A0A077YYR8_TRITR Loading...

Cell division cycle 2

AlphaFold DB , UniProt , Accession A0A077YYR8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 313 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.2	Very low	70.8	Confident	238 Å²	238	87.1 Å²	87.1	100%	1.172	50%	0.5	S	S	*	.				0	144.8	0	-69.3	179.1	-160.4	0	0	107.7	L3	M1-L3 PolarHBondContact O-N 3.25Å
2	S	60.1	Low	72.8	Confident	97 Å²	97	81.1 Å²	81.1	68%	0.678	47%	0.465	S	S	*	.			trans	-60.3	123.4	175.7	176.1	0	0	0	0	109.6	V4	S2-V4 PolarHBondContact O-N 2.62Å; S2-V4 PolarHBondContact OG-N 3.25Å; S2-V4 PolarHBondContact OG-O 3.29Å
3	L	66.8	Low	74.5	Confident	50 Å²	50	80.4 Å²	80.4	26%	0.262	46%	0.455	S	S	.	.	S	Bend	trans	-69.1	-20.8	172.5	-85.2	160	0	0	0	112	M1 Q64 E76 Q77 V78	M1-L3 PolarHBondContact O-N 3.25Å; L3-Q64 HydrophobicContact CD1-CG 3.54Å; L3-E76 WeakPolarHBondContact CD2-O 3.45Å; L3-Q77 WeakPolarHBondContact O-CG 3.18Å; L3-V78 PolarHBondContact O-N 3.32Å
4	V	68.9	Low	76	Confident	77 Å²	77	82.4 Å²	82.4	47%	0.467	46%	0.456	S	S	.	.	B	Isolated β-bridge	trans	-92	121.5	177.8	-174.8	0	0	0	0	109.2	S2 V78	S2-V4 PolarHBondContact O-N 2.62Å; S2-V4 PolarHBondContact OG-N 3.25Å; S2-V4 PolarHBondContact OG-O 3.29Å; V4-V78 WeakPolarHBondContact CA-O 3.2Å; V4-V78 HydrophobicContact CG2-CB 4.47Å
5	N	67.4	Low	77.3	Confident	86 Å²	86	82.2 Å²	82.2	46%	0.46	45%	0.453	S	S	.	.			trans	-132.4	118.9	174.8	-161.4	-2.2	0	0	0	110.4	A8 V78	N5-A8 HydrophobicContact CB-CB 3.96Å; N5-V78 PolarHBondContact N-O 3.49Å
6	N	63.5	Low	78.4	Confident	108 Å²	108	83.6 Å²	83.6	58%	0.578	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	133.9	178.4	-63.3	-19.3	0	0	0	108.4
7	N	62.6	Low	79.3	Confident	128 Å²	128	85.4 Å²	85.4	68%	0.684	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.2	17.1	-173.8	-55.5	-15.7	0	0	0	116.7
8	A	79.3	Confident	79.9	Confident	10 Å²	10	85 Å²	85	8%	0.083	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-78.5	-14.2	177	0	0	0	0	0	114.5	N5 A10 D11 I79	N5-A8 HydrophobicContact CB-CB 3.96Å; A8-A10 PolarHBondContact O-N 2.76Å; A8-D11 WeakPolarHBondContact O-CB 3.34Å; A8-D11 PolarHBondContact O-N 3.26Å; A8-I79 HydrophobicContact CB-CD1 3.88Å; A8-I79 HydrophobicContact CB-CG1 4.09Å
9	L	85.1	Confident	80.1	Confident	38 Å²	38	81.9 Å²	81.9	20%	0.199	45%	0.445	C	S	.	.	G	3₁₀ helix	trans	-65.3	-25.7	-177	-159.3	71.2	0	0	0	112.4	D11 I12 L40 I79 E81 Y86	L9-D11 PolarHBondContact O-N 3.12Å; L9-I12 PolarHBondContact O-N 3.44Å; L9-L40 HydrophobicContact CD1-CD1 4.32Å; L9-I79 HydrophobicContact CB-CG2 4.31Å; L9-I79 HydrophobicContact CD1-CD1 4.37Å; L9-E81 WeakPolarHBondContact CB-OE2 3.4Å; L9-E81 WeakPolarHBondContact CD2-OE2 2.9Å; L9-Y86 HydrophobicContact CD1-CD1 4.34Å; L9-Y86 HydrophobicContact CD1-CD2 4.07Å; L9-Y86 HydrophobicContact CD1-CE1 4.45Å; L9-Y86 HydrophobicContact CD1-CE2 4.18Å; L9-Y86 HydrophobicContact CD1-CG 4.14Å; L9-Y86 HydrophobicContact CD2-CE2 3.97Å
10	A	88.2	Confident	80.3	Confident	83 Å²	83	83.2 Å²	83.2	69%	0.686	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-60.6	-28.5	173.9	0	0	0	0	0	112.9	A8 I12	A8-A10 PolarHBondContact O-N 2.76Å; A10-I12 VanDerWaalsContact C-N 3.28Å
11	D	90.8	Very high	79.8	Confident	43 Å²	43	81.1 Å²	81.1	23%	0.23	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-73.4	-21.4	173.3	-169.2	60.4	0	0	0	112.4	A8 L9 S31 R32 S33	A8-D11 WeakPolarHBondContact O-CB 3.34Å; A8-D11 PolarHBondContact O-N 3.26Å; L9-D11 PolarHBondContact O-N 3.12Å; D11-S31 PolarHBondContact OD2-OG 3.5Å; D11-R32 WeakPolarHBondContact O-CB 3.36Å; D11-R32 WeakPolarHBondContact O-CG 3.48Å; D11-R32 PolarHBondContact O-N 3.45Å; D11-R32 WeakPolarHBondContact OD1-CB 3.4Å; D11-S33 VanDerWaalsContact CG-OG 3.32Å; D11-S33 WeakPolarHBondContact OD1-CB 3.41Å; D11-S33 PolarHBondContact OD1-N 3.28Å; D11-S33 PolarHBondContact OD1-OG 3.22Å; D11-S33 PolarHBondContact OD2-OG 3.4Å
12	I	94.2	Very high	80.9	Confident	15 Å²	15	74.4 Å²	74.4	8%	0.077	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	102.5	-172	-54	-56.4	0	0	0	110.2	L9 A10 K14 A29 V38 L40 I79 I88	L9-I12 PolarHBondContact O-N 3.44Å; A10-I12 VanDerWaalsContact C-N 3.28Å; I12-K14 PolarHBondContact O-N 3.28Å; I12-A29 HydrophobicContact CG2-CB 3.51Å; I12-V38 HydrophobicContact CD1-CG2 4.41Å; I12-V38 HydrophobicContact CG2-CG2 4.49Å; I12-L40 HydrophobicContact CG2-CD1 4.42Å; I12-L40 HydrophobicContact CG2-CD2 4.29Å; I12-I79 HydrophobicContact CG1-CD1 4.08Å; I12-I88 HydrophobicContact CD1-CD1 4.39Å; I12-I88 HydrophobicContact CG1-CD1 4.15Å; I12-I88 HydrophobicContact CG2-CD1 4.45Å
13	Q	95.2	Very high	81.5	Confident	72 Å²	72	72.7 Å²	72.7	34%	0.336	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	105.1	171.5	-177.9	176.3	-12.7	0	0	110.4	L15 A29 L30	Q13-L15 HydrophobicContact CG-CD2 4.11Å; Q13-L15 PolarHBondContact O-N 3.24Å; Q13-A29 CarbonylContact O-C 3.47Å; Q13-A29 WeakPolarHBondContact O-CA 3.33Å; Q13-A29 WeakPolarHBondContact O-CB 3.22Å; Q13-L30 HydrophobicContact CB-CB 4.37Å; Q13-L30 PolarHBondContact N-O 2.83Å; Q13-L30 PolarHBondContact O-N 2.79Å
14	K	95.1	Very high	82.3	Confident	109 Å²	109	70.4 Å²	70.4	47%	0.474	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	130.6	172.4	-169.8	-176.9	-175.8	-174.6	0	111.1	I12 Y27	I12-K14 PolarHBondContact O-N 3.28Å; K14-Y27 HydrophobicContact CD-CD1 4.17Å; K14-Y27 HydrophobicContact CD-CE1 4.39Å; K14-Y27 HydrophobicContact CD-CG 4.23Å; K14-Y27 VanDerWaalsContact CE-CE2 3.46Å; K14-Y27 HydrophobicContact CG-CD1 4.13Å; K14-Y27 HydrophobicContact CG-CG 4.06Å; K14-Y27 PolarHBondContact NZ-OH 2.65Å; K14-Y27 VanDerWaalsContact NZ-OH 3.11Å
15	L	95.5	Very high	83.3	Confident	79 Å²	79	67.5 Å²	67.5	41%	0.414	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	-73.7	-177.3	-58.1	175.3	0	0	0	111.8	Q13 K28 L30 Y37	Q13-L15 HydrophobicContact CG-CD2 4.11Å; Q13-L15 PolarHBondContact O-N 3.24Å; L15-K28 WeakPolarHBondContact CA-O 3.49Å; L15-K28 WeakPolarHBondContact CB-O 3.47Å; L15-K28 HydrophobicContact CD1-CG 4.41Å; L15-K28 PolarHBondContact N-O 2.77Å; L15-L30 HydrophobicContact CD1-CB 4.2Å; L15-Y37 HydrophobicContact CD1-CD1 3.91Å; L15-Y37 HydrophobicContact CD1-CE1 3.55Å
16	E	95.1	Very high	84.5	Confident	104 Å²	104	65.3 Å²	65.3	49%	0.486	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	152	-174.6	61.7	176.9	161.2	0	0	111.7	I18 Y27 K28	E16-I18 HydrophobicContact CG-CG2 3.95Å; E16-Y27 CarbonylContact O-C 3.54Å; E16-Y27 WeakPolarHBondContact O-CA 3.4Å; E16-Y27 WeakPolarHBondContact O-CB 3.3Å; E16-K28 HydrophobicContact CG-CB 3.81Å; E16-K28 HydrophobicContact CG-CD 4.26Å; E16-K28 PolarHBondContact N-O 2.79Å; E16-K28 PolarHBondContact O-N 2.94Å; E16-K28 WeakPolarHBondContact OE1-CD 3.48Å
