydrophobicContact CG1-CZ 3.97Å; I76-F487 HydrophobicContact CG2-CD2 4.5Å; I76-F487 HydrophobicContact CG2-CE2 3.84Å; I76-F487 HydrophobicContact CG2-CZ 4.2Å; P283-F487 HydrophobicContact CG-CE1 4.39Å; P283-F487 HydrophobicContact CG-CZ 3.78Å; L483-F487 HydrophobicContact CB-CD2 4.45Å; L483-F487 HydrophobicContact CB-CE2 4.46Å; L483-F487 HydrophobicContact CD2-CE2 4.38Å; L483-F487 WeakPolarHBondContact O-CD2 3.5Å; L483-F487 PolarHBondContact O-N 3.27Å; Q484-F487 PolarHBondContact O-N 3.23Å; F487-N489 VanDerWaalsContact C-N 3.3Å; F487-N489 PolarHBondContact O-N 3.47Å; F487-L490 HydrophobicContact CD1-CD1 4.27Å; F487-L490 PolarHBondContact O-N 3.2Å; F487-L490 VanDerWaalsContact O-N 3.17Å; F487-E491 WeakPolarHBondContact O-CB 3.48Å; F487-E491 PolarHBondContact O-N 3.01Å
488	R	90.1	Very high	90.3	Very high	56 Å²	56	70.6 Å²	70.6	21%	0.211	37%	0.368	C	S	.	.	H	α-helix	trans	-60.7	-39.8	171.5	-67.2	-73.6	158.1	-169.3	-16.5	112	Q484 E491 A492 E501	Q484-R488 WeakPolarHBondContact O-CB 3.47Å; Q484-R488 WeakPolarHBondContact O-CG 3.21Å; Q484-R488 PolarHBondContact O-N 3.19Å; R488-E491 IonicContact CZ-OE2 2.77Å; R488-E491 IonicContact NH1-OE2 2.72Å; R488-E491 PolarHBondContact NH1-OE2 3.33Å; R488-A492 PolarHBondContact O-N 2.65Å; R488-A492 VanDerWaalsContact O-N 3.11Å; R488-E501 WeakPolarHBondContact CD-OE2 3.48Å; R488-E501 IonicContact CZ-OE2 3.66Å; R488-E501 IonicContact NE-OE2 3.57Å; R488-E501 IonicContact NH1-OE2 2.65Å; R488-E501 PolarHBondContact NH1-OE2 3.28Å
489	N	91.9	Very high	90	Very high	60 Å²	60	73.3 Å²	73.3	32%	0.321	38%	0.382	S	S	.	.	H	α-helix	trans	-65.7	-41.3	173.8	-68.6	-13.2	0	0	0	112.2	Q485 H486 F487 L493 P500	Q485-N489 PolarHBondContact NE2-OD1 3.24Å; Q485-N489 WeakPolarHBondContact O-CB 3.21Å; Q485-N489 PolarHBondContact O-N 2.79Å; Q485-N489 VanDerWaalsContact O-N 3.09Å; Q485-N489 PolarHBondContact O-ND2 2.73Å; Q485-N489 PolarHBondContact O-OD1 3Å; H486-N489 PolarHBondContact O-N 2.96Å; F487-N489 VanDerWaalsContact C-N 3.3Å; F487-N489 PolarHBondContact O-N 3.47Å; N489-L493 VanDerWaalsContact O-CG 3.32Å; N489-L493 WeakPolarHBondContact O-CG 3.44Å; N489-L493 PolarHBondContact O-N 3.03Å; N489-L493 VanDerWaalsContact O-N 3.12Å; N489-P500 VanDerWaalsContact OD1-CB 3.3Å; N489-P500 WeakPolarHBondContact OD1-CB 3.49Å
490	L	89.1	Confident	89.9	Confident	80 Å²	80	70.8 Å²	70.8	42%	0.419	37%	0.374	S	S	.	.	H	α-helix	trans	-67.5	-38.9	177.8	-73	178.6	0	0	0	112.3	H486 F487 L493 A494	H486-L490 WeakPolarHBondContact O-CG 3.31Å; H486-L490 PolarHBondContact O-N 2.96Å; H486-L490 VanDerWaalsContact O-N 3.11Å; F487-L490 HydrophobicContact CD1-CD1 4.27Å; F487-L490 PolarHBondContact O-N 3.2Å; F487-L490 VanDerWaalsContact O-N 3.17Å; L490-L493 PolarHBondContact O-N 2.97Å; L490-A494 VanDerWaalsContact O-CB 3.26Å; L490-A494 WeakPolarHBondContact O-CB 3.46Å; L490-A494 PolarHBondContact O-N 2.96Å
491	E	86.2	Confident	89.7	Confident	45 Å²	45	73 Å²	73	21%	0.21	38%	0.382	C	S	.	.	H	α-helix	trans	-60.3	-47.9	175.4	179.9	173.2	-149.6	0	0	111	F487 R488 L493 A494 L495	F487-E491 WeakPolarHBondContact O-CB 3.48Å; F487-E491 PolarHBondContact O-N 3.01Å; R488-E491 IonicContact CZ-OE2 2.77Å; R488-E491 IonicContact NH1-OE2 2.72Å; R488-E491 PolarHBondContact NH1-OE2 3.33Å; E491-L493 VanDerWaalsContact C-N 3.34Å; E491-L493 PolarHBondContact O-N 2.94Å; E491-A494 PolarHBondContact O-N 3.37Å; E491-L495 HydrophobicContact CG-CD1 3.98Å; E491-L495 WeakPolarHBondContact O-CB 3.48Å; E491-L495 WeakPolarHBondContact O-CG 3.44Å; E491-L495 PolarHBondContact O-N 3.08Å
492	A	90.1	Very high	89.5	Confident	7 Å²	7	77.5 Å²	77.5	6%	0.058	40%	0.4	C	S	.	.	H	α-helix	trans	-60.5	-42	177	0	0	0	0	0	112.7	R488 L495 D496 L497 P500	R488-A492 PolarHBondContact O-N 2.65Å; R488-A492 VanDerWaalsContact O-N 3.11Å; A492-L495 PolarHBondContact O-N 3.01Å; A492-D496 PolarHBondContact O-N 3.29Å; A492-D496 VanDerWaalsContact O-N 3.12Å; A492-L497 HydrophobicContact CB-CB 4.15Å; A492-L497 HydrophobicContact CB-CD1 4.45Å; A492-L497 PolarHBondContact O-N 3.16Å; A492-P500 HydrophobicContact CB-CB 3.8Å
493	L	89.4	Confident	89.3	Confident	127 Å²	127	74.3 Å²	74.3	67%	0.665	39%	0.385	S	S	*	.	H	α-helix	trans	-68.1	-39.9	176.2	-70.3	171.2	0	0	0	112.6	N489 L490 E491 L495 D496	N489-L493 VanDerWaalsContact O-CG 3.32Å; N489-L493 WeakPolarHBondContact O-CG 3.44Å; N489-L493 PolarHBondContact O-N 3.03Å; N489-L493 VanDerWaalsContact O-N 3.12Å; L490-L493 PolarHBondContact O-N 2.97Å; E491-L493 VanDerWaalsContact C-N 3.34Å; E491-L493 PolarHBondContact O-N 2.94Å; L493-L495 PolarHBondContact O-N 2.77Å; L493-D496 PolarHBondContact O-N 3.08Å
494	A	86.3	Confident	89.3	Confident	58 Å²	58	79.7 Å²	79.7	48%	0.479	42%	0.418	S	S	.	.	H	α-helix	trans	-71.4	-20.7	-179.7	0	0	0	0	0	113.3	A113 L490 E491	A113-A494 HydrophobicContact CB-CB 3.68Å; L490-A494 VanDerWaalsContact O-CB 3.26Å; L490-A494 WeakPolarHBondContact O-CB 3.46Å; L490-A494 PolarHBondContact O-N 2.96Å; E491-A494 PolarHBondContact O-N 3.37Å
495	L	84.4	Confident	89.4	Confident	31 Å²	31	80.9 Å²	80.9	16%	0.162	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	4.3	177.7	-66.3	178.3	0	0	0	113.3	A113 K114 L117 E491 A492 L493 L497	A113-L495 HydrophobicContact CB-CD1 4.43Å; A113-L495 HydrophobicContact CB-CD2 3.77Å; A113-L495 HydrophobicContact CB-CG 3.83Å; K114-L495 HydrophobicContact CG-CD2 4.27Å; L117-L495 HydrophobicContact CB-CD1 4.27Å; L117-L495 HydrophobicContact CB-CD2 4.25Å; L117-L495 HydrophobicContact CD2-CD1 4.36Å; L117-L495 HydrophobicContact CD2-CD2 3.96Å; E491-L495 HydrophobicContact CG-CD1 3.98Å; E491-L495 WeakPolarHBondContact O-CB 3.48Å; E491-L495 WeakPolarHBondContact O-CG 3.44Å; E491-L495 PolarHBondContact O-N 3.08Å; A492-L495 PolarHBondContact O-N 3.01Å; L493-L495 PolarHBondContact O-N 2.77Å; L495-L497 HydrophobicContact CB-CD1 4.34Å; L495-L497 HydrophobicContact CB-CD2 4.35Å; L495-L497 HydrophobicContact CB-CG 3.86Å; L495-L497 HydrophobicContact CD1-CD1 4.43Å; L495-L497 PolarHBondContact O-N 3.13Å
496	D	87	Confident	89.3	Confident	152 Å²	152	82.7 Å²	82.7	81%	0.813	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	37.9	-175.5	-62.5	-53.6	0	0	0	113.3	A492 L493	A492-D496 PolarHBondContact O-N 3.29Å; A492-D496 VanDerWaalsContact O-N 3.12Å; L493-D496 PolarHBondContact O-N 3.08Å
497	L	85.3	Confident	89.4	Confident	100 Å²	100	84.7 Å²	84.7	52%	0.524	45%	0.45	S	S	.	.			trans	-73.9	147.5	175.9	-60.7	-179.2	0	0	0	110.9	A492 L495 E499	A492-L497 HydrophobicContact CB-CB 4.15Å; A492-L497 HydrophobicContact CB-CD1 4.45Å; A492-L497 PolarHBondContact O-N 3.16Å; L495-L497 HydrophobicContact CB-CD1 4.34Å; L495-L497 HydrophobicContact CB-CD2 4.35Å; L495-L497 HydrophobicContact CB-CG 3.86Å; L495-L497 HydrophobicContact CD1-CD1 4.43Å; L495-L497 PolarHBondContact O-N 3.13Å; L497-E499 VanDerWaalsContact C-N 3.35Å; L497-E499 PolarHBondContact O-N 2.83Å
498	M	85.8	Confident	89.6	Confident	201 Å²	201	89.1 Å²	89.1	99%	0.99	48%	0.475	S	S	*	.	S	Bend	trans	-67	-35.1	-178.5	-65.8	-177.3	179.5	0	0	113
499	E	87.9	Confident	89.9	Confident	159 Å²	159	90.6 Å²	90.6	74%	0.743	49%	0.491	S	S	*	.	S	Bend	trans	-141.1	140.9	-179.1	61.9	-176.9	178.6	0	0	111.4	L497	L497-E499 VanDerWaalsContact C-N 3.35Å; L497-E499 PolarHBondContact O-N 2.83Å
500	P	88.4	Confident	90	Very high	49 Å²	49	95.8 Å²	95.8	32%	0.318	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-78.4	140.7	173.9	31.7	-33.2	0	0	0	111.4	N489 A492 Q502	N489-P500 VanDerWaalsContact OD1-CB 3.3Å; N489-P500 WeakPolarHBondContact OD1-CB 3.49Å; A492-P500 HydrophobicContact CB-CB 3.8Å; P500-Q502 PolarHBondContact O-N 3.38Å; P500-Q502 PolarHBondContact O-NE2 2.92Å
501	E	89.3	Confident	90.3	Very high	120 Å²	120	95.6 Å²	95.6	56%	0.561	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-59.3	132.5	171.4	-172.1	-178.6	-176.4	0	0	110.5	Q485 R488	Q485-E501 PolarHBondContact NE2-O 3.4Å; R488-E501 WeakPolarHBondContact CD-OE2 3.48Å; R488-E501 IonicContact CZ-OE2 3.66Å; R488-E501 IonicContact NE-OE2 3.57Å; R488-E501 IonicContact NH1-OE2 2.65Å; R488-E501 PolarHBondContact NH1-OE2 3.28Å
502	Q	91.4	Very high	90.8	Very high	133 Å²	133	100.5 Å²	100.5	62%	0.621	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-85.7	117.6	177	-62.4	-56.9	-61.7	0	0	109.5	P500	P500-Q502 PolarHBondContact O-N 3.38Å; P500-Q502 PolarHBondContact O-NE2 2.92Å
503	A	90.5	Very high	91	Very high	35 Å²	35	103 Å²	103	29%	0.289	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-69.8	134.9	178.3	0	0	0	0	0	110.5	Q484 D505	Q484-A503 HydrophobicContact CB-CB 3.88Å; A503-D505 PolarHBondContact O-N 2.72Å
504	V	92.9	Very high	91.2	Very high	126 Å²	126	100.1 Å²	100.1	76%	0.764	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-77.3	120.9	173.8	-178.6	0	0	0	0	109.3	L506	V504-L506 PolarHBondContact O-N 2.88Å; V504-L506 VanDerWaalsContact O-N 3.12Å
505	D	93.8	Very high	91.6	Very high	58 Å²	58	101.4 Å²	101.4	31%	0.31	54%	0.539	S	S	.	.			trans	-75.5	102.6	178.9	-169	-16.6	0	0	0	111.4	P481 A503 T507 L508	P481-D505 WeakPolarHBondContact CG-OD1 3.39Å; A503-D505 PolarHBondContact O-N 2.72Å; D505-T507 PolarHBondContact O-N 3.31Å; D505-T507 WeakPolarHBondContact OD1-CA 3.3Å; D505-T507 VanDerWaalsContact OD1-CB 3.27Å; D505-T507 WeakPolarHBondContact OD1-CB 3.42Å; D505-T507 PolarHBondContact OD1-N 3.5Å; D505-T507 PolarHBondContact OD1-OG1 3.41Å; D505-T507 PolarHBondContact OD2-OG1 2.85Å; D505-L508 HydrophobicContact CB-CD1 4.09Å; D505-L508 HydrophobicContact CB-CG 4.11Å
506	L	92.8	Very high	92.2	Very high	84 Å²	84	109 Å²	109	44%	0.44	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.4	-11	177.8	-59.4	178.6	0	0	0	113.4	F478 V504	F478-L506 HydrophobicContact CD1-CB 4.44Å; F478-L506 WeakPolarHBondContact CD1-O 3.48Å; F478-L506 WeakPolarHBondContact CE1-O 3.28Å; V504-L506 PolarHBondContact O-N 2.88Å; V504-L506 VanDerWaalsContact O-N 3.12Å
507	T	94.4	Very high	92.5	Very high	75 Å²	75	108.7 Å²	108.7	46%	0.46	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85	-18	-179.8	75.8	0	0	0	0	112.7	P481 D505	P481-T507 HydrophobicContact CG-CG2 3.74Å; D505-T507 PolarHBondContact O-N 3.31Å; D505-T507 WeakPolarHBondContact OD1-CA 3.3Å; D505-T507 VanDerWaalsContact OD1-CB 3.27Å; D505-T507 WeakPolarHBondContact OD1-CB 3.42Å; D505-T507 PolarHBondContact OD1-N 3.5Å; D505-T507 PolarHBondContact OD1-OG1 3.41Å; D505-T507 PolarHBondContact OD2-OG1 2.85Å
508	L	94.9	Very high	92.9	Very high	116 Å²	116	104.7 Å²	104.7	61%	0.607	54%	0.537	S	S	*	.	S	Bend	trans	-70.9	131.2	175	-68.1	179.3	0	0	0	110.7	D505	D505-L508 HydrophobicContact CB-CD1 4.09Å; D505-L508 HydrophobicContact CB-CG 4.11Å
509	P	95.1	Very high	93.3	Very high	87 Å²	87	97.4 Å²	97.4	57%	0.565	51%	0.514	S	S	*	.			trans	-60.4	141.3	174.9	-22	32.6	0	0	0	111.4	V511 M514	P509-V511 HydrophobicContact CB-CG2 4.45Å; P509-V511 PolarHBondContact O-N 3.06Å; P509-M514 HydrophobicContact CB-SD 3.74Å
510	K	95.4	Very high	93.6	Very high	169 Å²	169	93.1 Å²	93.1	74%	0.735	50%	0.501	S	S	*	.			trans	-77.1	69.4	175.1	-61.9	179.6	-177.5	179.3	0	110.2	E512 A513 M514	K510-E512 PolarHBondContact O-N 3.21Å; K510-A513 HydrophobicContact CB-CB 4.08Å; K510-A513 WeakPolarHBondContact O-CB 3.47Å; K510-A513 PolarHBondContact O-N 2.89Å; K510-M514 WeakPolarHBondContact O-CG 3.4Å; K510-M514 PolarHBondContact O-N 2.69Å
511	V	95.4	Very high	93.8	Very high	76 Å²	76	92.1 Å²	92.1	46%	0.461	49%	0.493	S	S	.	.	H	α-helix	trans	-49.4	-52.3	-168.7	176	0	0	0	0	112.6	P509 A513 M514 N515	P509-V511 HydrophobicContact CB-CG2 4.45Å; P509-V511 PolarHBondContact O-N 3.06Å; V511-A513 VanDerWaalsContact C-N 3.33Å; V511-A513 PolarHBondContact O-N 3.25Å; V511-M514 WeakPolarHBondContact O-CB 3.37Å; V511-M514 PolarHBondContact O-N 3.06Å; V511-M514 VanDerWaalsContact O-N 3.13Å; V511-N515 WeakPolarHBondContact CG1-ND2 3.28Å; V511-N515 WeakPolarHBondContact O-CB 3.43Å; V511-N515 VanDerWaalsContact O-CG 3.26Å; V511-N515 PolarHBondContact O-N 2.81Å; V511-N515 PolarHBondContact O-ND2 2.98Å
512	E	95.5	Very high	94.1	Very high	148 Å²	148	88.5 Å²	88.5	69%	0.692	48%	0.479	S	S	*	.	H	α-helix	trans	-61.5	-40.5	-178.7	-61.5	-51.4	141.2	0	0	112.9	K510 K516	K510-E512 PolarHBondContact O-N 3.21Å; E512-K516 VanDerWaalsContact O-CB 3.32Å; E512-K516 WeakPolarHBondContact O-CB 3.48Å; E512-K516 PolarHBondContact O-N 3.07Å
513	A	94.1	Very high	94.2	Very high	59 Å²	59	86.5 Å²	86.5	49%	0.488	47%	0.473	S	S	.	.	H	α-helix	trans	-67.5	-38.5	176.8	0	0	0	0	0	111.5	K510 V511 R517	K510-A513 HydrophobicContact CB-CB 4.08Å; K510-A513 WeakPolarHBondContact O-CB 3.47Å; K510-A513 PolarHBondContact O-N 2.89Å; V511-A513 VanDerWaalsContact C-N 3.33Å; V511-A513 PolarHBondContact O-N 3.25Å; A513-R517 VanDerWaalsContact O-CB 3.27Å; A513-R517 WeakPolarHBondContact O-CB 3.41Å; A513-R517 PolarHBondContact O-N 3.17Å
514	M	94.8	Very high	94.3	Very high	66 Å²	66	87.6 Å²	87.6	33%	0.325	47%	0.472	S	S	.	.	H	α-helix	trans	-65.6	-48.8	176.4	-67	170.5	63.2	0	0	111.1	L469 P509 K510 V511 K516 R517 L518	L469-M514 HydrophobicContact CD1-CE 4.07Å; L469-M514 HydrophobicContact CD2-CB 4.1Å; L469-M514 HydrophobicContact CD2-CE 4.28Å; L469-M514 HydrophobicContact CD2-CG 4Å; P509-M514 HydrophobicContact CB-SD 3.74Å; K510-M514 WeakPolarHBondContact O-CG 3.4Å; K510-M514 PolarHBondContact O-N 2.69Å; V511-M514 WeakPolarHBondContact O-CB 3.37Å; V511-M514 PolarHBondContact O-N 3.06Å; V511-M514 VanDerWaalsContact O-N 3.13Å; M514-K516 VanDerWaalsContact C-N 3.35Å; M514-K516 PolarHBondContact O-N 2.84Å; M514-R517 PolarHBondContact O-N 3.11Å; M514-R517 VanDerWaalsContact O-N 3.13Å; M514-L518 WeakPolarHBondContact O-CB 3.41Å; M514-L518 VanDerWaalsContact O-CG 3.28Å; M514-L518 WeakPolarHBondContact O-CG 3.48Å; M514-L518 PolarHBondContact O-N 3.43Å
515	N	95.1	Very high	94.4	Very high	85 Å²	85	83.4 Å²	83.4	46%	0.455	44%	0.444	S	S	.	.	H	α-helix	trans	-58.2	-47.5	178.4	-69.5	-15.8	0	0	0	111	V511 R517 L518 G519	V511-N515 WeakPolarHBondContact CG1-ND2 3.28Å; V511-N515 WeakPolarHBondContact O-CB 3.43Å; V511-N515 VanDerWaalsContact O-CG 3.26Å; V511-N515 PolarHBondContact O-N 2.81Å; V511-N515 PolarHBondContact O-ND2 2.98Å; N515-R517 VanDerWaalsContact C-N 3.32Å; N515-R517 PolarHBondContact O-N 3.42Å; N515-L518 PolarHBondContact O-N 3.09Å; N515-G519 PolarHBondContact O-N 3.29Å
516	K	95.8	Very high	94.3	Very high	191 Å²	191	85.2 Å²	85.2	83%	0.83	45%	0.449	S	S	*	.	H	α-helix	trans	-61.1	-38.6	176.6	-173.5	178.9	-179.6	179.3	0	112.6	E512 M514	E512-K516 VanDerWaalsContact O-CB 3.32Å; E512-K516 WeakPolarHBondContact O-CB 3.48Å; E512-K516 PolarHBondContact O-N 3.07Å; M514-K516 VanDerWaalsContact C-N 3.35Å; M514-K516 PolarHBondContact O-N 2.84Å
517	R	94.3	Very high	94.3	Very high	145 Å²	145	89.2 Å²	89.2	55%	0.547	47%	0.465	S	S	.	.	H	α-helix	trans	-74.3	-29.1	-178.6	-165.4	169.6	-170.2	-159.7	-5.6	112.8	K468 A513 M514 N515	K468-R517 WeakPolarHBondContact O-CD 3.37Å; K468-R517 PolarHBondContact O-NE 3.41Å; K468-R517 PolarHBondContact O-NH1 2.93Å; K468-R517 VanDerWaalsContact O-NH1 3.1Å; K468-R517 PolarHBondContact O-NH2 3.27Å; A513-R517 VanDerWaalsContact O-CB 3.27Å; A513-R517 WeakPolarHBondContact O-CB 3.41Å; A513-R517 PolarHBondContact O-N 3.17Å; M514-R517 PolarHBondContact O-N 3.11Å; M514-R517 VanDerWaalsContact O-N 3.13Å; N515-R517 VanDerWaalsContact C-N 3.32Å; N515-R517 PolarHBondContact O-N 3.42Å
518	L	93.5	Very high	94.2	Very high	16 Å²	16	88.8 Å²	88.8	8%	0.084	46%	0.46	C	S	.	.	H	α-helix	trans	-85.5	-33.2	-179.5	-69.9	172.4	0	0	0	113.4	I465 K468 L469 M514 N515 S520 L521 V522	I465-L518 HydrophobicContact CB-CD2 4.24Å; I465-L518 HydrophobicContact CG1-CD2 4.28Å; I465-L518 HydrophobicContact CG2-CD2 3.82Å; K468-L518 HydrophobicContact CB-CD2 3.97Å; L469-L518 HydrophobicContact CD1-CD1 4.16Å; L469-L518 HydrophobicContact CD1-CD2 4.35Å; L469-L518 HydrophobicContact CD2-CD1 4.22Å; L469-L518 HydrophobicContact CD2-CD2 4.21Å; L469-L518 HydrophobicContact CD2-CG 4.09Å; L469-L518 HydrophobicContact CG-CD1 4.4Å; L469-L518 HydrophobicContact CG-CD2 3.97Å; L469-L518 HydrophobicContact CG-CG 4.35Å; M514-L518 WeakPolarHBondContact O-CB 3.41Å; M514-L518 VanDerWaalsContact O-CG 3.28Å; M514-L518 WeakPolarHBondContact O-CG 3.48Å; M514-L518 PolarHBondContact O-N 3.43Å; N515-L518 PolarHBondContact O-N 3.09Å; L518-S520 PolarHBondContact O-N 3.1Å; L518-L521 WeakPolarHBondContact O-CB 3.46Å; L518-L521 WeakPolarHBondContact O-CG 3.1Å; L518-L521 PolarHBondContact O-N 2.87Å; L518-V522 HydrophobicContact CB-CG2 3.86Å; L518-V522 HydrophobicContact CD1-CG2 3.75Å; L518-V522 HydrophobicContact CG-CG2 4.39Å