17	K	94.3	Very high	86	Confident	114 Å²	114	61.9 Å²	61.9	50%	0.496	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	120.3	172.9	-176.8	-177.8	172.7	-175.3	0	108.5	E20 V25 Y27	K17-E20 WeakPolarHBondContact CE-OE2 3.36Å; K17-E20 IonicContact NZ-OE2 3.9Å; K17-E20 PolarHBondContact NZ-OE2 3.29Å; K17-V25 HydrophobicContact CD-CG1 3.92Å; K17-V25 HydrophobicContact CG-CG1 3.78Å; K17-Y27 HydrophobicContact CB-CD1 3.83Å; K17-Y27 HydrophobicContact CB-CE1 3.74Å; K17-Y27 HydrophobicContact CG-CD1 4.31Å; K17-Y27 HydrophobicContact CG-CE1 4Å
18	I	90	Very high	87.6	Confident	79 Å²	79	57.5 Å²	57.5	41%	0.405	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	-16.7	-178.4	62.1	176.8	0	0	0	113.2	E16 V26 K28 Y91	E16-I18 HydrophobicContact CG-CG2 3.95Å; I18-V26 HydrophobicContact CD1-CG1 3.8Å; I18-V26 HydrophobicContact CG1-CB 4.06Å; I18-V26 HydrophobicContact CG1-CG1 3.72Å; I18-V26 WeakPolarHBondContact CG1-O 3.12Å; I18-V26 PolarHBondContact N-O 3.15Å; I18-K28 HydrophobicContact CD1-CB 4.47Å; I18-K28 HydrophobicContact CG2-CB 3.83Å; I18-Y91 HydrophobicContact CD1-CE2 4.11Å
19	G	84.1	Confident	88.5	Confident	26 Å²	26	57 Å²	57	27%	0.268	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.6	158.7	177.8	0	0	0	0	0	113	V25 V26	G19-V25 WeakPolarHBondContact O-CG1 3.41Å; G19-V26 PolarHBondContact N-O 3.46Å; G19-V26 PolarHBondContact O-N 3.29Å
20	E	82.8	Confident	89	Confident	107 Å²	107	57.2 Å²	57.2	50%	0.5	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	132.9	170.8	176.4	164.8	-140.9	0	0	108.4	K17 V25 R44	K17-E20 WeakPolarHBondContact CE-OE2 3.36Å; K17-E20 IonicContact NZ-OE2 3.9Å; K17-E20 PolarHBondContact NZ-OE2 3.29Å; E20-V25 HydrophobicContact CG-CG2 4.2Å; E20-R44 IonicContact OE1-CZ 3.74Å; E20-R44 IonicContact OE1-NH2 2.87Å; E20-R44 PolarHBondContact OE1-NH2 2.94Å
21	G	70.8	Confident	89.4	Confident	41 Å²	41	53.7 Å²	53.7	42%	0.423	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	-175.2	177.9	0	0	0	0	0	110.8	Y23 G24	G21-Y23 PolarHBondContact O-N 2.66Å; G21-Y23 VanDerWaalsContact O-N 3.15Å; G21-G24 PolarHBondContact N-O 3.1Å; G21-G24 PolarHBondContact O-N 3.47Å
22	T	69.8	Low	89.5	Confident	96 Å²	96	58.7 Å²	58.7	59%	0.589	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-38.5	-179.1	-49.3	0	0	0	0	112.4
23	Y	72.7	Confident	89.3	Confident	62 Å²	62	62.3 Å²	62.3	24%	0.243	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-8.5	-170.9	-54.2	-65.4	0	0	0	114.7	G21 I43 R44 L159	G21-Y23 PolarHBondContact O-N 2.66Å; G21-Y23 VanDerWaalsContact O-N 3.15Å; Y23-I43 WeakPolarHBondContact O-CA 3.38Å; Y23-R44 PolarHBondContact O-N 3.32Å; Y23-L159 HydrophobicContact CE2-CG 4.15Å; Y23-L159 WeakPolarHBondContact OH-CD2 3.31Å
24	G	82.8	Confident	89.2	Confident	2 Å²	2	62.8 Å²	62.8	2%	0.021	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.2	-178	-168.9	0	0	0	0	0	116.2	G21 K42	G21-G24 PolarHBondContact N-O 3.1Å; G21-G24 PolarHBondContact O-N 3.47Å; G24-K42 CarbonylContact C-O 3.59Å; G24-K42 WeakPolarHBondContact CA-O 3.2Å
25	V	90.1	Very high	89.2	Confident	16 Å²	16	60.1 Å²	60.1	10%	0.097	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	131.8	174.3	-171.2	0	0	0	0	108.9	K17 G19 E20 Y27 K42	K17-V25 HydrophobicContact CD-CG1 3.92Å; K17-V25 HydrophobicContact CG-CG1 3.78Å; G19-V25 WeakPolarHBondContact O-CG1 3.41Å; E20-V25 HydrophobicContact CG-CG2 4.2Å; V25-Y27 HydrophobicContact CB-CE2 3.69Å; V25-Y27 HydrophobicContact CG1-CD2 4.23Å; V25-Y27 HydrophobicContact CG1-CE1 3.89Å; V25-Y27 HydrophobicContact CG1-CE2 3.47Å; V25-Y27 VanDerWaalsContact CG1-CE2 3.47Å; V25-Y27 WeakPolarHBondContact CG1-OH 3.21Å; V25-K42 PolarHBondContact N-O 2.98Å; V25-K42 PolarHBondContact O-N 3.3Å
26	V	93.1	Very high	89.1	Confident	39 Å²	39	61.9 Å²	61.9	24%	0.236	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	131.6	179	-168.9	0	0	0	0	109.4	I18 G19 A39 L40 K41	I18-V26 HydrophobicContact CD1-CG1 3.8Å; I18-V26 HydrophobicContact CG1-CB 4.06Å; I18-V26 HydrophobicContact CG1-CG1 3.72Å; I18-V26 WeakPolarHBondContact CG1-O 3.12Å; I18-V26 PolarHBondContact N-O 3.15Å; G19-V26 PolarHBondContact N-O 3.46Å; G19-V26 PolarHBondContact O-N 3.29Å; V26-A39 HydrophobicContact CG1-CB 4.33Å; V26-L40 CarbonylContact C-O 3.58Å; V26-L40 WeakPolarHBondContact CA-O 3.21Å; V26-K41 HydrophobicContact CG2-CB 4.32Å; V26-K41 HydrophobicContact CG2-CG 4.08Å
27	Y	95.2	Very high	89.2	Confident	36 Å²	36	62.7 Å²	62.7	14%	0.141	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	142.9	177.1	-57.7	-86.7	0	0	0	110.4	K14 E16 K17 V25 A39 L40 K42	K14-Y27 HydrophobicContact CD-CD1 4.17Å; K14-Y27 HydrophobicContact CD-CE1 4.39Å; K14-Y27 HydrophobicContact CD-CG 4.23Å; K14-Y27 VanDerWaalsContact CE-CE2 3.46Å; K14-Y27 HydrophobicContact CG-CD1 4.13Å; K14-Y27 HydrophobicContact CG-CG 4.06Å; K14-Y27 PolarHBondContact NZ-OH 2.65Å; K14-Y27 VanDerWaalsContact NZ-OH 3.11Å; E16-Y27 CarbonylContact O-C 3.54Å; E16-Y27 WeakPolarHBondContact O-CA 3.4Å; E16-Y27 WeakPolarHBondContact O-CB 3.3Å; K17-Y27 HydrophobicContact CB-CD1 3.83Å; K17-Y27 HydrophobicContact CB-CE1 3.74Å; K17-Y27 HydrophobicContact CG-CD1 4.31Å; K17-Y27 HydrophobicContact CG-CE1 4Å; V25-Y27 HydrophobicContact CB-CE2 3.69Å; V25-Y27 HydrophobicContact CG1-CD2 4.23Å; V25-Y27 HydrophobicContact CG1-CE1 3.89Å; V25-Y27 HydrophobicContact CG1-CE2 3.47Å; V25-Y27 VanDerWaalsContact CG1-CE2 3.47Å; V25-Y27 WeakPolarHBondContact CG1-OH 3.21Å; Y27-A39 CarbonylContact O-C 3.49Å; Y27-A39 WeakPolarHBondContact O-CA 3.34Å; Y27-L40 PolarHBondContact N-O 3.22Å; Y27-L40 PolarHBondContact O-N 2.84Å; Y27-K42 HydrophobicContact CE2-CB 4.37Å
28	K	95.9	Very high	89.3	Confident	37 Å²	37	57.4 Å²	57.4	16%	0.161	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	132.8	157.7	-175.8	-179.4	-175.7	170.3	0	107.6	L15 E16 I18 Y37 Y91	L15-K28 WeakPolarHBondContact CA-O 3.49Å; L15-K28 WeakPolarHBondContact CB-O 3.47Å; L15-K28 HydrophobicContact CD1-CG 4.41Å; L15-K28 PolarHBondContact N-O 2.77Å; E16-K28 HydrophobicContact CG-CB 3.81Å; E16-K28 HydrophobicContact CG-CD 4.26Å; E16-K28 PolarHBondContact N-O 2.79Å; E16-K28 PolarHBondContact O-N 2.94Å; E16-K28 WeakPolarHBondContact OE1-CD 3.48Å; I18-K28 HydrophobicContact CD1-CB 4.47Å; I18-K28 HydrophobicContact CG2-CB 3.83Å; K28-Y37 HydrophobicContact CG-CD1 4.39Å; K28-Y91 HydrophobicContact CB-CE2 4.12Å; K28-Y91 HydrophobicContact CD-CE1 4.34Å; K28-Y91 HydrophobicContact CD-CE2 3.95Å; K28-Y91 HydrophobicContact CG-CD2 4.15Å; K28-Y91 HydrophobicContact CG-CE2 3.78Å
29	A	96.9	Very high	89.5	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	164.7	177.2	0	0	0	0	0	110.6	I12 Q13 Y37 V38 L40	I12-A29 HydrophobicContact CG2-CB 3.51Å; Q13-A29 CarbonylContact O-C 3.47Å; Q13-A29 WeakPolarHBondContact O-CA 3.33Å; Q13-A29 WeakPolarHBondContact O-CB 3.22Å; A29-Y37 CarbonylContact O-C 3.28Å; A29-Y37 VanDerWaalsContact O-CA 3.32Å; A29-Y37 WeakPolarHBondContact O-CA 3.28Å; A29-V38 HydrophobicContact CB-CG2 3.93Å; A29-V38 PolarHBondContact N-O 3.44Å; A29-V38 PolarHBondContact O-N 3.22Å; A29-L40 HydrophobicContact CB-CB 4.16Å
30	L	96.7	Very high	90	Very high	42 Å²	42	53.3 Å²	53.3	22%	0.22	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	123.9	175	178.4	72.9	0	0	0	108.4	Q13 L15 R32 G35 Y37	Q13-L30 HydrophobicContact CB-CB 4.37Å; Q13-L30 PolarHBondContact N-O 2.83Å; Q13-L30 PolarHBondContact O-N 2.79Å; L15-L30 HydrophobicContact CD1-CB 4.2Å; L30-R32 PolarHBondContact O-N 3.04Å; L30-G35 WeakPolarHBondContact CD1-O 3.36Å; L30-Y37 HydrophobicContact CB-CD1 4.45Å; L30-Y37 HydrophobicContact CD1-CD1 4.14Å; L30-Y37 HydrophobicContact CD1-CE1 4.13Å
31	S	95.4	Very high	90.5	Very high	9 Å²	9	48.9 Å²	48.9	6%	0.063	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	119.3	166.7	163.2	0	0	0	0	108.6	D11 S33 T34 G35 Q36	D11-S31 PolarHBondContact OD2-OG 3.5Å; S31-S33 PolarHBondContact OG-OG 3.05Å; S31-S33 VanDerWaalsContact OG-OG 3.12Å; S31-T34 WeakPolarHBondContact CB-OG1 3.43Å; S31-T34 PolarHBondContact OG-N 3.29Å; S31-T34 PolarHBondContact OG-OG1 3.34Å; S31-G35 VanDerWaalsContact O-CA 3.3Å; S31-G35 WeakPolarHBondContact O-CA 3.32Å; S31-G35 PolarHBondContact O-N 2.84Å; S31-Q36 PolarHBondContact N-O 3.2Å
32	R	93.9	Very high	91.5	Very high	147 Å²	147	50 Å²	50	56%	0.555	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-38.5	-177.1	-67.6	178.6	-174.7	-68.5	0.2	111.7	D11 L30	D11-R32 WeakPolarHBondContact O-CB 3.36Å; D11-R32 WeakPolarHBondContact O-CG 3.48Å; D11-R32 PolarHBondContact O-N 3.45Å; D11-R32 WeakPolarHBondContact OD1-CB 3.4Å; L30-R32 PolarHBondContact O-N 3.04Å
33	S	90.9	Very high	92.5	Very high	92 Å²	92	45.9 Å²	45.9	64%	0.643	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-38.1	-179.9	58.2	0	0	0	0	113.1	D11 S31	D11-S33 VanDerWaalsContact CG-OG 3.32Å; D11-S33 WeakPolarHBondContact OD1-CB 3.41Å; D11-S33 PolarHBondContact OD1-N 3.28Å; D11-S33 PolarHBondContact OD1-OG 3.22Å; D11-S33 PolarHBondContact OD2-OG 3.4Å; S31-S33 PolarHBondContact OG-OG 3.05Å; S31-S33 VanDerWaalsContact OG-OG 3.12Å
34	T	92.5	Very high	92.9	Very high	81 Å²	81	48.9 Å²	48.9	50%	0.497	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-19.7	-176.8	63.2	0	0	0	0	113.7	S31 Q36	S31-T34 WeakPolarHBondContact CB-OG1 3.43Å; S31-T34 PolarHBondContact OG-N 3.29Å; S31-T34 PolarHBondContact OG-OG1 3.34Å; T34-Q36 PolarHBondContact O-N 3.08Å; T34-Q36 PolarHBondContact OG1-N 3.41Å
35	G	93.9	Very high	92.7	Very high	53 Å²	53	51.1 Å²	51.1	55%	0.546	26%	0.259	S	S	.	.			trans	69	9.5	-170	0	0	0	0	0	113.9	L30 S31	L30-G35 WeakPolarHBondContact CD1-O 3.36Å; S31-G35 VanDerWaalsContact O-CA 3.3Å; S31-G35 WeakPolarHBondContact O-CA 3.32Å; S31-G35 PolarHBondContact O-N 2.84Å
36	Q	94.4	Very high	91.7	Very high	116 Å²	116	58.9 Å²	58.9	54%	0.542	30%	0.295	S	S	.	.			trans	-95.2	147.1	-177.1	-63.7	-168.2	-10.6	0	0	112.4	S31 T34	S31-Q36 PolarHBondContact N-O 3.2Å; T34-Q36 PolarHBondContact O-N 3.08Å; T34-Q36 PolarHBondContact OG1-N 3.41Å
37	Y	96.3	Very high	90.5	Very high	122 Å²	122	61.3 Å²	61.3	48%	0.478	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	139	170.2	-67.1	-63.4	0	0	0	110.6	L15 K28 A29 L30 Y91	L15-Y37 HydrophobicContact CD1-CD1 3.91Å; L15-Y37 HydrophobicContact CD1-CE1 3.55Å; K28-Y37 HydrophobicContact CG-CD1 4.39Å; A29-Y37 CarbonylContact O-C 3.28Å; A29-Y37 VanDerWaalsContact O-CA 3.32Å; A29-Y37 WeakPolarHBondContact O-CA 3.28Å; L30-Y37 HydrophobicContact CB-CD1 4.45Å; L30-Y37 HydrophobicContact CD1-CD1 4.14Å; L30-Y37 HydrophobicContact CD1-CE1 4.13Å; Y37-Y91 VanDerWaalsContact O-CB 3.29Å; Y37-Y91 WeakPolarHBondContact O-CB 3.45Å
38	V	96	Very high	89.1	Confident	2 Å²	2	67.2 Å²	67.2	1%	0.012	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	157.5	177.3	-60.3	0	0	0	0	110.4	I12 A29 I88 F89	I12-V38 HydrophobicContact CD1-CG2 4.41Å; I12-V38 HydrophobicContact CG2-CG2 4.49Å; A29-V38 HydrophobicContact CB-CG2 3.93Å; A29-V38 PolarHBondContact N-O 3.44Å; A29-V38 PolarHBondContact O-N 3.22Å; V38-I88 HydrophobicContact CB-CG2 3.75Å; V38-I88 HydrophobicContact CG1-CG2 3.97Å; V38-I88 HydrophobicContact CG2-CG2 3.93Å; V38-F89 WeakPolarHBondContact CA-O 3.24Å; V38-F89 WeakPolarHBondContact CB-O 3.25Å
39	A	95.8	Very high	87.8	Confident	13 Å²	13	74.6 Å²	74.6	11%	0.107	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	115.4	169.7	0	0	0	0	0	109.9	V26 Y27 F89 Y91	V26-A39 HydrophobicContact CG1-CB 4.33Å; Y27-A39 CarbonylContact O-C 3.49Å; Y27-A39 WeakPolarHBondContact O-CA 3.34Å; A39-F89 HydrophobicContact CB-CB 4.18Å; A39-F89 PolarHBondContact N-O 3.29Å; A39-F89 PolarHBondContact O-N 2.95Å; A39-Y91 HydrophobicContact CB-CD2 4.48Å
40	L	94.9	Very high	86.5	Confident	6 Å²	6	80.5 Å²	80.5	3%	0.031	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	104.1	179.3	174.9	74.1	0	0	0	109.7	L9 I12 V26 Y27 A29 Y86 I88	L9-L40 HydrophobicContact CD1-CD1 4.32Å; I12-L40 HydrophobicContact CG2-CD1 4.42Å; I12-L40 HydrophobicContact CG2-CD2 4.29Å; V26-L40 CarbonylContact C-O 3.58Å; V26-L40 WeakPolarHBondContact CA-O 3.21Å; Y27-L40 PolarHBondContact N-O 3.22Å; Y27-L40 PolarHBondContact O-N 2.84Å; A29-L40 HydrophobicContact CB-CB 4.16Å; L40-Y86 HydrophobicContact CD1-CD1 3.75Å; L40-Y86 HydrophobicContact CD1-CG 4.04Å; L40-Y86 HydrophobicContact CD2-CD1 4.39Å; L40-Y86 HydrophobicContact CG-CD1 4.16Å; L40-I88 HydrophobicContact CB-CD1 4.4Å; L40-I88 HydrophobicContact CD1-CD1 3.28Å; L40-I88 HydrophobicContact CG-CD1 4.44Å
41	K	92.6	Very high	85.5	Confident	15 Å²	15	80.3 Å²	80.3	7%	0.065	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	106.4	173.3	-172.6	179.6	-168.8	-175.2	0	109.2	V26 I43 E59 Y86 L87 F89 D156	V26-K41 HydrophobicContact CG2-CB 4.32Å; V26-K41 HydrophobicContact CG2-CG 4.08Å; K41-I43 HydrophobicContact CD-CD1 4.12Å; K41-I43 HydrophobicContact CG-CD1 4.04Å; K41-E59 VanDerWaalsContact NZ-CD 3.32Å; K41-E59 IonicContact NZ-OE1 2.63Å; K41-E59 PolarHBondContact NZ-OE1 3.37Å; K41-E59 IonicContact NZ-OE2 3.79Å; K41-E59 PolarHBondContact NZ-OE2 3.46Å; K41-Y86 WeakPolarHBondContact O-CA 3.36Å; K41-L87 HydrophobicContact CB-CB 4.28Å; K41-L87 HydrophobicContact CD-CD1 4.46Å; K41-L87 PolarHBondContact N-O 3.48Å; K41-L87 PolarHBondContact O-N 3.12Å; K41-F89 HydrophobicContact CB-CD2 4.39Å; K41-F89 HydrophobicContact CB-CE2 3.99Å; K41-F89 HydrophobicContact CD-CE2 4.11Å; K41-D156 IonicContact NZ-OD1 2.63Å; K41-D156 PolarHBondContact NZ-OD1 3.11Å