519	G	94.1	Very high	94.1	Very high	48 Å²	48	85.9 Å²	85.9	50%	0.495	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	55	-128.8	178.4	0	0	0	0	0	112.3	N515 L521	N515-G519 PolarHBondContact O-N 3.29Å; G519-L521 VanDerWaalsContact C-N 3.3Å; G519-L521 PolarHBondContact O-N 3.02Å
520	S	94	Very high	94	Very high	69 Å²	69	86.7 Å²	86.7	48%	0.483	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-14.7	-178.1	60.3	0	0	0	0	114.8	L518 V522 D523 E524	L518-S520 PolarHBondContact O-N 3.1Å; S520-V522 PolarHBondContact O-N 3.35Å; S520-V522 VanDerWaalsContact O-N 3.12Å; S520-D523 PolarHBondContact O-N 2.86Å; S520-E524 VanDerWaalsContact CB-OE1 3.32Å; S520-E524 WeakPolarHBondContact CB-OE1 3.37Å; S520-E524 WeakPolarHBondContact O-CG 3.5Å; S520-E524 PolarHBondContact O-N 3.16Å; S520-E524 PolarHBondContact OG-OE1 3.4Å
521	L	93.9	Very high	93.8	Very high	28 Å²	28	81.9 Å²	81.9	15%	0.147	43%	0.425	C	S	.	.	H	α-helix	trans	-59.3	-30.9	-174.8	-68.4	174	0	0	0	112.8	A464 I465 K468 L518 G519 F525	A464-L521 HydrophobicContact CB-CD1 4.46Å; A464-L521 HydrophobicContact CB-CD2 4.41Å; I465-L521 HydrophobicContact CG1-CB 3.99Å; K468-L521 HydrophobicContact CG-CD1 3.88Å; L518-L521 WeakPolarHBondContact O-CB 3.46Å; L518-L521 WeakPolarHBondContact O-CG 3.1Å; L518-L521 PolarHBondContact O-N 2.87Å; G519-L521 VanDerWaalsContact C-N 3.3Å; G519-L521 PolarHBondContact O-N 3.02Å; L521-F525 VanDerWaalsContact O-CB 3.31Å; L521-F525 WeakPolarHBondContact O-CB 3.48Å; L521-F525 PolarHBondContact O-N 3.42Å
522	V	94	Very high	93.2	Very high	44 Å²	44	85 Å²	85	27%	0.267	45%	0.447	S	S	.	.	H	α-helix	trans	-65.9	-46	176.8	174.9	0	0	0	0	110.6	L518 S520 F525 K526	L518-V522 HydrophobicContact CB-CG2 3.86Å; L518-V522 HydrophobicContact CD1-CG2 3.75Å; L518-V522 HydrophobicContact CG-CG2 4.39Å; S520-V522 PolarHBondContact O-N 3.35Å; S520-V522 VanDerWaalsContact O-N 3.12Å; V522-F525 PolarHBondContact O-N 2.85Å; V522-K526 HydrophobicContact CG1-CD 4.32Å; V522-K526 VanDerWaalsContact O-CG 3.28Å; V522-K526 WeakPolarHBondContact O-CG 3.37Å; V522-K526 PolarHBondContact O-N 3.45Å
523	D	93.4	Very high	92.7	Very high	91 Å²	91	84.6 Å²	84.6	49%	0.487	45%	0.45	S	S	.	.	H	α-helix	trans	-74.2	-39.4	-176.7	-61.8	-33.5	0	0	0	111.1	S520 F525 K526 E527	S520-D523 PolarHBondContact O-N 2.86Å; D523-F525 VanDerWaalsContact C-N 3.29Å; D523-F525 PolarHBondContact O-N 2.75Å; D523-K526 WeakPolarHBondContact O-CB 3.45Å; D523-K526 PolarHBondContact O-N 3.03Å; D523-K526 VanDerWaalsContact O-N 3.13Å; D523-K526 IonicContact OD1-NZ 3.16Å; D523-K526 PolarHBondContact OD1-NZ 2.77Å; D523-E527 PolarHBondContact O-N 2.72Å
524	E	93.1	Very high	92.2	Very high	59 Å²	59	87.6 Å²	87.6	28%	0.276	45%	0.449	S	S	.	.	H	α-helix	trans	-58.5	-40.1	171.4	-67.8	169.9	-144.2	0	0	112.1	K461 S520 L528	K461-E524 IonicContact NZ-OE2 3.57Å; K461-E524 PolarHBondContact NZ-OE2 3.45Å; S520-E524 VanDerWaalsContact CB-OE1 3.32Å; S520-E524 WeakPolarHBondContact CB-OE1 3.37Å; S520-E524 WeakPolarHBondContact O-CG 3.5Å; S520-E524 PolarHBondContact O-N 3.16Å; S520-E524 PolarHBondContact OG-OE1 3.4Å; E524-L528 WeakPolarHBondContact O-CG 3.5Å; E524-L528 PolarHBondContact O-N 2.6Å
525	F	94.6	Very high	91.5	Very high	38 Å²	38	89.4 Å²	89.4	17%	0.167	46%	0.46	C	S	.	.	H	α-helix	trans	-70.7	-36.9	176.3	-176.9	-101	0	0	0	112	Q458 K461 M462 I465 L521 V522 D523 L528 V529	Q458-F525 WeakPolarHBondContact O-CE2 3.34Å; K461-F525 HydrophobicContact CB-CD2 3.97Å; M462-F525 HydrophobicContact CB-CE2 3.98Å; M462-F525 HydrophobicContact CE-CD1 4.02Å; M462-F525 HydrophobicContact CE-CD2 4.24Å; M462-F525 HydrophobicContact CE-CE1 3.43Å; M462-F525 VanDerWaalsContact CE-CE1 3.43Å; M462-F525 HydrophobicContact CE-CE2 3.68Å; M462-F525 HydrophobicContact CE-CG 4.4Å; M462-F525 HydrophobicContact CE-CZ 3.23Å; I465-F525 HydrophobicContact CD1-CB 3.86Å; I465-F525 HydrophobicContact CD1-CG 4.09Å; L521-F525 VanDerWaalsContact O-CB 3.31Å; L521-F525 WeakPolarHBondContact O-CB 3.48Å; L521-F525 PolarHBondContact O-N 3.42Å; V522-F525 PolarHBondContact O-N 2.85Å; D523-F525 VanDerWaalsContact C-N 3.29Å; D523-F525 PolarHBondContact O-N 2.75Å; F525-L528 PolarHBondContact O-N 2.77Å; F525-V529 HydrophobicContact CD1-CG2 4.47Å; F525-V529 HydrophobicContact CD2-CG2 4.32Å; F525-V529 HydrophobicContact CE1-CG2 4Å; F525-V529 HydrophobicContact CE2-CG2 3.83Å; F525-V529 HydrophobicContact CZ-CG2 3.65Å; F525-V529 WeakPolarHBondContact O-CG2 3.4Å; F525-V529 PolarHBondContact O-N 3.43Å
526	K	92.8	Very high	90.6	Very high	95 Å²	95	89.6 Å²	89.6	41%	0.413	47%	0.466	S	S	.	.	H	α-helix	trans	-62.5	-45.2	175.3	-73.2	170.3	-175.3	163	0	111.3	V522 D523 L528 V529 Y530	V522-K526 HydrophobicContact CG1-CD 4.32Å; V522-K526 VanDerWaalsContact O-CG 3.28Å; V522-K526 WeakPolarHBondContact O-CG 3.37Å; V522-K526 PolarHBondContact O-N 3.45Å; D523-K526 WeakPolarHBondContact O-CB 3.45Å; D523-K526 PolarHBondContact O-N 3.03Å; D523-K526 VanDerWaalsContact O-N 3.13Å; D523-K526 IonicContact OD1-NZ 3.16Å; D523-K526 PolarHBondContact OD1-NZ 2.77Å; K526-L528 PolarHBondContact O-N 2.99Å; K526-V529 PolarHBondContact O-N 2.99Å; K526-Y530 HydrophobicContact CB-CD2 4.13Å; K526-Y530 HydrophobicContact CG-CD2 3.95Å; K526-Y530 HydrophobicContact CG-CE2 4.3Å; K526-Y530 PolarHBondContact O-N 3.36Å
527	E	92.7	Very high	89.7	Confident	168 Å²	168	89.1 Å²	89.1	79%	0.785	47%	0.467	S	S	*	.	H	α-helix	trans	-59.8	-32.9	178.9	-73.4	-173.2	161.4	0	0	113	D523	D523-E527 PolarHBondContact O-N 2.72Å
528	L	92.1	Very high	88	Confident	66 Å²	66	83.8 Å²	83.8	35%	0.346	46%	0.457	S	S	.	.	H	α-helix	trans	-80.1	-20.1	179.7	-68.4	173.9	0	0	0	114.3	Q458 K461 E524 F525 K526	Q458-L528 HydrophobicContact CG-CB 4.12Å; Q458-L528 PolarHBondContact NE2-O 3.19Å; K461-L528 HydrophobicContact CB-CD1 4.37Å; K461-L528 HydrophobicContact CG-CD1 3.61Å; E524-L528 WeakPolarHBondContact O-CG 3.5Å; E524-L528 PolarHBondContact O-N 2.6Å; F525-L528 PolarHBondContact O-N 2.77Å; K526-L528 PolarHBondContact O-N 2.99Å
529	V	93.1	Very high	85.7	Confident	55 Å²	55	92.5 Å²	92.5	33%	0.333	49%	0.494	S	S	.	.	H	α-helix	trans	-117.9	-46.1	-169.9	177.5	0	0	0	0	112.4	Q458 F525 K526 P531	Q458-V529 HydrophobicContact CB-CG2 4.43Å; Q458-V529 HydrophobicContact CG-CG2 3.9Å; F525-V529 HydrophobicContact CD1-CG2 4.47Å; F525-V529 HydrophobicContact CD2-CG2 4.32Å; F525-V529 HydrophobicContact CE1-CG2 4Å; F525-V529 HydrophobicContact CE2-CG2 3.83Å; F525-V529 HydrophobicContact CZ-CG2 3.65Å; F525-V529 WeakPolarHBondContact O-CG2 3.4Å; F525-V529 PolarHBondContact O-N 3.43Å; K526-V529 PolarHBondContact O-N 2.99Å; V529-P531 WeakPolarHBondContact O-CD 3.25Å
530	Y	92.1	Very high	83.4	Confident	104 Å²	104	96.7 Å²	96.7	41%	0.408	51%	0.51	S	S	.	.	S	Bend	trans	-95.1	123.2	-175.3	-63.1	-51.6	0	0	0	110.4	K526 Y534	K526-Y530 HydrophobicContact CB-CD2 4.13Å; K526-Y530 HydrophobicContact CG-CD2 3.95Å; K526-Y530 HydrophobicContact CG-CE2 4.3Å; K526-Y530 PolarHBondContact O-N 3.36Å; Y530-Y534 AromaticContact CD1-CD1 3.32Å; Y530-Y534 HydrophobicContact CD1-CD1 3.32Å; Y530-Y534 AromaticContact CD1-CE1 3.36Å; Y530-Y534 HydrophobicContact CD1-CE1 3.36Å; Y530-Y534 HydrophobicContact CD1-CG 4.11Å; Y530-Y534 AromaticContact CE1-CD1 3.93Å; Y530-Y534 HydrophobicContact CE1-CD1 3.93Å; Y530-Y534 AromaticContact CE1-CE1 3.46Å; Y530-Y534 HydrophobicContact CE1-CE1 3.46Å; Y530-Y534 VanDerWaalsContact CE1-CE1 3.46Å; Y530-Y534 AromaticContact CG-CD1 3.82Å; Y530-Y534 HydrophobicContact CG-CD1 3.82Å; Y530-Y534 HydrophobicContact CG-CE1 4.22Å
531	P	90.8	Very high	80.8	Confident	69 Å²	69	99.4 Å²	99.4	45%	0.448	52%	0.524	S	S	.	.			trans	-54.8	149.9	166.3	-26.4	35.2	0	0	0	111.6	V529 D533 Y534	V529-P531 WeakPolarHBondContact O-CD 3.25Å; P531-D533 WeakPolarHBondContact CB-OD1 3.39Å; P531-D533 PolarHBondContact O-N 2.93Å; P531-D533 VanDerWaalsContact O-N 3.16Å; P531-Y534 WeakPolarHBondContact O-CB 3.32Å; P531-Y534 PolarHBondContact O-N 2.9Å
532	P	83.8	Confident	78.1	Confident	141 Å²	141	107.3 Å²	107.3	92%	0.916	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	-20.6	-177.6	26.4	-34.9	0	0	0	113.6
533	D	84.3	Confident	75.3	Confident	139 Å²	139	116.5 Å²	116.5	74%	0.743	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	3.5	175.3	63.3	-40.1	0	0	0	113.4	P531 N535	P531-D533 WeakPolarHBondContact CB-OD1 3.39Å; P531-D533 PolarHBondContact O-N 2.93Å; P531-D533 VanDerWaalsContact O-N 3.16Å; D533-N535 PolarHBondContact O-N 2.94Å
534	Y	84.3	Confident	72.3	Confident	122 Å²	122	121 Å²	121	48%	0.478	60%	0.602	S	S	.	*			trans	-73.3	124.2	178.8	-172.5	-107.8	0	0	0	110.7	Y530 P531 P536	Y530-Y534 AromaticContact CD1-CD1 3.32Å; Y530-Y534 HydrophobicContact CD1-CD1 3.32Å; Y530-Y534 AromaticContact CD1-CE1 3.36Å; Y530-Y534 HydrophobicContact CD1-CE1 3.36Å; Y530-Y534 HydrophobicContact CD1-CG 4.11Å; Y530-Y534 AromaticContact CE1-CD1 3.93Å; Y530-Y534 HydrophobicContact CE1-CD1 3.93Å; Y530-Y534 AromaticContact CE1-CE1 3.46Å; Y530-Y534 HydrophobicContact CE1-CE1 3.46Å; Y530-Y534 VanDerWaalsContact CE1-CE1 3.46Å; Y530-Y534 AromaticContact CG-CD1 3.82Å; Y530-Y534 HydrophobicContact CG-CD1 3.82Å; Y530-Y534 HydrophobicContact CG-CE1 4.22Å; P531-Y534 WeakPolarHBondContact O-CB 3.32Å; P531-Y534 PolarHBondContact O-N 2.9Å; Y534-P536 HydrophobicContact CD1-CB 4.21Å; Y534-P536 HydrophobicContact CE1-CB 3.95Å; Y534-P536 WeakPolarHBondContact O-CD 3.35Å
535	N	80.6	Confident	69.4	Low	105 Å²	105	126.8 Å²	126.8	56%	0.561	63%	0.629	S	S	*	*			trans	-97.1	98.3	172.2	-172.5	1.2	0	0	0	110.2	D533 E537 G538	D533-N535 PolarHBondContact O-N 2.94Å; N535-E537 PolarHBondContact O-N 3.05Å; N535-E537 PolarHBondContact OD1-N 3.21Å; N535-G538 PolarHBondContact O-N 3.36Å; N535-G538 VanDerWaalsContact O-N 3.15Å; N535-G538 PolarHBondContact OD1-N 3.14Å
536	P	75.4	Confident	66.2	Low	89 Å²	89	131.2 Å²	131.2	58%	0.578	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-21.1	-176.8	25.3	-34.2	0	0	0	114	Y534	Y534-P536 HydrophobicContact CD1-CB 4.21Å; Y534-P536 HydrophobicContact CE1-CB 3.95Å; Y534-P536 WeakPolarHBondContact O-CD 3.35Å
537	E	77.8	Confident	63.2	Low	181 Å²	181	134.4 Å²	134.4	85%	0.846	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	-4.3	178.2	-60.8	-173.6	172	0	0	112.9	N535 K539	N535-E537 PolarHBondContact O-N 3.05Å; N535-E537 PolarHBondContact OD1-N 3.21Å; E537-K539 PolarHBondContact O-N 3.36Å
538	G	57	Low	60.3	Low	33 Å²	33	133.8 Å²	133.8	34%	0.34	68%	0.678	S	S	.	*	S	Bend	trans	-70.1	111	177.3	0	0	0	0	0	110.4	N535 V540	N535-G538 PolarHBondContact O-N 3.36Å; N535-G538 VanDerWaalsContact O-N 3.15Å; N535-G538 PolarHBondContact OD1-N 3.14Å; G538-V540 PolarHBondContact O-N 3.05Å
539	K	46.8	Very low	57.3	Low	198 Å²	198	133.9 Å²	133.9	86%	0.861	69%	0.694	S	S	*	*			trans	-53	117.7	167.2	-81.1	179.4	178	172.7	0	108.5	E537 T541	E537-K539 PolarHBondContact O-N 3.36Å; K539-T541 VanDerWaalsContact C-N 3.33Å; K539-T541 PolarHBondContact O-N 3.19Å
540	V	45.5	Very low	54.3	Low	136 Å²	136	137.4 Å²	137.4	82%	0.824	72%	0.722	S	S	*	*			trans	-55.8	101.8	166	-178.7	0	0	0	0	106.7	G538 K542	G538-V540 PolarHBondContact O-N 3.05Å; V540-K542 VanDerWaalsContact C-N 3.35Å; V540-K542 PolarHBondContact O-N 3.19Å
541	T	39.1	Very low	51.3	Low	126 Å²	126	135.5 Å²	135.5	77%	0.773	73%	0.734	S	S	*	*			trans	-60.3	105	166.8	26.7	0	0	0	0	105.3	K539 R543	K539-T541 VanDerWaalsContact C-N 3.33Å; K539-T541 PolarHBondContact O-N 3.19Å; T541-R543 VanDerWaalsContact C-N 3.35Å; T541-R543 PolarHBondContact O-N 3.16Å
542	K	37.9	Very low	48.9	Very low	194 Å²	194	138.2 Å²	138.2	84%	0.843	75%	0.754	S	S	*	*			trans	-45.8	108.7	162.3	-83.6	-178.7	174.2	178.1	0	105.6	V540 K544	V540-K542 VanDerWaalsContact C-N 3.35Å; V540-K542 PolarHBondContact O-N 3.19Å; K542-K544 PolarHBondContact O-N 2.9Å
543	R	33.9	Very low	46.7	Very low	238 Å²	238	140.8 Å²	140.8	90%	0.898	75%	0.751	S	S	*	*			trans	-50.7	116.3	166.9	-82.3	-179.1	176.9	168.4	-0.6	105	T541 H545	T541-R543 VanDerWaalsContact C-N 3.35Å; T541-R543 PolarHBondContact O-N 3.16Å; R543-H545 PolarHBondContact O-N 3.48Å
544	K	31.1	Very low	44.3	Very low	184 Å²	184	145.7 Å²	145.7	80%	0.8	76%	0.759	S	S	*	*			trans	-51.1	117.4	163.4	-90.7	178.5	171.4	178.3	0	104.6	K542 D546	K542-K544 PolarHBondContact O-N 2.9Å; K544-D546 PolarHBondContact O-N 2.84Å
545	H	31.7	Very low	41.9	Very low	181 Å²	181	145.4 Å²	145.4	84%	0.838	77%	0.772	S	S	*	*			trans	-63.5	101.9	160.2	-162.8	-56.8	0	0	0	103.9	R543 N547	R543-H545 PolarHBondContact O-N 3.48Å; H545-N547 PolarHBondContact O-N 2.85Å
546	D	28.2	Very low	40	Very low	131 Å²	131	148.9 Å²	148.9	70%	0.701	78%	0.782	S	S	*	*			trans	-55.8	117	172.4	-83.8	-33.3	0	0	0	106.6	K544 D548	K544-D546 PolarHBondContact O-N 2.84Å; D546-D548 PolarHBondContact O-N 3.35Å; D546-D548 VanDerWaalsContact O-N 3.11Å
547	N	30.1	Very low	38.7	Very low	162 Å²	162	148.5 Å²	148.5	87%	0.866	78%	0.778	S	S	*	*			trans	-82.7	77.9	174.9	-171.7	33.1	0	0	0	105.9	H545	H545-N547 PolarHBondContact O-N 2.85Å
548	D	30.5	Very low	37.6	Very low	156 Å²	156	146.3 Å²	146.3	83%	0.834	77%	0.768	S	S	*	*			trans	-102.8	113.5	175.9	-144.5	9.6	0	0	0	109.6	D546	D546-D548 PolarHBondContact O-N 3.35Å; D546-D548 VanDerWaalsContact O-N 3.11Å
549	G	29	Very low	38.2	Very low	67 Å²	67	145.7 Å²	145.7	69%	0.691	76%	0.756	S	S	*	*			trans	61.9	91.2	157.6	0	0	0	0	0	119.1	G551	G549-G551 VanDerWaalsContact C-N 3.25Å; G549-G551 PolarHBondContact O-N 3.2Å
550	S	30.1	Very low	39.5	Very low	130 Å²	130	139.7 Å²	139.7	91%	0.909	74%	0.739	S	S	*	*			trans	-71.8	78	159.4	68.8	0	0	0	0	111.3
551	G	30.5	Very low	41.1	Very low	64 Å²	64	138.7 Å²	138.7	66%	0.66	73%	0.725	S	S	*	*			trans	-88.8	115.8	158.7	0	0	0	0	0	109.3	G549 K553	G549-G551 VanDerWaalsContact C-N 3.25Å; G549-G551 PolarHBondContact O-N 3.2Å; G551-K553 PolarHBondContact O-N 2.82Å
552	S	39.7	Very low	42.9	Very low	126 Å²	126	140.3 Å²	140.3	88%	0.881	72%	0.724	S	S	*	*			trans	-58.7	98.1	179.1	58.3	0	0	0	0	112.4
553	K	37.3	Very low	44.9	Very low	195 Å²	195	135 Å²	135	85%	0.848	70%	0.702	S	S	*	*			trans	-112.5	126	155.7	-78.5	-177.3	179	174.4	0	107.6	G551	G551-K553 PolarHBondContact O-N 2.82Å
554	R	34.6	Very low	47.1	Very low	242 Å²	242	123.7 Å²	123.7	91%	0.913	66%	0.659	S	S	*	*			trans	-48.9	132.3	172.3	-72.5	178.7	176	175.7	-1.5	108.6	K556	R554-K556 PolarHBondContact O-N 3.37Å
555	P	33.9	Very low	49.4	Very low	116 Å²	116	121.2 Å²	121.2	75%	0.753	65%	0.649	S	S	*	*			trans	-62.3	125.7	178.6	21.2	-24.4	0	0	0	108.3	V557	P555-V557 PolarHBondContact O-N 3.46Å
556	K	39.7	Very low	51.9	Low	177 Å²	177	115.6 Å²	115.6	77%	0.77	63%	0.627	S	S	*	*			trans	-64.4	111.9	170.2	-139.1	-175.9	179.6	-164.1	0	105.6	R554 E558	R554-K556 PolarHBondContact O-N 3.37Å; K556-E558 PolarHBondContact O-N 3.22Å; K556-E558 VanDerWaalsContact O-N 3.07Å
557	V	48.1	Very low	54.4	Low	81 Å²	81	111.5 Å²	111.5	49%	0.491	60%	0.604	S	S	.	*			trans	-78.4	92.5	178	-176.1	0	0	0	0	106.8	P555 Y559	P555-V557 PolarHBondContact O-N 3.46Å; V557-Y559 HydrophobicContact CB-CE2 4.5Å; V557-Y559 HydrophobicContact CG1-CD1 4.3Å; V557-Y559 HydrophobicContact CG1-CE1 3.79Å; V557-Y559 HydrophobicContact CG1-CE2 4Å
558	E	55.9	Low	56.9	Low	136 Å²	136	104.9 Å²	104.9	64%	0.636	57%	0.568	S	S	*	*			trans	-83.9	108.8	170.2	-79.8	177.8	179.1	0	0	108.4	K556 S560	K556-E558 PolarHBondContact O-N 3.22Å; K556-E558 VanDerWaalsContact O-N 3.07Å; E558-S560 PolarHBondContact O-N 3.19Å