42	K	92.3	Very high	84.9	Confident	65 Å²	65	82.8 Å²	82.8	28%	0.283	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	115.8	170.5	-178.3	-179	-179.1	-177.4	0	108.9	G24 V25 Y27 Y86	G24-K42 CarbonylContact C-O 3.59Å; G24-K42 WeakPolarHBondContact CA-O 3.2Å; V25-K42 PolarHBondContact N-O 2.98Å; V25-K42 PolarHBondContact O-N 3.3Å; Y27-K42 HydrophobicContact CE2-CB 4.37Å; K42-Y86 HydrophobicContact CB-CD1 3.79Å; K42-Y86 HydrophobicContact CB-CE1 3.79Å; K42-Y86 HydrophobicContact CD-CE1 3.85Å; K42-Y86 HydrophobicContact CG-CD1 3.95Å; K42-Y86 HydrophobicContact CG-CE1 3.58Å
43	I	89.3	Confident	84.2	Confident	9 Å²	9	77.3 Å²	77.3	5%	0.046	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	136.9	178.5	-56.1	-59.2	0	0	0	109.8	Y23 K41 A56 L85 L87	Y23-I43 WeakPolarHBondContact O-CA 3.38Å; K41-I43 HydrophobicContact CD-CD1 4.12Å; K41-I43 HydrophobicContact CG-CD1 4.04Å; I43-A56 HydrophobicContact CG1-CB 4.48Å; I43-A56 HydrophobicContact CG2-CB 3.94Å; I43-L85 HydrophobicContact CB-CB 4.14Å; I43-L85 HydrophobicContact CB-CD2 4.29Å; I43-L85 HydrophobicContact CB-CG 4.28Å; I43-L85 HydrophobicContact CG1-CB 4.32Å; I43-L85 HydrophobicContact CG1-CD2 3.95Å; I43-L85 HydrophobicContact CG1-CG 3.93Å; I43-L85 HydrophobicContact CG2-CD2 4.47Å; I43-L85 PolarHBondContact N-O 3.22Å; I43-L87 HydrophobicContact CD1-CD1 4.02Å; I43-L87 HydrophobicContact CD1-CG 4.26Å; I43-L87 HydrophobicContact CG1-CD1 4.49Å; I43-L87 HydrophobicContact CG1-CG 4.27Å
44	R	82.2	Confident	83.7	Confident	125 Å²	125	76.7 Å²	76.7	47%	0.472	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-78	124	170.7	-75	172.2	-179.8	-158.5	1.2	109	E20 Y23	E20-R44 IonicContact OE1-CZ 3.74Å; E20-R44 IonicContact OE1-NH2 2.87Å; E20-R44 PolarHBondContact OE1-NH2 2.94Å; Y23-R44 PolarHBondContact O-N 3.32Å
45	L	78.1	Confident	82.9	Confident	48 Å²	48	75.2 Å²	75.2	25%	0.251	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-100.7	117.2	172.2	-60.7	169.7	0	0	0	106.2	P53 N83	L45-P53 HydrophobicContact CD2-CG 3.88Å; L45-N83 WeakPolarHBondContact CD1-O 3.15Å
46	E	69.8	Low	82.3	Confident	180 Å²	180	72.8 Å²	72.8	84%	0.841	37%	0.367	S	S	*	.	S	Bend	trans	-72.4	-38.5	-174.4	-68.7	178.6	177.4	0	0	111.2
47	N	67.7	Low	81.9	Confident	90 Å²	90	71.1 Å²	71.1	48%	0.481	36%	0.362	S	S	.	.			trans	-137.3	134.7	174.7	-67.2	-37.2	0	0	0	109.9	E49 D50	N47-E49 PolarHBondContact O-N 2.68Å; N47-D50 HydrophobicContact CB-CB 4.19Å; N47-D50 WeakPolarHBondContact CB-OD2 3.34Å; N47-D50 PolarHBondContact ND2-OD2 3.16Å; N47-D50 PolarHBondContact O-N 2.75Å
48	E	64.9	Low	81.3	Confident	159 Å²	159	69.3 Å²	69.3	74%	0.743	35%	0.354	S	S	*	.	S	Bend	trans	-64	-27.8	175.2	-70.2	-173.7	169.9	0	0	112.4
49	E	68.8	Low	80.7	Confident	193 Å²	193	69.4 Å²	69.4	90%	0.902	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-32	-180	-64.1	-172.1	169.4	0	0	113.5	N47 G51	N47-E49 PolarHBondContact O-N 2.68Å; E49-G51 PolarHBondContact O-N 2.84Å
50	D	70.3	Confident	80.4	Confident	123 Å²	123	69.6 Å²	69.6	66%	0.658	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-5.1	-177.4	-71.8	-36.9	0	0	0	112.8	N47	N47-D50 HydrophobicContact CB-CB 4.19Å; N47-D50 WeakPolarHBondContact CB-OD2 3.34Å; N47-D50 PolarHBondContact ND2-OD2 3.16Å; N47-D50 PolarHBondContact O-N 2.75Å
51	G	76.4	Confident	80.2	Confident	39 Å²	39	72.6 Å²	72.6	40%	0.402	37%	0.374	S	S	.	.			trans	65.3	-142.8	-178.4	0	0	0	0	0	112.8	E49 P53	E49-G51 PolarHBondContact O-N 2.84Å; G51-P53 WeakPolarHBondContact O-CD 3.32Å
52	I	81.1	Confident	80	Confident	61 Å²	61	72.5 Å²	72.5	31%	0.313	37%	0.374	S	S	.	.	S	Bend	trans	-78.2	126.3	-177.3	-51.8	176.5	0	0	0	110.2	S54 A56 L57 M80 L85	I52-S54 PolarHBondContact O-N 3.06Å; I52-A56 HydrophobicContact CG2-CB 4.1Å; I52-L57 HydrophobicContact CB-CD1 4.42Å; I52-L57 HydrophobicContact CB-CG 4.22Å; I52-L57 HydrophobicContact CD1-CD2 4.22Å; I52-L57 HydrophobicContact CG2-CD2 4.15Å; I52-L57 HydrophobicContact CG2-CG 3.81Å; I52-M80 HydrophobicContact CD1-CE 3.22Å; I52-M80 HydrophobicContact CG1-CE 3.5Å; I52-M80 VanDerWaalsContact CG1-CE 3.5Å; I52-L85 HydrophobicContact CG2-CD2 3.59Å
53	P	79.6	Confident	79.9	Confident	32 Å²	32	69.6 Å²	69.6	21%	0.208	36%	0.361	C	S	.	.			trans	-53.9	133.5	175.3	-26.3	30.9	0	0	0	111.7	L45 G51 T55 A56 L57	L45-P53 HydrophobicContact CD2-CG 3.88Å; G51-P53 WeakPolarHBondContact O-CD 3.32Å; P53-T55 WeakPolarHBondContact CB-OG1 3.07Å; P53-T55 PolarHBondContact O-N 3.18Å; P53-A56 HydrophobicContact CB-CB 4.41Å; P53-A56 WeakPolarHBondContact O-CB 3.36Å; P53-A56 PolarHBondContact O-N 3.15Å; P53-L57 PolarHBondContact O-N 2.55Å; P53-L57 VanDerWaalsContact O-N 3.15Å
54	S	80.3	Confident	80	Confident	79 Å²	79	73.3 Å²	73.3	55%	0.552	38%	0.379	S	S	*	.	H	α-helix	trans	-57.4	-23.8	176.5	67.5	0	0	0	0	113.4	I52 R58	I52-S54 PolarHBondContact O-N 3.06Å; S54-R58 VanDerWaalsContact O-CB 3.26Å; S54-R58 WeakPolarHBondContact O-CB 3.06Å; S54-R58 PolarHBondContact O-N 2.84Å; S54-R58 VanDerWaalsContact O-N 3.11Å
55	T	76.9	Confident	80.3	Confident	50 Å²	50	73.4 Å²	73.4	31%	0.307	38%	0.384	S	S	.	.	H	α-helix	trans	-66.8	-44.3	172.2	45.7	0	0	0	0	111.9	P53 R58 E59	P53-T55 WeakPolarHBondContact CB-OG1 3.07Å; P53-T55 PolarHBondContact O-N 3.18Å; T55-R58 PolarHBondContact O-N 2.89Å; T55-E59 PolarHBondContact O-N 2.85Å
56	A	81.3	Confident	81	Confident	2 Å²	2	71.2 Å²	71.2	2%	0.017	37%	0.373	C	S	.	.	H	α-helix	trans	-69.7	-43.7	179.5	0	0	0	0	0	111.8	I43 I52 P53 R58 E59 I60 L85	I43-A56 HydrophobicContact CG1-CB 4.48Å; I43-A56 HydrophobicContact CG2-CB 3.94Å; I52-A56 HydrophobicContact CG2-CB 4.1Å; P53-A56 HydrophobicContact CB-CB 4.41Å; P53-A56 WeakPolarHBondContact O-CB 3.36Å; P53-A56 PolarHBondContact O-N 3.15Å; A56-R58 VanDerWaalsContact C-N 3.28Å; A56-R58 PolarHBondContact O-N 3.12Å; A56-E59 PolarHBondContact O-N 2.92Å; A56-I60 VanDerWaalsContact O-CG1 3.3Å; A56-I60 WeakPolarHBondContact O-CG1 3.42Å; A56-I60 PolarHBondContact O-N 3.41Å; A56-L85 HydrophobicContact CB-CD2 3.74Å
57	L	84.6	Confident	82.1	Confident	81 Å²	81	66.8 Å²	66.8	42%	0.424	36%	0.355	S	S	.	.	H	α-helix	trans	-58.5	-42.2	172.9	-74.4	174.7	0	0	0	111.6	I52 P53 I60 C61	I52-L57 HydrophobicContact CB-CD1 4.42Å; I52-L57 HydrophobicContact CB-CG 4.22Å; I52-L57 HydrophobicContact CD1-CD2 4.22Å; I52-L57 HydrophobicContact CG2-CD2 4.15Å; I52-L57 HydrophobicContact CG2-CG 3.81Å; P53-L57 PolarHBondContact O-N 2.55Å; P53-L57 VanDerWaalsContact O-N 3.15Å; L57-I60 PolarHBondContact O-N 3.21Å; L57-C61 PolarHBondContact O-N 3Å; L57-C61 PolarHBondContact O-SG 2.75Å