559	Y	68.2	Low	59.3	Low	20 Å²	20	102.6 Å²	102.6	8%	0.078	56%	0.564	C	S	.	*			trans	-73.7	115.2	174.6	-59.3	-82.1	0	0	0	108.7	V557 F576 M580 E583 A584 Y588	V557-Y559 HydrophobicContact CB-CE2 4.5Å; V557-Y559 HydrophobicContact CG1-CD1 4.3Å; V557-Y559 HydrophobicContact CG1-CE1 3.79Å; V557-Y559 HydrophobicContact CG1-CE2 4Å; Y559-F576 HydrophobicContact CD1-CE2 4.18Å; Y559-F576 AromaticContact CE1-CE2 3.93Å; Y559-F576 HydrophobicContact CE1-CE2 3.93Å; Y559-M580 HydrophobicContact CE1-CE 4.04Å; Y559-M580 WeakPolarHBondContact OH-CE 3.39Å; Y559-M580 WeakPolarHBondContact OH-CG 3.38Å; Y559-E583 HydrophobicContact CE2-CB 4.11Å; Y559-A584 HydrophobicContact CD2-CB 4.18Å; Y559-Y588 PolarHBondContact O-OH 3Å; Y559-Y588 VanDerWaalsContact O-OH 3.11Å
560	S	75.4	Confident	61.9	Low	72 Å²	72	106.6 Å²	106.6	50%	0.503	56%	0.562	S	S	.	*			trans	-76.4	156.6	177.9	-60.4	0	0	0	0	111.5	E558 E562 E563 L564 Y588	E558-S560 PolarHBondContact O-N 3.19Å; S560-E562 VanDerWaalsContact C-N 3.25Å; S560-E562 PolarHBondContact O-N 2.81Å; S560-E563 WeakPolarHBondContact O-CB 3.35Å; S560-E563 PolarHBondContact O-N 3.26Å; S560-E563 VanDerWaalsContact O-N 3.07Å; S560-L564 PolarHBondContact O-N 3.39Å; S560-L564 VanDerWaalsContact O-N 3.15Å; S560-Y588 VanDerWaalsContact C-OH 3.31Å
561	E	77.6	Confident	64.3	Low	115 Å²	115	103.3 Å²	103.3	54%	0.537	55%	0.549	S	S	.	.	H	α-helix	trans	-59	-39.7	-176.2	-67.4	-171.2	167.8	0	0	111.7	E563 L564 K565 Y588 F607	E561-E563 VanDerWaalsContact C-N 3.32Å; E561-E563 PolarHBondContact O-N 2.85Å; E561-L564 PolarHBondContact O-N 3.27Å; E561-K565 VanDerWaalsContact O-CB 3.23Å; E561-K565 WeakPolarHBondContact O-CB 3.33Å; E561-K565 PolarHBondContact O-N 2.92Å; E561-Y588 WeakPolarHBondContact CA-OH 3.44Å; E561-Y588 HydrophobicContact CG-CE1 3.43Å; E561-Y588 VanDerWaalsContact CG-CE1 3.43Å; E561-Y588 WeakPolarHBondContact CG-OH 3.23Å; E561-Y588 PolarHBondContact N-OH 3.39Å; E561-Y588 WeakPolarHBondContact OE1-CE1 3.23Å; E561-F607 HydrophobicContact CB-CE1 3.99Å; E561-F607 HydrophobicContact CG-CE1 3.85Å; E561-F607 HydrophobicContact CG-CZ 4.37Å
562	E	77	Confident	66.9	Low	159 Å²	159	102.2 Å²	102.2	74%	0.743	53%	0.53	S	S	*	.	H	α-helix	trans	-63.7	-37.3	178.7	-59.8	-175.1	165	0	0	112.4	S560 T566	S560-E562 VanDerWaalsContact C-N 3.25Å; S560-E562 PolarHBondContact O-N 2.81Å; E562-T566 VanDerWaalsContact O-CB 3.29Å; E562-T566 WeakPolarHBondContact O-CB 3.49Å; E562-T566 PolarHBondContact O-N 3.35Å; E562-T566 PolarHBondContact O-OG1 3.16Å
563	E	80.1	Confident	68.8	Low	82 Å²	82	96.5 Å²	96.5	38%	0.383	49%	0.489	S	S	.	.	H	α-helix	trans	-69.1	-47.6	179.4	-167.4	-177.8	177.4	0	0	110.2	S560 E561 T566 H567	S560-E563 WeakPolarHBondContact O-CB 3.35Å; S560-E563 PolarHBondContact O-N 3.26Å; S560-E563 VanDerWaalsContact O-N 3.07Å; E561-E563 VanDerWaalsContact C-N 3.32Å; E561-E563 PolarHBondContact O-N 2.85Å; E563-T566 WeakPolarHBondContact O-CB 3.42Å; E563-T566 PolarHBondContact O-N 3.36Å; E563-H567 PolarHBondContact O-CD2 2.79Å; E563-H567 PolarHBondContact O-N 2.83Å
564	L	80.1	Confident	70.9	Confident	1 Å²	1	89 Å²	89	1%	0.005	47%	0.467	C	S	.	.	H	α-helix	trans	-64.2	-42.3	177.4	-70.2	169.7	0	0	0	111.9	S560 E561 T566 H567 I568 L573 F576 A584 Y588 L603 F607	S560-L564 PolarHBondContact O-N 3.39Å; S560-L564 VanDerWaalsContact O-N 3.15Å; E561-L564 PolarHBondContact O-N 3.27Å; L564-T566 VanDerWaalsContact C-N 3.31Å; L564-T566 PolarHBondContact O-N 2.85Å; L564-H567 PolarHBondContact O-N 3.18Å; L564-I568 VanDerWaalsContact O-CG1 3.25Å; L564-I568 WeakPolarHBondContact O-CG1 3.3Å; L564-I568 PolarHBondContact O-N 3.02Å; L564-L573 HydrophobicContact CD2-CD1 4.13Å; L564-F576 HydrophobicContact CD2-CE2 4.44Å; L564-A584 HydrophobicContact CD1-CB 4.12Å; L564-A584 HydrophobicContact CD2-CB 3.96Å; L564-Y588 HydrophobicContact CD1-CD2 3.96Å; L564-Y588 HydrophobicContact CD1-CE2 3.34Å; L564-L603 HydrophobicContact CD1-CD2 4.47Å; L564-F607 HydrophobicContact CB-CD2 4.45Å; L564-F607 HydrophobicContact CB-CE2 4.19Å; L564-F607 HydrophobicContact CB-CZ 4.47Å; L564-F607 HydrophobicContact CD1-CE2 3.84Å; L564-F607 HydrophobicContact CD1-CZ 3.99Å
565	K	80.6	Confident	73.2	Confident	133 Å²	133	85.7 Å²	85.7	58%	0.578	46%	0.459	S	S	*	.	H	α-helix	trans	-63.5	-37.4	175.7	-162.4	171.9	-170.4	170.8	0	111.9	E561 I568 S569	E561-K565 VanDerWaalsContact O-CB 3.23Å; E561-K565 WeakPolarHBondContact O-CB 3.33Å; E561-K565 PolarHBondContact O-N 2.92Å; K565-I568 PolarHBondContact O-N 3.41Å; K565-S569 WeakPolarHBondContact O-CB 3.45Å; K565-S569 PolarHBondContact O-N 2.94Å
566	T	82.8	Confident	75.5	Confident	62 Å²	62	80.9 Å²	80.9	38%	0.38	43%	0.427	S	S	.	.	H	α-helix	trans	-66.2	-40.3	173.8	-58.8	0	0	0	0	111.6	E562 E563 L564 S569 K570	E562-T566 VanDerWaalsContact O-CB 3.29Å; E562-T566 WeakPolarHBondContact O-CB 3.49Å; E562-T566 PolarHBondContact O-N 3.35Å; E562-T566 PolarHBondContact O-OG1 3.16Å; E563-T566 WeakPolarHBondContact O-CB 3.42Å; E563-T566 PolarHBondContact O-N 3.36Å; L564-T566 VanDerWaalsContact C-N 3.31Å; L564-T566 PolarHBondContact O-N 2.85Å; T566-S569 PolarHBondContact O-N 3.36Å; T566-K570 HydrophobicContact CG2-CD 3.97Å; T566-K570 HydrophobicContact CG2-CG 4.49Å; T566-K570 WeakPolarHBondContact O-CB 3.33Å; T566-K570 WeakPolarHBondContact O-CG 3.24Å; T566-K570 PolarHBondContact O-N 3.38Å
567	H	81.1	Confident	77.7	Confident	46 Å²	46	76 Å²	76	21%	0.213	41%	0.411	C	S	.	.	H	α-helix	trans	-69.1	-33.8	177.4	-79.7	-63.5	0	0	0	113.5	E563 L564 G571 T572 L573 F576	E563-H567 PolarHBondContact O-CD2 2.79Å; E563-H567 PolarHBondContact O-N 2.83Å; L564-H567 PolarHBondContact O-N 3.18Å; H567-G571 PolarHBondContact O-N 3.49Å; H567-T572 WeakPolarHBondContact CA-OG1 3.26Å; H567-T572 PolarHBondContact ND1-OG1 3.05Å; H567-T572 PolarHBondContact O-N 3.37Å; H567-T572 PolarHBondContact O-OG1 2.79Å; H567-L573 HydrophobicContact CB-CB 4.35Å; H567-L573 HydrophobicContact CB-CD1 4.18Å; H567-L573 PolarHBondContact O-N 2.89Å; H567-L573 VanDerWaalsContact O-N 3.1Å; H567-F576 HydrophobicContact CB-CE1 4.4Å; H567-F576 HydrophobicContact CB-CZ 4.46Å; H567-F576 AromaticContact CD2-CE1 3.9Å; H567-F576 AromaticContact CD2-CZ 3.49Å; H567-F576 VanDerWaalsContact CD2-CZ 3.49Å; H567-F576 WeakPolarHBondContact CD2-CZ 3.36Å; H567-F576 AromaticContact CE1-CE1 3.79Å; H567-F576 AromaticContact CG-CE1 3.75Å; H567-F576 AromaticContact CG-CZ 3.79Å; H567-F576 AromaticContact ND1-CE1 3.68Å; H567-F576 AromaticContact NE2-CE1 3.93Å; H567-F576 AromaticContact NE2-CZ 3.67Å
568	I	82.3	Confident	79.3	Confident	23 Å²	23	74.3 Å²	74.3	12%	0.118	40%	0.401	C	S	.	.	H	α-helix	trans	-66.4	-52	172.4	-69.7	164.5	0	0	0	110	L564 K565 K570 G571 L573 T604 F607	L564-I568 VanDerWaalsContact O-CG1 3.25Å; L564-I568 WeakPolarHBondContact O-CG1 3.3Å; L564-I568 PolarHBondContact O-N 3.02Å; K565-I568 PolarHBondContact O-N 3.41Å; I568-K570 VanDerWaalsContact C-N 3.31Å; I568-K570 PolarHBondContact O-N 2.92Å; I568-G571 PolarHBondContact O-N 3.03Å; I568-L573 HydrophobicContact CD1-CD2 4.37Å; I568-L573 HydrophobicContact CG1-CB 4.42Å; I568-L573 HydrophobicContact CG1-CD2 3.7Å; I568-L573 HydrophobicContact CG1-CG 4.43Å; I568-T604 HydrophobicContact CG2-CG2 4.24Å; I568-F607 HydrophobicContact CD1-CB 3.6Å; I568-F607 HydrophobicContact CD1-CD2 4.04Å; I568-F607 HydrophobicContact CD1-CG 4.16Å
569	S	81.1	Confident	80.6	Confident	107 Å²	107	71.9 Å²	71.9	75%	0.748	40%	0.397	S	S	*	.	H	α-helix	trans	-59.4	-38.6	179	176	0	0	0	0	113	K565 T566 G571	K565-S569 WeakPolarHBondContact O-CB 3.45Å; K565-S569 PolarHBondContact O-N 2.94Å; T566-S569 PolarHBondContact O-N 3.36Å; S569-G571 VanDerWaalsContact C-N 3.3Å; S569-G571 PolarHBondContact O-N 3.41Å
570	K	83.6	Confident	81.2	Confident	152 Å²	152	73.7 Å²	73.7	66%	0.661	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	0.8	178.1	-67.8	-179	-179.1	174.3	0	114	T566 I568 T572	T566-K570 HydrophobicContact CG2-CD 3.97Å; T566-K570 HydrophobicContact CG2-CG 4.49Å; T566-K570 WeakPolarHBondContact O-CB 3.33Å; T566-K570 WeakPolarHBondContact O-CG 3.24Å; T566-K570 PolarHBondContact O-N 3.38Å; I568-K570 VanDerWaalsContact C-N 3.31Å; I568-K570 PolarHBondContact O-N 2.92Å; K570-T572 HydrophobicContact CB-CG2 4.22Å; K570-T572 PolarHBondContact O-N 3.27Å; K570-T572 VanDerWaalsContact O-N 3.15Å