58	R	84.4	Confident	83.1	Confident	83 Å²	83	64.8 Å²	64.8	31%	0.313	36%	0.356	S	S	.	.	H	α-helix	trans	-63.6	-46.1	176.1	-173.9	-178.6	-58.4	109.9	7.8	111.8	S54 T55 A56 I60 C61 L62	S54-R58 VanDerWaalsContact O-CB 3.26Å; S54-R58 WeakPolarHBondContact O-CB 3.06Å; S54-R58 PolarHBondContact O-N 2.84Å; S54-R58 VanDerWaalsContact O-N 3.11Å; T55-R58 PolarHBondContact O-N 2.89Å; A56-R58 VanDerWaalsContact C-N 3.28Å; A56-R58 PolarHBondContact O-N 3.12Å; R58-I60 VanDerWaalsContact C-N 3.31Å; R58-I60 PolarHBondContact O-N 3.47Å; R58-C61 PolarHBondContact O-N 3.21Å; R58-L62 HydrophobicContact CG-CD1 3.87Å; R58-L62 HydrophobicContact CG-CG 4.18Å; R58-L62 WeakPolarHBondContact O-CB 3.29Å; R58-L62 VanDerWaalsContact O-CG 3.25Å; R58-L62 WeakPolarHBondContact O-CG 3.32Å; R58-L62 PolarHBondContact O-N 3.09Å
59	E	83.7	Confident	84.5	Confident	5 Å²	5	57.6 Å²	57.6	2%	0.023	32%	0.322	C	S	.	.	H	α-helix	trans	-56.8	-46.6	177.4	-175.5	173.3	-171.9	0	0	110.5	K41 T55 A56 L62 L63 F157	K41-E59 VanDerWaalsContact NZ-CD 3.32Å; K41-E59 IonicContact NZ-OE1 2.63Å; K41-E59 PolarHBondContact NZ-OE1 3.37Å; K41-E59 IonicContact NZ-OE2 3.79Å; K41-E59 PolarHBondContact NZ-OE2 3.46Å; T55-E59 PolarHBondContact O-N 2.85Å; A56-E59 PolarHBondContact O-N 2.92Å; E59-L62 PolarHBondContact O-N 2.59Å; E59-L63 HydrophobicContact CG-CD1 3.76Å; E59-L63 WeakPolarHBondContact O-CB 3.16Å; E59-L63 WeakPolarHBondContact O-CD1 3.37Å; E59-L63 VanDerWaalsContact O-CG 3.31Å; E59-L63 WeakPolarHBondContact O-CG 3.43Å; E59-L63 PolarHBondContact O-N 2.73Å; E59-F157 HydrophobicContact CG-CB 4.34Å
60	I	89.2	Confident	85.7	Confident	16 Å²	16	49.3 Å²	49.3	8%	0.082	29%	0.285	C	S	.	.	H	α-helix	trans	-58.2	-52.9	176	-66.1	161	0	0	0	111.4	A56 L57 R58 L62 L63 Q64 L75 V78 L85 L87	A56-I60 VanDerWaalsContact O-CG1 3.3Å; A56-I60 WeakPolarHBondContact O-CG1 3.42Å; A56-I60 PolarHBondContact O-N 3.41Å; L57-I60 PolarHBondContact O-N 3.21Å; R58-I60 VanDerWaalsContact C-N 3.31Å; R58-I60 PolarHBondContact O-N 3.47Å; I60-L62 VanDerWaalsContact C-N 3.33Å; I60-L62 PolarHBondContact O-N 3.18Å; I60-L63 PolarHBondContact O-N 2.75Å; I60-Q64 HydrophobicContact CG2-CG 4.48Å; I60-Q64 VanDerWaalsContact O-CG 3.32Å; I60-Q64 WeakPolarHBondContact O-CG 3.29Å; I60-Q64 PolarHBondContact O-N 2.89Å; I60-L75 HydrophobicContact CG2-CD2 4.22Å; I60-V78 HydrophobicContact CD1-CG1 3.99Å; I60-V78 HydrophobicContact CD1-CG2 4.27Å; I60-V78 HydrophobicContact CG1-CG2 4.14Å; I60-V78 HydrophobicContact CG2-CG2 3.99Å; I60-L85 HydrophobicContact CD1-CD1 4.42Å; I60-L85 HydrophobicContact CD1-CD2 4.17Å; I60-L87 HydrophobicContact CD1-CD2 3.82Å; I60-L87 HydrophobicContact CG1-CD1 4.44Å; I60-L87 HydrophobicContact CG1-CD2 3.58Å
61	C	90.1	Very high	86.9	Confident	69 Å²	69	43.4 Å²	43.4	47%	0.466	25%	0.254	S	S	.	.	H	α-helix	trans	-61.9	-41.4	-178.1	-65.7	0	0	0	0	112.1	L57 R58 Q64 E65	L57-C61 PolarHBondContact O-N 3Å; L57-C61 PolarHBondContact O-SG 2.75Å; R58-C61 PolarHBondContact O-N 3.21Å; C61-Q64 PolarHBondContact O-N 3.4Å; C61-E65 WeakPolarHBondContact O-CG 3.4Å; C61-E65 PolarHBondContact O-N 2.87Å; C61-E65 VanDerWaalsContact O-N 3.12Å
62	L	89.8	Confident	87.8	Confident	13 Å²	13	41.8 Å²	41.8	7%	0.068	24%	0.236	C	C	.	.	H	α-helix	trans	-65.6	-43	178.1	-69.1	176.9	0	0	0	111.4	R58 E59 I60 Q64 E65 L66 I134 A160	R58-L62 HydrophobicContact CG-CD1 3.87Å; R58-L62 HydrophobicContact CG-CG 4.18Å; R58-L62 WeakPolarHBondContact O-CB 3.29Å; R58-L62 VanDerWaalsContact O-CG 3.25Å; R58-L62 WeakPolarHBondContact O-CG 3.32Å; R58-L62 PolarHBondContact O-N 3.09Å; E59-L62 PolarHBondContact O-N 2.59Å; I60-L62 VanDerWaalsContact C-N 3.33Å; I60-L62 PolarHBondContact O-N 3.18Å; L62-Q64 VanDerWaalsContact C-N 3.32Å; L62-Q64 PolarHBondContact O-N 2.78Å; L62-E65 PolarHBondContact O-N 2.85Å; L62-L66 WeakPolarHBondContact O-CB 3.3Å; L62-L66 WeakPolarHBondContact O-CG 3.42Å; L62-L66 PolarHBondContact O-N 2.83Å; L62-I134 HydrophobicContact CD1-CG2 4.49Å; L62-I134 HydrophobicContact CD2-CD1 3.71Å; L62-I134 HydrophobicContact CD2-CG1 3.82Å; L62-I134 HydrophobicContact CD2-CG2 4.23Å; L62-A160 HydrophobicContact CD1-CB 3.74Å; L62-A160 WeakPolarHBondContact CD1-O 3.46Å
63	L	90.2	Very high	88.4	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-65.6	-35.7	178	-75.2	163.7	0	0	0	112.4	E59 I60 L66 D67 V73 L75 F89 F157	E59-L63 HydrophobicContact CG-CD1 3.76Å; E59-L63 WeakPolarHBondContact O-CB 3.16Å; E59-L63 WeakPolarHBondContact O-CD1 3.37Å; E59-L63 VanDerWaalsContact O-CG 3.31Å; E59-L63 WeakPolarHBondContact O-CG 3.43Å; E59-L63 PolarHBondContact O-N 2.73Å; I60-L63 PolarHBondContact O-N 2.75Å; L63-L66 CarbonylContact O-C 3.46Å; L63-L66 PolarHBondContact O-N 2.85Å; L63-D67 PolarHBondContact O-N 2.93Å; L63-D67 VanDerWaalsContact O-N 3.08Å; L63-V73 HydrophobicContact CD2-CG1 4.32Å; L63-L75 HydrophobicContact CB-CB 4.01Å; L63-L75 HydrophobicContact CB-CD2 4.02Å; L63-L75 HydrophobicContact CD1-CB 4.3Å; L63-L75 HydrophobicContact CD1-CD2 4.25Å; L63-F89 HydrophobicContact CD1-CE1 3.5Å; L63-F89 VanDerWaalsContact CD1-CE1 3.5Å; L63-F89 HydrophobicContact CD1-CZ 3.71Å; L63-F89 HydrophobicContact CD2-CE1 4.32Å; L63-F157 HydrophobicContact CD2-CB 4.42Å; L63-F157 HydrophobicContact CD2-CD2 3.71Å; L63-F157 HydrophobicContact CD2-CE2 4.23Å; L63-F157 HydrophobicContact CD2-CG 4.17Å; L63-F157 HydrophobicContact CG-CB 4.45Å
64	Q	90.2	Very high	89.1	Confident	87 Å²	87	42.1 Å²	42.1	41%	0.407	23%	0.232	S	C	.	.	H	α-helix	trans	-61.5	-44.3	172.4	-74.2	173.2	-17.2	0	0	111.9	L3 I60 C61 L62 L66 D67	L3-Q64 HydrophobicContact CD1-CG 3.54Å; I60-Q64 HydrophobicContact CG2-CG 4.48Å; I60-Q64 VanDerWaalsContact O-CG 3.32Å; I60-Q64 WeakPolarHBondContact O-CG 3.29Å; I60-Q64 PolarHBondContact O-N 2.89Å; C61-Q64 PolarHBondContact O-N 3.4Å; L62-Q64 VanDerWaalsContact C-N 3.32Å; L62-Q64 PolarHBondContact O-N 2.78Å; Q64-L66 PolarHBondContact O-N 3.17Å; Q64-D67 WeakPolarHBondContact O-CB 3.42Å; Q64-D67 PolarHBondContact O-N 3.39Å
65	E	90.2	Very high	89.8	Confident	127 Å²	127	38.9 Å²	38.9	59%	0.593	21%	0.208	S	C	*	.	H	α-helix	trans	-66.5	-24.2	175.9	-72.4	-66.6	150.8	0	0	113.3	C61 L62 R132 I134	C61-E65 WeakPolarHBondContact O-CG 3.4Å; C61-E65 PolarHBondContact O-N 2.87Å; C61-E65 VanDerWaalsContact O-N 3.12Å; L62-E65 PolarHBondContact O-N 2.85Å; E65-R132 WeakPolarHBondContact O-CD 3.44Å; E65-R132 PolarHBondContact O-NE 2.89Å; E65-I134 HydrophobicContact CB-CD1 4.45Å