571	G	81.1	Confident	81.5	Confident	61 Å²	61	70.3 Å²	70.3	63%	0.629	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	20.4	-176.6	0	0	0	0	0	114.2	H567 I568 S569	H567-G571 PolarHBondContact O-N 3.49Å; I568-G571 PolarHBondContact O-N 3.03Å; S569-G571 VanDerWaalsContact C-N 3.3Å; S569-G571 PolarHBondContact O-N 3.41Å
572	T	83.9	Confident	81.7	Confident	41 Å²	41	67.7 Å²	67.7	25%	0.252	37%	0.37	S	S	.	.			trans	-96.2	-8.9	-176.6	51.2	0	0	0	0	112.9	H567 K570 G574 K575	H567-T572 WeakPolarHBondContact CA-OG1 3.26Å; H567-T572 PolarHBondContact ND1-OG1 3.05Å; H567-T572 PolarHBondContact O-N 3.37Å; H567-T572 PolarHBondContact O-OG1 2.79Å; K570-T572 HydrophobicContact CB-CG2 4.22Å; K570-T572 PolarHBondContact O-N 3.27Å; K570-T572 VanDerWaalsContact O-N 3.15Å; T572-G574 PolarHBondContact O-N 3.12Å; T572-K575 WeakPolarHBondContact O-CB 3.39Å; T572-K575 PolarHBondContact O-N 3.11Å
573	L	81.2	Confident	82	Confident	6 Å²	6	64.8 Å²	64.8	3%	0.031	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-56.2	-36.7	175.1	-166.1	74.1	0	0	0	111.9	L564 H567 I568 K575 F576 L581 L600 L603	L564-L573 HydrophobicContact CD2-CD1 4.13Å; H567-L573 HydrophobicContact CB-CB 4.35Å; H567-L573 HydrophobicContact CB-CD1 4.18Å; H567-L573 PolarHBondContact O-N 2.89Å; H567-L573 VanDerWaalsContact O-N 3.1Å; I568-L573 HydrophobicContact CD1-CD2 4.37Å; I568-L573 HydrophobicContact CG1-CB 4.42Å; I568-L573 HydrophobicContact CG1-CD2 3.7Å; I568-L573 HydrophobicContact CG1-CG 4.43Å; L573-K575 PolarHBondContact O-N 2.89Å; L573-K575 VanDerWaalsContact O-N 3.08Å; L573-F576 HydrophobicContact CD1-CD2 4.41Å; L573-F576 VanDerWaalsContact O-CB 3.32Å; L573-F576 WeakPolarHBondContact O-CB 3.32Å; L573-F576 PolarHBondContact O-N 3.16Å; L573-L581 HydrophobicContact CD1-CD2 4.24Å; L573-L581 HydrophobicContact CG-CD2 4.21Å; L573-L600 HydrophobicContact CB-CD2 4.23Å; L573-L600 HydrophobicContact CD2-CD2 3.9Å; L573-L600 HydrophobicContact CG-CD2 3.71Å; L573-L600 WeakPolarHBondContact O-CD2 3.43Å; L573-L603 HydrophobicContact CD2-CB 4.08Å
574	G	80.4	Confident	81.9	Confident	37 Å²	37	60.9 Å²	60.9	38%	0.381	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-60.5	-18.8	175.8	0	0	0	0	0	114.9	T572 F576 K596	T572-G574 PolarHBondContact O-N 3.12Å; G574-F576 VanDerWaalsContact C-N 3.34Å; G574-K596 WeakPolarHBondContact O-CE 3.46Å; G574-K596 PolarHBondContact O-NZ 3.28Å
575	K	82.9	Confident	82.1	Confident	173 Å²	173	60.9 Å²	60.9	75%	0.752	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-83.8	-9.5	176.7	-60	-172.9	178.1	-177.9	0	113.1	T572 L573	T572-K575 WeakPolarHBondContact O-CB 3.39Å; T572-K575 PolarHBondContact O-N 3.11Å; L573-K575 PolarHBondContact O-N 2.89Å; L573-K575 VanDerWaalsContact O-N 3.08Å
576	F	83	Confident	82.1	Confident	15 Å²	15	63.1 Å²	63.1	7%	0.066	34%	0.343	C	S	.	.	S	Bend	trans	-66.5	146.6	178.8	-80.4	36.4	0	0	0	110.6	Y559 L564 H567 L573 G574 M580 L581 K596	Y559-F576 HydrophobicContact CD1-CE2 4.18Å; Y559-F576 AromaticContact CE1-CE2 3.93Å; Y559-F576 HydrophobicContact CE1-CE2 3.93Å; L564-F576 HydrophobicContact CD2-CE2 4.44Å; H567-F576 HydrophobicContact CB-CE1 4.4Å; H567-F576 HydrophobicContact CB-CZ 4.46Å; H567-F576 AromaticContact CD2-CE1 3.9Å; H567-F576 AromaticContact CD2-CZ 3.49Å; H567-F576 VanDerWaalsContact CD2-CZ 3.49Å; H567-F576 WeakPolarHBondContact CD2-CZ 3.36Å; H567-F576 AromaticContact CE1-CE1 3.79Å; H567-F576 AromaticContact CG-CE1 3.75Å; H567-F576 AromaticContact CG-CZ 3.79Å; H567-F576 AromaticContact ND1-CE1 3.68Å; H567-F576 AromaticContact NE2-CE1 3.93Å; H567-F576 AromaticContact NE2-CZ 3.67Å; L573-F576 HydrophobicContact CD1-CD2 4.41Å; L573-F576 VanDerWaalsContact O-CB 3.32Å; L573-F576 WeakPolarHBondContact O-CB 3.32Å; L573-F576 PolarHBondContact O-N 3.16Å; G574-F576 VanDerWaalsContact C-N 3.34Å; F576-M580 HydrophobicContact CB-CB 4.34Å; F576-M580 HydrophobicContact CD2-CB 3.9Å; F576-M580 HydrophobicContact CD2-CE 4.03Å; F576-M580 HydrophobicContact CE2-CE 4.03Å; F576-M580 HydrophobicContact CG-CB 4.47Å; F576-M580 HydrophobicContact CG-CE 4.34Å; F576-M580 HydrophobicContact CZ-CE 4.34Å; F576-L581 HydrophobicContact CB-CD1 4.27Å; F576-L581 HydrophobicContact CB-CD2 3.78Å; F576-L581 HydrophobicContact CB-CG 3.71Å; F576-L581 HydrophobicContact CD2-CD2 4.33Å; F576-L581 HydrophobicContact CG-CD2 4.37Å; F576-K596 WeakPolarHBondContact O-CE 3.35Å; F576-K596 PolarHBondContact O-NZ 3.24Å
577	T	84.7	Confident	82.1	Confident	73 Å²	73	63.2 Å²	63.2	45%	0.448	35%	0.35	S	S	.	.			trans	-76.7	154.5	173.6	65.2	0	0	0	0	109.7	P579 M580 L581	T577-P579 VanDerWaalsContact C-CD 3.43Å; T577-P579 VanDerWaalsContact C-N 3.28Å; T577-M580 HydrophobicContact CG2-SD 4.41Å; T577-M580 PolarHBondContact O-N 3.31Å; T577-M580 VanDerWaalsContact OG1-CG 3.24Å; T577-M580 WeakPolarHBondContact OG1-CG 3.49Å; T577-M580 PolarHBondContact OG1-SD 2.91Å; T577-L581 PolarHBondContact O-N 3.19Å
578	V	81.8	Confident	82	Confident	46 Å²	46	63.5 Å²	63.5	28%	0.279	35%	0.35	S	S	.	.	H	α-helix	trans	-53.6	-39.1	178.9	178.6	0	0	0	0	112.7	L581 K582 K596 L599	V578-L581 PolarHBondContact O-N 3.22Å; V578-K582 HydrophobicContact CG1-CD 4.3Å; V578-K582 HydrophobicContact CG1-CG 4.47Å; V578-K582 WeakPolarHBondContact O-CG 3.49Å; V578-K582 PolarHBondContact O-N 3.26Å; V578-K596 HydrophobicContact CG2-CB 3.72Å; V578-K596 HydrophobicContact CG2-CD 4.17Å; V578-K596 HydrophobicContact CG2-CG 3.96Å; V578-L599 HydrophobicContact CG1-CD1 3.88Å
579	P	83.4	Confident	81.9	Confident	86 Å²	86	65.8 Å²	65.8	56%	0.558	38%	0.379	S	S	*	.	H	α-helix	trans	-60.8	-44.2	173.3	-25.8	36.2	0	0	0	113.9	T577 L581 K582 E583	T577-P579 VanDerWaalsContact C-CD 3.43Å; T577-P579 VanDerWaalsContact C-N 3.28Å; P579-L581 PolarHBondContact O-N 3.41Å; P579-K582 PolarHBondContact O-N 3.42Å; P579-E583 PolarHBondContact O-N 3.28Å
580	M	81.8	Confident	81.9	Confident	58 Å²	58	62 Å²	62	29%	0.286	35%	0.35	S	S	.	.	H	α-helix	trans	-63.8	-41.2	179	-62.5	170.6	74.6	0	0	111.5	Y559 F576 T577 E583 A584	Y559-M580 HydrophobicContact CE1-CE 4.04Å; Y559-M580 WeakPolarHBondContact OH-CE 3.39Å; Y559-M580 WeakPolarHBondContact OH-CG 3.38Å; F576-M580 HydrophobicContact CB-CB 4.34Å; F576-M580 HydrophobicContact CD2-CB 3.9Å; F576-M580 HydrophobicContact CD2-CE 4.03Å; F576-M580 HydrophobicContact CE2-CE 4.03Å; F576-M580 HydrophobicContact CG-CB 4.47Å; F576-M580 HydrophobicContact CG-CE 4.34Å; F576-M580 HydrophobicContact CZ-CE 4.34Å; T577-M580 HydrophobicContact CG2-SD 4.41Å; T577-M580 PolarHBondContact O-N 3.31Å; T577-M580 VanDerWaalsContact OG1-CG 3.24Å; T577-M580 WeakPolarHBondContact OG1-CG 3.49Å; T577-M580 PolarHBondContact OG1-SD 2.91Å; M580-E583 PolarHBondContact O-N 3.3Å; M580-A584 WeakPolarHBondContact O-CB 3.4Å; M580-A584 PolarHBondContact O-N 3.38Å
581	L	81.7	Confident	81.5	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-67	-37	176	-67.7	168.1	0	0	0	112.1	L573 F576 T577 V578 P579 C585 K596 L599 L600 L603	L573-L581 HydrophobicContact CD1-CD2 4.24Å; L573-L581 HydrophobicContact CG-CD2 4.21Å; F576-L581 HydrophobicContact CB-CD1 4.27Å; F576-L581 HydrophobicContact CB-CD2 3.78Å; F576-L581 HydrophobicContact CB-CG 3.71Å; F576-L581 HydrophobicContact CD2-CD2 4.33Å; F576-L581 HydrophobicContact CG-CD2 4.37Å; T577-L581 PolarHBondContact O-N 3.19Å; V578-L581 PolarHBondContact O-N 3.22Å; P579-L581 PolarHBondContact O-N 3.41Å; L581-C585 WeakPolarHBondContact O-CB 3.26Å; L581-C585 PolarHBondContact O-N 3.17Å; L581-C585 PolarHBondContact O-SG 3.02Å; L581-K596 HydrophobicContact CD1-CG 3.77Å; L581-L599 HydrophobicContact CB-CB 3.81Å; L581-L599 HydrophobicContact CB-CD1 3.92Å; L581-L599 HydrophobicContact CB-CG 4.46Å; L581-L599 HydrophobicContact CD1-CB 4.32Å; L581-L600 HydrophobicContact CD1-CD2 3.97Å; L581-L600 HydrophobicContact CD1-CG 3.93Å; L581-L600 HydrophobicContact CD2-CD2 3.8Å; L581-L600 HydrophobicContact CD2-CG 4.46Å; L581-L603 HydrophobicContact CB-CD1 4.41Å; L581-L603 HydrophobicContact CD2-CD1 3.67Å
582	K	81.9	Confident	81.1	Confident	61 Å²	61	64.5 Å²	64.5	27%	0.265	35%	0.351	S	S	.	.	H	α-helix	trans	-66.9	-38.7	174	-76.6	-176	178.2	-178.7	0	112.1	V578 P579 R586 L599	V578-K582 HydrophobicContact CG1-CD 4.3Å; V578-K582 HydrophobicContact CG1-CG 4.47Å; V578-K582 WeakPolarHBondContact O-CG 3.49Å; V578-K582 PolarHBondContact O-N 3.26Å; P579-K582 PolarHBondContact O-N 3.42Å; K582-R586 WeakPolarHBondContact O-CB 3.32Å; K582-R586 WeakPolarHBondContact O-CG 3.48Å; K582-R586 PolarHBondContact O-N 2.81Å; K582-L599 HydrophobicContact CG-CD1 3.61Å; K582-L599 HydrophobicContact CG-CD2 4.06Å
583	E	83.4	Confident	80.6	Confident	98 Å²	98	63.6 Å²	63.6	46%	0.458	35%	0.35	S	S	.	.	H	α-helix	trans	-67	-43.2	175.4	-77.2	-166.8	160.6	0	0	112	Y559 P579 M580 R586 A587	Y559-E583 HydrophobicContact CE2-CB 4.11Å; P579-E583 PolarHBondContact O-N 3.28Å; M580-E583 PolarHBondContact O-N 3.3Å; E583-R586 PolarHBondContact O-N 2.91Å; E583-A587 WeakPolarHBondContact O-CB 3.34Å; E583-A587 PolarHBondContact O-N 2.72Å
584	A	78.1	Confident	80.3	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-59.9	-49.9	172.1	0	0	0	0	0	111.4	Y559 L564 M580 R586 A587 Y588 L603	Y559-A584 HydrophobicContact CD2-CB 4.18Å; L564-A584 HydrophobicContact CD1-CB 4.12Å; L564-A584 HydrophobicContact CD2-CB 3.96Å; M580-A584 WeakPolarHBondContact O-CB 3.4Å; M580-A584 PolarHBondContact O-N 3.38Å; A584-R586 PolarHBondContact O-N 3.26Å; A584-A587 PolarHBondContact O-N 3.44Å; A584-Y588 VanDerWaalsContact O-CD2 3.26Å; A584-Y588 WeakPolarHBondContact O-CD2 3.18Å; A584-Y588 PolarHBondContact O-N 3.06Å; A584-L603 HydrophobicContact CB-CD1 3.77Å; A584-L603 HydrophobicContact CB-CD2 3.92Å
585	C	82.4	Confident	80.3	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-59.2	-34.8	175.8	-69.1	0	0	0	0	113.1	L581 G589 L590 L599 L603	L581-C585 WeakPolarHBondContact O-CB 3.26Å; L581-C585 PolarHBondContact O-N 3.17Å; L581-C585 PolarHBondContact O-SG 3.02Å; C585-G589 PolarHBondContact O-N 3.12Å; C585-G589 VanDerWaalsContact O-N 3.14Å; C585-L590 HydrophobicContact CB-CB 4.22Å; C585-L590 PolarHBondContact O-N 3.13Å; C585-L599 HydrophobicContact CB-CD2 4.46Å; C585-L603 VanDerWaalsContact SG-CG 3.6Å
586	R	82.4	Confident	80.2	Confident	181 Å²	181	71.1 Å²	71.1	68%	0.683	38%	0.378	S	S	*	.	H	α-helix	trans	-71.3	-39.8	177.2	-78.4	171.7	-178.6	-173.3	-0.8	112.5	K582 E583 A584 Y588 G589	K582-R586 WeakPolarHBondContact O-CB 3.32Å; K582-R586 WeakPolarHBondContact O-CG 3.48Å; K582-R586 PolarHBondContact O-N 2.81Å; E583-R586 PolarHBondContact O-N 2.91Å; A584-R586 PolarHBondContact O-N 3.26Å; R586-Y588 PolarHBondContact O-N 3.17Å; R586-G589 PolarHBondContact O-N 2.94Å
587	A	81.8	Confident	80.1	Confident	64 Å²	64	75.9 Å²	75.9	53%	0.529	40%	0.4	S	S	.	.	H	α-helix	trans	-59.7	-35	177.5	0	0	0	0	0	111.7	E583 A584	E583-A587 WeakPolarHBondContact O-CB 3.34Å; E583-A587 PolarHBondContact O-N 2.72Å; A584-A587 PolarHBondContact O-N 3.44Å
588	Y	78.6	Confident	80	Confident	52 Å²	52	76.1 Å²	76.1	20%	0.204	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	8.8	179.1	-66	-79.4	0	0	0	114.2	Y559 S560 E561 L564 A584 R586 L590 F607	Y559-Y588 PolarHBondContact O-OH 3Å; Y559-Y588 VanDerWaalsContact O-OH 3.11Å; S560-Y588 VanDerWaalsContact C-OH 3.31Å; E561-Y588 WeakPolarHBondContact CA-OH 3.44Å; E561-Y588 HydrophobicContact CG-CE1 3.43Å; E561-Y588 VanDerWaalsContact CG-CE1 3.43Å; E561-Y588 WeakPolarHBondContact CG-OH 3.23Å; E561-Y588 PolarHBondContact N-OH 3.39Å; E561-Y588 WeakPolarHBondContact OE1-CE1 3.23Å; L564-Y588 HydrophobicContact CD1-CD2 3.96Å; L564-Y588 HydrophobicContact CD1-CE2 3.34Å; A584-Y588 VanDerWaalsContact O-CD2 3.26Å; A584-Y588 WeakPolarHBondContact O-CD2 3.18Å; A584-Y588 PolarHBondContact O-N 3.06Å; R586-Y588 PolarHBondContact O-N 3.17Å; Y588-L590 WeakPolarHBondContact O-CD2 3.21Å; Y588-L590 PolarHBondContact O-N 3.42Å; Y588-F607 AromaticContact CD1-CZ 3.85Å; Y588-F607 HydrophobicContact CD1-CZ 3.85Å; Y588-F607 HydrophobicContact CD2-CE2 4.25Å; Y588-F607 AromaticContact CD2-CZ 3.9Å; Y588-F607 HydrophobicContact CD2-CZ 3.9Å; Y588-F607 HydrophobicContact CE1-CE1 4.23Å; Y588-F607 AromaticContact CE1-CZ 3.71Å; Y588-F607 HydrophobicContact CE1-CZ 3.71Å; Y588-F607 HydrophobicContact CE2-CE2 4.41Å; Y588-F607 AromaticContact CE2-CZ 3.81Å; Y588-F607 HydrophobicContact CE2-CZ 3.81Å; Y588-F607 HydrophobicContact CG-CE2 4.45Å; Y588-F607 AromaticContact CG-CZ 3.96Å; Y588-F607 HydrophobicContact CG-CZ 3.96Å; Y588-F607 AromaticContact CZ-CZ 3.7Å
589	G	80.1	Confident	80.1	Confident	70 Å²	70	73.9 Å²	73.9	72%	0.722	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	23.9	177.4	0	0	0	0	0	115	C585 R586	C585-G589 PolarHBondContact O-N 3.12Å; C585-G589 VanDerWaalsContact O-N 3.14Å; R586-G589 PolarHBondContact O-N 2.94Å
590	L	82.4	Confident	80.1	Confident	27 Å²	27	70.9 Å²	70.9	14%	0.141	36%	0.362	C	S	.	.			trans	-78.9	143	-174.9	-45.1	178	0	0	0	110.9	C585 Y588 S592 L603 H606	C585-L590 HydrophobicContact CB-CB 4.22Å; C585-L590 PolarHBondContact O-N 3.13Å; Y588-L590 WeakPolarHBondContact O-CD2 3.21Å; Y588-L590 PolarHBondContact O-N 3.42Å; L590-S592 PolarHBondContact O-N 3.24Å; L590-L603 HydrophobicContact CD1-CD2 3.62Å; L590-L603 HydrophobicContact CD1-CG 4.21Å; L590-H606 HydrophobicContact CD1-CB 3.98Å; L590-H606 HydrophobicContact CD2-CB 4.07Å; L590-H606 WeakPolarHBondContact CD2-CD2 3.26Å
591	K	75.6	Confident	80.1	Confident	208 Å²	208	73.1 Å²	73.1	90%	0.904	37%	0.372	S	S	*	.			trans	-63.6	105.2	170.9	-69.3	-177.2	-179.1	178	0	108.9
592	S	72.6	Confident	80.1	Confident	59 Å²	59	74.3 Å²	74.3	41%	0.413	38%	0.382	S	S	.	.			trans	-95.1	140.1	-177.2	34.6	0	0	0	0	111.4	L590	L590-S592 PolarHBondContact O-N 3.24Å
593	G	72.8	Confident	80.2	Confident	22 Å²	22	71.4 Å²	71.4	23%	0.227	37%	0.369	C	S	.	.			trans	-90.3	178.4	172.2	0	0	0	0	0	113.6	E598	G593-E598 WeakPolarHBondContact CA-OE2 3.45Å
594	L	74.5	Confident	80.1	Confident	151 Å²	151	69.1 Å²	69.1	79%	0.791	36%	0.362	S	S	*	.	S	Bend	trans	-86.4	-26.5	175.9	-69.4	171	0	0	0	111.7	E598	L594-E598 PolarHBondContact N-OE2 2.98Å
595	K	80.8	Confident	80.3	Confident	144 Å²	144	75.7 Å²	75.7	63%	0.626	39%	0.391	S	S	*	.	S	Bend	trans	-88.5	147.5	-178	-64.2	176.7	-178	170.8	0	111.1	Q597 E598 L599	K595-Q597 PolarHBondContact O-N 2.87Å; K595-E598 HydrophobicContact CB-CG 4.16Å; K595-E598 PolarHBondContact N-OE2 2.89Å; K595-E598 VanDerWaalsContact N-OE2 3.15Å; K595-E598 PolarHBondContact O-N 2.88Å; K595-L599 PolarHBondContact O-N 3.45Å
596	K	80.9	Confident	80.3	Confident	79 Å²	79	79.8 Å²	79.8	34%	0.343	41%	0.409	S	S	.	.	H	α-helix	trans	-55.6	-40.2	175.8	-170.8	173.2	167.2	171.7	0	112.4	G574 F576 V578 L581 L599 L600	G574-K596 WeakPolarHBondContact O-CE 3.46Å; G574-K596 PolarHBondContact O-NZ 3.28Å; F576-K596 WeakPolarHBondContact O-CE 3.35Å; F576-K596 PolarHBondContact O-NZ 3.24Å; V578-K596 HydrophobicContact CG2-CB 3.72Å; V578-K596 HydrophobicContact CG2-CD 4.17Å; V578-K596 HydrophobicContact CG2-CG 3.96Å; L581-K596 HydrophobicContact CD1-CG 3.77Å; K596-L599 PolarHBondContact O-N 3.16Å; K596-L600 HydrophobicContact CG-CD1 4.22Å; K596-L600 WeakPolarHBondContact O-CG 3.35Å; K596-L600 PolarHBondContact O-N 3.06Å; K596-L600 VanDerWaalsContact O-N 3.08Å
597	Q	81.1	Confident	80	Confident	114 Å²	114	72.5 Å²	72.5	53%	0.533	38%	0.383	S	S	.	.	H	α-helix	trans	-64.1	-41.5	-178.1	-170	62	22.1	0	0	112.5	K595 L599 L600 E601	K595-Q597 PolarHBondContact O-N 2.87Å; Q597-L599 VanDerWaalsContact C-N 3.33Å; Q597-L599 PolarHBondContact O-N 3.03Å; Q597-L600 PolarHBondContact O-N 3.12Å; Q597-E601 WeakPolarHBondContact CG-OE1 3.35Å; Q597-E601 PolarHBondContact NE2-OE1 2.92Å; Q597-E601 WeakPolarHBondContact O-CG 3.46Å; Q597-E601 PolarHBondContact O-N 3.46Å