66	L	92.6	Very high	90.5	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.01	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	1.1	179.9	-65.7	173.8	0	0	0	113.8	L62 L63 Q64 V72 F128 C129 I134 F157	L62-L66 WeakPolarHBondContact O-CB 3.3Å; L62-L66 WeakPolarHBondContact O-CG 3.42Å; L62-L66 PolarHBondContact O-N 2.83Å; L63-L66 CarbonylContact O-C 3.46Å; L63-L66 PolarHBondContact O-N 2.85Å; Q64-L66 PolarHBondContact O-N 3.17Å; L66-V72 HydrophobicContact CB-CG1 4.08Å; L66-V72 HydrophobicContact CD1-CG1 4.45Å; L66-F128 HydrophobicContact CB-CE1 4.41Å; L66-F128 HydrophobicContact CD2-CD1 3.85Å; L66-F128 HydrophobicContact CD2-CE1 3.99Å; L66-F128 WeakPolarHBondContact O-CE1 3.49Å; L66-C129 HydrophobicContact CD2-CB 4.23Å; L66-I134 HydrophobicContact CD1-CD1 4.2Å; L66-I134 HydrophobicContact CD1-CG2 4.36Å; L66-I134 HydrophobicContact CD2-CD1 3.82Å; L66-I134 HydrophobicContact CG-CD1 3.87Å; L66-F157 HydrophobicContact CD1-CD1 3.76Å; L66-F157 HydrophobicContact CD1-CE1 3.29Å; L66-F157 HydrophobicContact CD1-CZ 3.78Å
67	D	91.4	Very high	91	Very high	87 Å²	87	41.6 Å²	41.6	47%	0.465	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	150.3	-176.7	-171.5	32.7	0	0	0	112.3	L63 Q64 H69	L63-D67 PolarHBondContact O-N 2.93Å; L63-D67 VanDerWaalsContact O-N 3.08Å; Q64-D67 WeakPolarHBondContact O-CB 3.42Å; Q64-D67 PolarHBondContact O-N 3.39Å; D67-H69 PolarHBondContact O-N 3.26Å
68	G	89.9	Confident	91.4	Very high	48 Å²	48	38 Å²	38	50%	0.495	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.7	-9.1	176.7	0	0	0	0	0	115.6	R311	G68-R311 PolarHBondContact O-NH2 3.25Å
69	H	94	Very high	91.7	Very high	9 Å²	9	34.1 Å²	34.1	4%	0.042	18%	0.184	C	C	.	.			trans	-77.7	131.3	176	-164.2	-84	0	0	0	112	D67 N71 V72 D124 F128	D67-H69 PolarHBondContact O-N 3.26Å; H69-N71 PolarHBondContact CE1-OD1 3.49Å; H69-N71 PolarHBondContact ND1-N 3.43Å; H69-N71 PolarHBondContact O-N 3.13Å; H69-V72 HydrophobicContact CB-CB 4.21Å; H69-V72 HydrophobicContact CB-CG2 4.01Å; H69-V72 PolarHBondContact O-N 2.78Å; H69-D124 IonicContact CE1-OD2 2.83Å; H69-D124 PolarHBondContact CE1-OD2 3.42Å; H69-D124 IonicContact NE2-OD2 2.93Å; H69-D124 PolarHBondContact NE2-OD2 2.91Å; H69-F128 HydrophobicContact CB-CD1 3.67Å; H69-F128 HydrophobicContact CB-CD2 4.49Å; H69-F128 HydrophobicContact CB-CE1 3.66Å; H69-F128 HydrophobicContact CB-CE2 4.46Å; H69-F128 HydrophobicContact CB-CG 4.09Å; H69-F128 HydrophobicContact CB-CZ 4.06Å; H69-F128 VanDerWaalsContact CD2-CB 3.44Å; H69-F128 WeakPolarHBondContact CD2-CB 3.21Å; H69-F128 AromaticContact CD2-CD1 3.81Å; H69-F128 AromaticContact CD2-CD2 3.4Å; H69-F128 WeakPolarHBondContact CD2-CD2 3.48Å; H69-F128 AromaticContact CD2-CE2 3.96Å; H69-F128 AromaticContact CD2-CG 3.29Å; H69-F128 WeakPolarHBondContact CD2-CG 3.47Å; H69-F128 AromaticContact CG-CD1 3.83Å; H69-F128 AromaticContact CG-CG 3.78Å
70	P	93.3	Very high	91.8	Very high	18 Å²	18	36.3 Å²	36.3	12%	0.117	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-29	-176.2	23	-33.7	0	0	0	113.6	K153 Y308	P70-K153 WeakPolarHBondContact O-CD 3.3Å; P70-K153 WeakPolarHBondContact O-CE 3.45Å; P70-K153 WeakPolarHBondContact O-CG 3.48Å; P70-Y308 HydrophobicContact CG-CE2 4.42Å
71	N	95.2	Very high	91.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	20.7	-178.7	-48.9	104.1	0	0	0	114.4	H69 Q121 I152 K153 L154 Y308	H69-N71 PolarHBondContact CE1-OD1 3.49Å; H69-N71 PolarHBondContact ND1-N 3.43Å; H69-N71 PolarHBondContact O-N 3.13Å; N71-Q121 VanDerWaalsContact CB-O 3.3Å; N71-Q121 WeakPolarHBondContact CB-O 3.47Å; N71-Q121 WeakPolarHBondContact ND2-CB 3.46Å; N71-Q121 PolarHBondContact ND2-OE1 2.79Å; N71-I152 WeakPolarHBondContact CA-O 3.34Å; N71-I152 WeakPolarHBondContact CB-O 3.43Å; N71-I152 PolarHBondContact ND2-O 3.24Å; N71-K153 WeakPolarHBondContact O-CA 3.41Å; N71-L154 WeakPolarHBondContact O-CG 3.5Å; N71-L154 PolarHBondContact O-N 2.95Å; N71-Y308 PolarHBondContact OD1-OH 3.25Å
72	V	95.7	Very high	91.2	Very high	4 Å²	4	42 Å²	42	2%	0.024	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-122.8	136	168.6	-179.3	0	0	0	0	107.6	L66 H69 K74 L154 F157	L66-V72 HydrophobicContact CB-CG1 4.08Å; L66-V72 HydrophobicContact CD1-CG1 4.45Å; H69-V72 HydrophobicContact CB-CB 4.21Å; H69-V72 HydrophobicContact CB-CG2 4.01Å; H69-V72 PolarHBondContact O-N 2.78Å; V72-K74 PolarHBondContact O-N 2.87Å; V72-L154 HydrophobicContact CG2-CD1 4.48Å; V72-F157 HydrophobicContact CG1-CE2 3.77Å; V72-F157 HydrophobicContact CG1-CZ 3.78Å
73	V	95	Very high	90.7	Very high	7 Å²	7	46.2 Å²	46.2	4%	0.042	24%	0.237	C	C	.	.			trans	-61.9	131.9	178.8	71.8	0	0	0	0	110.3	L63 F89 E90 L92 L154 A155	L63-V73 HydrophobicContact CD2-CG1 4.32Å; V73-F89 HydrophobicContact CG1-CD1 3.95Å; V73-F89 HydrophobicContact CG1-CE1 4.11Å; V73-F89 HydrophobicContact CG2-CB 4.19Å; V73-F89 HydrophobicContact CG2-CD1 4.03Å; V73-E90 HydrophobicContact CG2-CG 3.8Å; V73-L92 HydrophobicContact CG2-CD1 4.21Å; V73-L154 WeakPolarHBondContact CB-O 3.47Å; V73-L154 WeakPolarHBondContact CG1-O 3.4Å; V73-L154 PolarHBondContact N-O 3.27Å; V73-A155 HydrophobicContact CB-CB 4.28Å; V73-A155 HydrophobicContact CG1-CB 4.04Å
74	K	93.9	Very high	90.5	Very high	94 Å²	94	51.2 Å²	51.2	41%	0.409	26%	0.256	S	S	.	.			trans	-79.2	125.2	179.1	-172.6	179	-178.8	-170.6	0	110.9	V72 E76 F89 E90	V72-K74 PolarHBondContact O-N 2.87Å; K74-E76 HydrophobicContact CD-CG 4.33Å; K74-E76 HydrophobicContact CG-CG 4.31Å; K74-E76 PolarHBondContact O-N 2.82Å; K74-F89 VanDerWaalsContact O-CA 3.29Å; K74-F89 WeakPolarHBondContact O-CA 3.49Å; K74-F89 WeakPolarHBondContact O-CD1 3.29Å; K74-E90 HydrophobicContact CB-CB 4.45Å; K74-E90 HydrophobicContact CB-CG 4.07Å; K74-E90 WeakPolarHBondContact CB-OE1 3.05Å; K74-E90 PolarHBondContact N-OE1 3.41Å; K74-E90 PolarHBondContact O-N 2.84Å
75	L	94.2	Very high	90.5	Very high	10 Å²	10	47.2 Å²	47.2	5%	0.052	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	106.6	163.6	178.7	66.3	0	0	0	108.1	I60 L63 V78 L87 F89	I60-L75 HydrophobicContact CG2-CD2 4.22Å; L63-L75 HydrophobicContact CB-CB 4.01Å; L63-L75 HydrophobicContact CB-CD2 4.02Å; L63-L75 HydrophobicContact CD1-CB 4.3Å; L63-L75 HydrophobicContact CD1-CD2 4.25Å; L75-V78 HydrophobicContact CD1-CG2 4.46Å; L75-V78 HydrophobicContact CD2-CG2 4.01Å; L75-V78 HydrophobicContact CG-CG2 4.48Å; L75-L87 HydrophobicContact CD1-CB 3.85Å; L75-L87 HydrophobicContact CD1-CD2 4.35Å; L75-F89 HydrophobicContact CB-CD1 4.35Å; L75-F89 HydrophobicContact CB-CE1 4.17Å; L75-F89 HydrophobicContact CD1-CD1 4.28Å; L75-F89 HydrophobicContact CD1-CE1 3.97Å; L75-F89 HydrophobicContact CD1-CE2 4.34Å; L75-F89 HydrophobicContact CD1-CZ 3.99Å
76	E	92.7	Very high	90.6	Very high	70 Å²	70	42 Å²	42	33%	0.327	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-37.6	-177.2	-59.8	-162.6	146.5	0	0	112.3	L3 K74 I88	L3-E76 WeakPolarHBondContact CD2-O 3.45Å; K74-E76 HydrophobicContact CD-CG 4.33Å; K74-E76 HydrophobicContact CG-CG 4.31Å; K74-E76 PolarHBondContact O-N 2.82Å; E76-I88 HydrophobicContact CB-CG2 4.36Å; E76-I88 PolarHBondContact N-O 2.93Å
77	Q	91.7	Very high	90.6	Very high	39 Å²	39	41.9 Å²	41.9	18%	0.182	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	151.8	-173.9	-162.2	178.6	-0.2	0	0	112.3	L3 I79 I88	L3-Q77 WeakPolarHBondContact O-CG 3.18Å; Q77-I79 HydrophobicContact CG-CG1 4.18Å; Q77-I88 HydrophobicContact CB-CB 3.88Å; Q77-I88 HydrophobicContact CB-CG1 3.92Å; Q77-I88 PolarHBondContact N-O 2.96Å; Q77-I88 PolarHBondContact O-N 3.43Å
78	V	92.4	Very high	90.7	Very high	7 Å²	7	37.9 Å²	37.9	4%	0.042	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	123.4	169	-177.7	0	0	0	0	108	L3 V4 N5 I60 L75 L85 L87	L3-V78 PolarHBondContact O-N 3.32Å; V4-V78 WeakPolarHBondContact CA-O 3.2Å; V4-V78 HydrophobicContact CG2-CB 4.47Å; N5-V78 PolarHBondContact N-O 3.49Å; I60-V78 HydrophobicContact CD1-CG1 3.99Å; I60-V78 HydrophobicContact CD1-CG2 4.27Å; I60-V78 HydrophobicContact CG1-CG2 4.14Å; I60-V78 HydrophobicContact CG2-CG2 3.99Å; L75-V78 HydrophobicContact CD1-CG2 4.46Å; L75-V78 HydrophobicContact CD2-CG2 4.01Å; L75-V78 HydrophobicContact CG-CG2 4.48Å; V78-L85 HydrophobicContact CG1-CD1 3.48Å; V78-L85 VanDerWaalsContact CG1-CD1 3.48Å; V78-L87 HydrophobicContact CB-CD2 4.45Å; V78-L87 HydrophobicContact CG1-CD2 4.04Å; V78-L87 HydrophobicContact CG2-CD2 3.95Å
79	I	91	Very high	90.9	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.6	179.3	-53.4	176.5	0	0	0	108.2	A8 L9 I12 Q77 Y86 I88	A8-I79 HydrophobicContact CB-CD1 3.88Å; A8-I79 HydrophobicContact CB-CG1 4.09Å; L9-I79 HydrophobicContact CB-CG2 4.31Å; L9-I79 HydrophobicContact CD1-CD1 4.37Å; I12-I79 HydrophobicContact CG1-CD1 4.08Å; Q77-I79 HydrophobicContact CG-CG1 4.18Å; I79-Y86 PolarHBondContact N-O 3.27Å; I79-Y86 PolarHBondContact O-N 3.03Å; I79-I88 HydrophobicContact CD1-CD1 3.9Å; I79-I88 HydrophobicContact CD1-CG1 3.81Å; I79-I88 HydrophobicContact CG1-CG1 4.18Å
80	M	86.5	Confident	90.9	Very high	52 Å²	52	37.9 Å²	37.9	26%	0.256	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	120	170.8	-175.1	64.4	78.6	0	0	108.6	I52 R84 L85	I52-M80 HydrophobicContact CD1-CE 3.22Å; I52-M80 HydrophobicContact CG1-CE 3.5Å; I52-M80 VanDerWaalsContact CG1-CE 3.5Å; M80-R84 WeakPolarHBondContact CA-O 3.43Å; M80-R84 VanDerWaalsContact SD-C 3.58Å; M80-R84 VanDerWaalsContact SD-O 3.36Å; M80-L85 HydrophobicContact CE-CB 3.97Å; M80-L85 HydrophobicContact CE-CD1 3.93Å; M80-L85 HydrophobicContact CE-CG 4.45Å; M80-L85 HydrophobicContact SD-CB 4.28Å
81	E	84.2	Confident	91	Very high	54 Å²	54	39.9 Å²	39.9	25%	0.252	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	132.4	178.8	-171.7	170.5	-147.8	0	0	110.2	L9 N83 R84	L9-E81 WeakPolarHBondContact CB-OE2 3.4Å; L9-E81 WeakPolarHBondContact CD2-OE2 2.9Å; E81-N83 VanDerWaalsContact C-N 3.34Å; E81-N83 PolarHBondContact O-N 3.48Å; E81-R84 PolarHBondContact N-O 3.38Å; E81-R84 WeakPolarHBondContact O-CA 3.19Å; E81-R84 VanDerWaalsContact O-CB 3.28Å; E81-R84 WeakPolarHBondContact O-CB 3.41Å; E81-R84 PolarHBondContact O-N 3Å
82	E	81.3	Confident	90.9	Very high	151 Å²	151	40.5 Å²	40.5	71%	0.706	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.5	50.4	179.1	-62.6	179.7	169.3	0	0	113.7	R84	E82-R84 PolarHBondContact O-N 3.23Å
83	N	79.8	Confident	90.6	Very high	101 Å²	101	42 Å²	42	54%	0.54	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	37.2	-174.4	-66.8	-17.1	0	0	0	112.7	L45 E81	L45-N83 WeakPolarHBondContact CD1-O 3.15Å; E81-N83 VanDerWaalsContact C-N 3.34Å; E81-N83 PolarHBondContact O-N 3.48Å
84	R	86.4	Confident	90.5	Very high	109 Å²	109	44 Å²	44	41%	0.411	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	127.2	172.5	-62.5	169	-179.9	168.8	4.6	109.4	M80 E81 E82 Y86	M80-R84 WeakPolarHBondContact CA-O 3.43Å; M80-R84 VanDerWaalsContact SD-C 3.58Å; M80-R84 VanDerWaalsContact SD-O 3.36Å; E81-R84 PolarHBondContact N-O 3.38Å; E81-R84 WeakPolarHBondContact O-CA 3.19Å; E81-R84 VanDerWaalsContact O-CB 3.28Å; E81-R84 WeakPolarHBondContact O-CB 3.41Å; E81-R84 PolarHBondContact O-N 3Å; E82-R84 PolarHBondContact O-N 3.23Å; R84-Y86 HydrophobicContact CB-CD2 4.39Å; R84-Y86 HydrophobicContact CB-CE2 3.55Å; R84-Y86 WeakPolarHBondContact CD-OH 3.47Å
85	L	89.6	Confident	90.5	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	128.7	176.6	178.5	62.7	0	0	0	110.4	I43 I52 A56 I60 V78 M80 L87	I43-L85 HydrophobicContact CB-CB 4.14Å; I43-L85 HydrophobicContact CB-CD2 4.29Å; I43-L85 HydrophobicContact CB-CG 4.28Å; I43-L85 HydrophobicContact CG1-CB 4.32Å; I43-L85 HydrophobicContact CG1-CD2 3.95Å; I43-L85 HydrophobicContact CG1-CG 3.93Å; I43-L85 HydrophobicContact CG2-CD2 4.47Å; I43-L85 PolarHBondContact N-O 3.22Å; I52-L85 HydrophobicContact CG2-CD2 3.59Å; A56-L85 HydrophobicContact CB-CD2 3.74Å; I60-L85 HydrophobicContact CD1-CD1 4.42Å; I60-L85 HydrophobicContact CD1-CD2 4.17Å; V78-L85 HydrophobicContact CG1-CD1 3.48Å; V78-L85 VanDerWaalsContact CG1-CD1 3.48Å; M80-L85 HydrophobicContact CE-CB 3.97Å; M80-L85 HydrophobicContact CE-CD1 3.93Å; M80-L85 HydrophobicContact CE-CG 4.45Å; M80-L85 HydrophobicContact SD-CB 4.28Å; L85-L87 HydrophobicContact CD1-CD2 4.39Å; L85-L87 HydrophobicContact CG-CD2 4.48Å
86	Y	91.8	Very high	90.5	Very high	18 Å²	18	41 Å²	41	7%	0.071	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	138.2	173.9	-54	-93.4	0	0	0	110.5	L9 L40 K41 K42 I79 R84	L9-Y86 HydrophobicContact CD1-CD1 4.34Å; L9-Y86 HydrophobicContact CD1-CD2 4.07Å; L9-Y86 HydrophobicContact CD1-CE1 4.45Å; L9-Y86 HydrophobicContact CD1-CE2 4.18Å; L9-Y86 HydrophobicContact CD1-CG 4.14Å; L9-Y86 HydrophobicContact CD2-CE2 3.97Å; L40-Y86 HydrophobicContact CD1-CD1 3.75Å; L40-Y86 HydrophobicContact CD1-CG 4.04Å; L40-Y86 HydrophobicContact CD2-CD1 4.39Å; L40-Y86 HydrophobicContact CG-CD1 4.16Å; K41-Y86 WeakPolarHBondContact O-CA 3.36Å; K42-Y86 HydrophobicContact CB-CD1 3.79Å; K42-Y86 HydrophobicContact CB-CE1 3.79Å; K42-Y86 HydrophobicContact CD-CE1 3.85Å; K42-Y86 HydrophobicContact CG-CD1 3.95Å; K42-Y86 HydrophobicContact CG-CE1 3.58Å; I79-Y86 PolarHBondContact N-O 3.27Å; I79-Y86 PolarHBondContact O-N 3.03Å; R84-Y86 HydrophobicContact CB-CD2 4.39Å; R84-Y86 HydrophobicContact CB-CE2 3.55Å; R84-Y86 WeakPolarHBondContact CD-OH 3.47Å