598	E	82.8	Confident	79.4	Confident	78 Å²	78	75.9 Å²	75.9	36%	0.364	39%	0.387	S	S	.	.	H	α-helix	trans	-65.1	-36.6	178.3	-65.9	164	175.3	0	0	111.7	G593 L594 K595 A602	G593-E598 WeakPolarHBondContact CA-OE2 3.45Å; L594-E598 PolarHBondContact N-OE2 2.98Å; K595-E598 HydrophobicContact CB-CG 4.16Å; K595-E598 PolarHBondContact N-OE2 2.89Å; K595-E598 VanDerWaalsContact N-OE2 3.15Å; K595-E598 PolarHBondContact O-N 2.88Å; E598-A602 VanDerWaalsContact O-CB 3.28Å; E598-A602 WeakPolarHBondContact O-CB 3.39Å; E598-A602 PolarHBondContact O-N 2.9Å
599	L	83.3	Confident	78.2	Confident	0 Å²	0	81.6 Å²	81.6	0%	0	42%	0.422	C	S	.	.	H	α-helix	trans	-71.2	-36.9	176.7	-59.6	167.8	0	0	0	112.1	V578 L581 K582 C585 K595 K596 Q597 L603	V578-L599 HydrophobicContact CG1-CD1 3.88Å; L581-L599 HydrophobicContact CB-CB 3.81Å; L581-L599 HydrophobicContact CB-CD1 3.92Å; L581-L599 HydrophobicContact CB-CG 4.46Å; L581-L599 HydrophobicContact CD1-CB 4.32Å; K582-L599 HydrophobicContact CG-CD1 3.61Å; K582-L599 HydrophobicContact CG-CD2 4.06Å; C585-L599 HydrophobicContact CB-CD2 4.46Å; K595-L599 PolarHBondContact O-N 3.45Å; K596-L599 PolarHBondContact O-N 3.16Å; Q597-L599 VanDerWaalsContact C-N 3.33Å; Q597-L599 PolarHBondContact O-N 3.03Å; L599-L603 PolarHBondContact O-N 3.32Å; L599-L603 VanDerWaalsContact O-N 3.1Å
600	L	82.1	Confident	78.1	Confident	22 Å²	22	82.2 Å²	82.2	12%	0.115	41%	0.407	C	S	.	.	H	α-helix	trans	-65.1	-46.4	174.7	-75.1	169.1	0	0	0	111.3	L573 L581 K596 Q597 T604	L573-L600 HydrophobicContact CB-CD2 4.23Å; L573-L600 HydrophobicContact CD2-CD2 3.9Å; L573-L600 HydrophobicContact CG-CD2 3.71Å; L573-L600 WeakPolarHBondContact O-CD2 3.43Å; L581-L600 HydrophobicContact CD1-CD2 3.97Å; L581-L600 HydrophobicContact CD1-CG 3.93Å; L581-L600 HydrophobicContact CD2-CD2 3.8Å; L581-L600 HydrophobicContact CD2-CG 4.46Å; K596-L600 HydrophobicContact CG-CD1 4.22Å; K596-L600 WeakPolarHBondContact O-CG 3.35Å; K596-L600 PolarHBondContact O-N 3.06Å; K596-L600 VanDerWaalsContact O-N 3.08Å; Q597-L600 PolarHBondContact O-N 3.12Å; L600-T604 VanDerWaalsContact O-CB 3.24Å; L600-T604 WeakPolarHBondContact O-CB 3.05Å; L600-T604 PolarHBondContact O-N 2.87Å; L600-T604 PolarHBondContact O-OG1 2.9Å
601	E	83.8	Confident	77.9	Confident	106 Å²	106	85.1 Å²	85.1	50%	0.495	42%	0.421	S	S	.	.	H	α-helix	trans	-64.3	-41	178	-73.6	167.6	-166.3	0	0	111.5	Q597 T604 K605	Q597-E601 WeakPolarHBondContact CG-OE1 3.35Å; Q597-E601 PolarHBondContact NE2-OE1 2.92Å; Q597-E601 WeakPolarHBondContact O-CG 3.46Å; Q597-E601 PolarHBondContact O-N 3.46Å; E601-T604 PolarHBondContact O-N 3.41Å; E601-K605 WeakPolarHBondContact O-CB 3.33Å; E601-K605 PolarHBondContact O-N 3.36Å
602	A	81.7	Confident	78	Confident	25 Å²	25	78.2 Å²	78.2	21%	0.207	39%	0.394	C	S	.	.	H	α-helix	trans	-63.7	-45.3	177.6	0	0	0	0	0	113	E598 H606	E598-A602 VanDerWaalsContact O-CB 3.28Å; E598-A602 WeakPolarHBondContact O-CB 3.39Å; E598-A602 PolarHBondContact O-N 2.9Å; A602-H606 WeakPolarHBondContact O-CB 3.36Å; A602-H606 PolarHBondContact O-N 3.25Å; A602-H606 VanDerWaalsContact O-N 3.12Å
603	L	82.4	Confident	78.3	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-70.6	-41.3	177.1	-75.8	163.2	0	0	0	111.7	L564 L573 L581 A584 C585 L590 L599 K605 H606 F607	L564-L603 HydrophobicContact CD1-CD2 4.47Å; L573-L603 HydrophobicContact CD2-CB 4.08Å; L581-L603 HydrophobicContact CB-CD1 4.41Å; L581-L603 HydrophobicContact CD2-CD1 3.67Å; A584-L603 HydrophobicContact CB-CD1 3.77Å; A584-L603 HydrophobicContact CB-CD2 3.92Å; C585-L603 VanDerWaalsContact SG-CG 3.6Å; L590-L603 HydrophobicContact CD1-CD2 3.62Å; L590-L603 HydrophobicContact CD1-CG 4.21Å; L599-L603 PolarHBondContact O-N 3.32Å; L599-L603 VanDerWaalsContact O-N 3.1Å; L603-K605 PolarHBondContact O-N 2.87Å; L603-H606 PolarHBondContact O-N 3.21Å; L603-F607 HydrophobicContact CD2-CE2 4.07Å; L603-F607 VanDerWaalsContact O-CD2 3.26Å; L603-F607 WeakPolarHBondContact O-CD2 3.2Å; L603-F607 PolarHBondContact O-N 3.19Å
604	T	81.9	Confident	78.7	Confident	49 Å²	49	82.9 Å²	82.9	30%	0.301	40%	0.403	S	S	.	.	H	α-helix	trans	-64.2	-43.5	178.7	-53	0	0	0	0	110.5	I568 L600 E601 F607 Q608	I568-T604 HydrophobicContact CG2-CG2 4.24Å; L600-T604 VanDerWaalsContact O-CB 3.24Å; L600-T604 WeakPolarHBondContact O-CB 3.05Å; L600-T604 PolarHBondContact O-N 2.87Å; L600-T604 PolarHBondContact O-OG1 2.9Å; E601-T604 PolarHBondContact O-N 3.41Å; T604-F607 PolarHBondContact O-N 3.42Å; T604-Q608 WeakPolarHBondContact O-CB 3.3Å; T604-Q608 PolarHBondContact O-N 3.33Å; T604-Q608 VanDerWaalsContact O-N 3.09Å
605	K	82.6	Confident	79	Confident	139 Å²	139	78.4 Å²	78.4	60%	0.604	38%	0.377	S	S	*	.	H	α-helix	trans	-62.7	-43.3	177	-171.1	176.7	-179.2	176.2	0	112.5	E601 L603 F607 D609	E601-K605 WeakPolarHBondContact O-CB 3.33Å; E601-K605 PolarHBondContact O-N 3.36Å; L603-K605 PolarHBondContact O-N 2.87Å; K605-F607 VanDerWaalsContact C-N 3.3Å; K605-F607 PolarHBondContact O-N 3.16Å; K605-D609 WeakPolarHBondContact CE-OD2 3.48Å; K605-D609 VanDerWaalsContact CG-OD2 3.31Å; K605-D609 WeakPolarHBondContact CG-OD2 3.32Å; K605-D609 WeakPolarHBondContact O-CB 3.21Å; K605-D609 PolarHBondContact O-N 2.78Å; K605-D609 VanDerWaalsContact O-N 3.09Å
606	H	81.7	Confident	78.8	Confident	85 Å²	85	73.7 Å²	73.7	39%	0.394	36%	0.359	S	S	.	.	H	α-helix	trans	-65.2	-28.6	-177.7	-177.4	-93.6	0	0	0	114.4	L590 A602 L603	L590-H606 HydrophobicContact CD1-CB 3.98Å; L590-H606 HydrophobicContact CD2-CB 4.07Å; L590-H606 WeakPolarHBondContact CD2-CD2 3.26Å; A602-H606 WeakPolarHBondContact O-CB 3.36Å; A602-H606 PolarHBondContact O-N 3.25Å; A602-H606 VanDerWaalsContact O-N 3.12Å; L603-H606 PolarHBondContact O-N 3.21Å
607	F	76.8	Confident	78.7	Confident	29 Å²	29	73.3 Å²	73.3	13%	0.127	36%	0.36	C	S	.	.	H	α-helix	trans	-107.4	-3.2	-176.6	-71	-72.8	0	0	0	114	E561 L564 I568 Y588 L603 T604 K605	E561-F607 HydrophobicContact CB-CE1 3.99Å; E561-F607 HydrophobicContact CG-CE1 3.85Å; E561-F607 HydrophobicContact CG-CZ 4.37Å; L564-F607 HydrophobicContact CB-CD2 4.45Å; L564-F607 HydrophobicContact CB-CE2 4.19Å; L564-F607 HydrophobicContact CB-CZ 4.47Å; L564-F607 HydrophobicContact CD1-CE2 3.84Å; L564-F607 HydrophobicContact CD1-CZ 3.99Å; I568-F607 HydrophobicContact CD1-CB 3.6Å; I568-F607 HydrophobicContact CD1-CD2 4.04Å; I568-F607 HydrophobicContact CD1-CG 4.16Å; Y588-F607 AromaticContact CD1-CZ 3.85Å; Y588-F607 HydrophobicContact CD1-CZ 3.85Å; Y588-F607 HydrophobicContact CD2-CE2 4.25Å; Y588-F607 AromaticContact CD2-CZ 3.9Å; Y588-F607 HydrophobicContact CD2-CZ 3.9Å; Y588-F607 HydrophobicContact CE1-CE1 4.23Å; Y588-F607 AromaticContact CE1-CZ 3.71Å; Y588-F607 HydrophobicContact CE1-CZ 3.71Å; Y588-F607 HydrophobicContact CE2-CE2 4.41Å; Y588-F607 AromaticContact CE2-CZ 3.81Å; Y588-F607 HydrophobicContact CE2-CZ 3.81Å; Y588-F607 HydrophobicContact CG-CE2 4.45Å; Y588-F607 AromaticContact CG-CZ 3.96Å; Y588-F607 HydrophobicContact CG-CZ 3.96Å; Y588-F607 AromaticContact CZ-CZ 3.7Å; L603-F607 HydrophobicContact CD2-CE2 4.07Å; L603-F607 VanDerWaalsContact O-CD2 3.26Å; L603-F607 WeakPolarHBondContact O-CD2 3.2Å; L603-F607 PolarHBondContact O-N 3.19Å; T604-F607 PolarHBondContact O-N 3.42Å; K605-F607 VanDerWaalsContact C-N 3.3Å; K605-F607 PolarHBondContact O-N 3.16Å
608	Q	68.8	Low	78.5	Confident	134 Å²	134	69.9 Å²	69.9	63%	0.626	35%	0.346	S	S	*	.	H	α-helix	trans	-123	-21.2	-174.9	-160.4	143.1	-0.4	0	0	114.5	T604	T604-Q608 WeakPolarHBondContact O-CB 3.3Å; T604-Q608 PolarHBondContact O-N 3.33Å; T604-Q608 VanDerWaalsContact O-N 3.09Å
609	D	54	Low	78.1	Confident	172 Å²	172	69.2 Å²	69.2	92%	0.92	34%	0.344	S	S	*	.			trans	-77.1	0	152.4	-74.1	-23.1	0	0	0	109	K605	K605-D609 WeakPolarHBondContact CE-OD2 3.48Å; K605-D609 VanDerWaalsContact CG-OD2 3.31Å; K605-D609 WeakPolarHBondContact CG-OD2 3.32Å; K605-D609 WeakPolarHBondContact O-CB 3.21Å; K605-D609 PolarHBondContact O-N 2.78Å; K605-D609 VanDerWaalsContact O-N 3.09Å

Retrieved 609 of 609 residues in 718.3 ms (Link to these results)

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