87	L	92.4	Very high	90.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	127.5	171.7	-51.9	-176.6	0	0	0	108.6	K41 I43 I60 L75 V78 L85 F89	K41-L87 HydrophobicContact CB-CB 4.28Å; K41-L87 HydrophobicContact CD-CD1 4.46Å; K41-L87 PolarHBondContact N-O 3.48Å; K41-L87 PolarHBondContact O-N 3.12Å; I43-L87 HydrophobicContact CD1-CD1 4.02Å; I43-L87 HydrophobicContact CD1-CG 4.26Å; I43-L87 HydrophobicContact CG1-CD1 4.49Å; I43-L87 HydrophobicContact CG1-CG 4.27Å; I60-L87 HydrophobicContact CD1-CD2 3.82Å; I60-L87 HydrophobicContact CG1-CD1 4.44Å; I60-L87 HydrophobicContact CG1-CD2 3.58Å; L75-L87 HydrophobicContact CD1-CB 3.85Å; L75-L87 HydrophobicContact CD1-CD2 4.35Å; V78-L87 HydrophobicContact CB-CD2 4.45Å; V78-L87 HydrophobicContact CG1-CD2 4.04Å; V78-L87 HydrophobicContact CG2-CD2 3.95Å; L85-L87 HydrophobicContact CD1-CD2 4.39Å; L85-L87 HydrophobicContact CG-CD2 4.48Å; L87-F89 HydrophobicContact CB-CD2 4.13Å; L87-F89 HydrophobicContact CB-CE2 3.43Å; L87-F89 VanDerWaalsContact CB-CE2 3.43Å; L87-F89 HydrophobicContact CB-CZ 4.01Å; L87-F89 HydrophobicContact CD1-CE2 4.08Å; L87-F89 HydrophobicContact CD1-CZ 3.99Å; L87-F89 HydrophobicContact CG-CE2 4.4Å
88	I	93.8	Very high	90.6	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.015	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	119.2	175.8	-50.8	-62.5	0	0	0	108	I12 V38 L40 E76 Q77 I79	I12-I88 HydrophobicContact CD1-CD1 4.39Å; I12-I88 HydrophobicContact CG1-CD1 4.15Å; I12-I88 HydrophobicContact CG2-CD1 4.45Å; V38-I88 HydrophobicContact CB-CG2 3.75Å; V38-I88 HydrophobicContact CG1-CG2 3.97Å; V38-I88 HydrophobicContact CG2-CG2 3.93Å; L40-I88 HydrophobicContact CB-CD1 4.4Å; L40-I88 HydrophobicContact CD1-CD1 3.28Å; L40-I88 HydrophobicContact CG-CD1 4.44Å; E76-I88 HydrophobicContact CB-CG2 4.36Å; E76-I88 PolarHBondContact N-O 2.93Å; Q77-I88 HydrophobicContact CB-CB 3.88Å; Q77-I88 HydrophobicContact CB-CG1 3.92Å; Q77-I88 PolarHBondContact N-O 2.96Å; Q77-I88 PolarHBondContact O-N 3.43Å; I79-I88 HydrophobicContact CD1-CD1 3.9Å; I79-I88 HydrophobicContact CD1-CG1 3.81Å; I79-I88 HydrophobicContact CG1-CG1 4.18Å
89	F	94.7	Very high	90.6	Very high	19 Å²	19	46.4 Å²	46.4	8%	0.083	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	157.3	175.5	-63.8	-91.2	0	0	0	110.4	V38 A39 K41 L63 V73 K74 L75 L87	V38-F89 WeakPolarHBondContact CA-O 3.24Å; V38-F89 WeakPolarHBondContact CB-O 3.25Å; A39-F89 HydrophobicContact CB-CB 4.18Å; A39-F89 PolarHBondContact N-O 3.29Å; A39-F89 PolarHBondContact O-N 2.95Å; K41-F89 HydrophobicContact CB-CD2 4.39Å; K41-F89 HydrophobicContact CB-CE2 3.99Å; K41-F89 HydrophobicContact CD-CE2 4.11Å; L63-F89 HydrophobicContact CD1-CE1 3.5Å; L63-F89 VanDerWaalsContact CD1-CE1 3.5Å; L63-F89 HydrophobicContact CD1-CZ 3.71Å; L63-F89 HydrophobicContact CD2-CE1 4.32Å; V73-F89 HydrophobicContact CG1-CD1 3.95Å; V73-F89 HydrophobicContact CG1-CE1 4.11Å; V73-F89 HydrophobicContact CG2-CB 4.19Å; V73-F89 HydrophobicContact CG2-CD1 4.03Å; K74-F89 VanDerWaalsContact O-CA 3.29Å; K74-F89 WeakPolarHBondContact O-CA 3.49Å; K74-F89 WeakPolarHBondContact O-CD1 3.29Å; L75-F89 HydrophobicContact CB-CD1 4.35Å; L75-F89 HydrophobicContact CB-CE1 4.17Å; L75-F89 HydrophobicContact CD1-CD1 4.28Å; L75-F89 HydrophobicContact CD1-CE1 3.97Å; L75-F89 HydrophobicContact CD1-CE2 4.34Å; L75-F89 HydrophobicContact CD1-CZ 3.99Å; L87-F89 HydrophobicContact CB-CD2 4.13Å; L87-F89 HydrophobicContact CB-CE2 3.43Å; L87-F89 VanDerWaalsContact CB-CE2 3.43Å; L87-F89 HydrophobicContact CB-CZ 4.01Å; L87-F89 HydrophobicContact CD1-CE2 4.08Å; L87-F89 HydrophobicContact CD1-CZ 3.99Å; L87-F89 HydrophobicContact CG-CE2 4.4Å
90	E	94.3	Very high	90.7	Very high	38 Å²	38	46.6 Å²	46.6	18%	0.178	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.2	141.5	162.7	65.1	177.8	129.3	0	0	110.3	V73 K74 L92 K153	V73-E90 HydrophobicContact CG2-CG 3.8Å; K74-E90 HydrophobicContact CB-CB 4.45Å; K74-E90 HydrophobicContact CB-CG 4.07Å; K74-E90 WeakPolarHBondContact CB-OE1 3.05Å; K74-E90 PolarHBondContact N-OE1 3.41Å; K74-E90 PolarHBondContact O-N 2.84Å; E90-L92 HydrophobicContact CG-CD1 3.94Å; E90-K153 WeakPolarHBondContact OE1-CD 3.33Å; E90-K153 IonicContact OE1-NZ 3.46Å; E90-K153 PolarHBondContact OE1-NZ 3.33Å; E90-K153 WeakPolarHBondContact OE2-CE 3.38Å; E90-K153 IonicContact OE2-NZ 3.37Å; E90-K153 PolarHBondContact OE2-NZ 3.25Å
91	Y	94.8	Very high	90.9	Very high	60 Å²	60	48.7 Å²	48.7	24%	0.235	23%	0.226	C	C	.	.			trans	-91	128.7	177.9	179.5	-103.6	0	0	0	111.2	I18 K28 Y37 A39	I18-Y91 HydrophobicContact CD1-CE2 4.11Å; K28-Y91 HydrophobicContact CB-CE2 4.12Å; K28-Y91 HydrophobicContact CD-CE1 4.34Å; K28-Y91 HydrophobicContact CD-CE2 3.95Å; K28-Y91 HydrophobicContact CG-CD2 4.15Å; K28-Y91 HydrophobicContact CG-CE2 3.78Å; Y37-Y91 VanDerWaalsContact O-CB 3.29Å; Y37-Y91 WeakPolarHBondContact O-CB 3.45Å; A39-Y91 HydrophobicContact CB-CD2 4.48Å
92	L	93.9	Very high	91.2	Very high	13 Å²	13	51.6 Å²	51.6	7%	0.068	24%	0.241	C	C	.	.			trans	-112.4	146.6	168.9	-67.5	99.4	0	0	0	109.6	V73 E90 M94 L145 D147 K153	V73-L92 HydrophobicContact CG2-CD1 4.21Å; E90-L92 HydrophobicContact CG-CD1 3.94Å; L92-M94 PolarHBondContact O-N 2.91Å; L92-L145 HydrophobicContact CB-CB 3.79Å; L92-L145 HydrophobicContact CB-CD1 4.37Å; L92-L145 HydrophobicContact CD1-CB 3.93Å; L92-L145 HydrophobicContact CD1-CD1 3.83Å; L92-L145 HydrophobicContact CD2-CB 3.82Å; L92-L145 HydrophobicContact CG-CB 4.05Å; L92-D147 HydrophobicContact CD2-CB 4.26Å; L92-K153 HydrophobicContact CD1-CD 4.36Å; L92-K153 HydrophobicContact CD2-CB 4.28Å; L92-K153 HydrophobicContact CD2-CD 4.08Å; L92-K153 HydrophobicContact CD2-CG 3.94Å
93	S	88.1	Confident	91.5	Very high	35 Å²	35	45.6 Å²	45.6	25%	0.245	21%	0.214	C	C	.	.	S	Bend	trans	-73.2	-27.9	-165.9	56.1	0	0	0	0	113.8	I146	S93-I146 PolarHBondContact N-O 3.35Å; S93-I146 PolarHBondContact OG-O 3.19Å
94	M	92.6	Very high	91.9	Very high	49 Å²	49	44.3 Å²	44.3	24%	0.241	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	165.2	178.5	63.5	-171	77.1	0	0	112.7	L92 K98 Y99 M102 I146	L92-M94 PolarHBondContact O-N 2.91Å; M94-K98 HydrophobicContact CB-CD 4.24Å; M94-Y99 HydrophobicContact SD-CD2 3.61Å; M94-Y99 HydrophobicContact SD-CG 4.14Å; M94-M102 HydrophobicContact SD-SD 4.41Å; M94-I146 HydrophobicContact CG-CB 4.31Å; M94-I146 PolarHBondContact N-O 3.24Å; M94-I146 PolarHBondContact O-N 3.18Å
95	D	94.3	Very high	91.7	Very high	40 Å²	40	45.5 Å²	45.5	21%	0.214	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	162.6	166.1	63.3	80.6	0	0	0	111.7	R97 K98 Y99 L144 L145	D95-R97 VanDerWaalsContact C-N 3.25Å; D95-R97 PolarHBondContact O-N 3.32Å; D95-R97 WeakPolarHBondContact OD1-CA 3.17Å; D95-R97 WeakPolarHBondContact OD1-CB 3.41Å; D95-R97 PolarHBondContact OD1-N 3.47Å; D95-K98 PolarHBondContact O-N 2.99Å; D95-K98 PolarHBondContact OD1-N 3.36Å; D95-Y99 PolarHBondContact O-N 3.05Å; D95-L144 CarbonylContact C-O 3.59Å; D95-L144 VanDerWaalsContact CA-O 3.31Å; D95-L144 WeakPolarHBondContact CA-O 3.42Å; D95-L145 HydrophobicContact CB-CD2 3.98Å
96	L	94.4	Very high	91.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.1	-32	-178.8	177.8	64.9	0	0	0	112.2	Y99 M100 Y118 P141 L144 I146 I152 I203 M207	L96-Y99 HydrophobicContact CD1-CD1 4.44Å; L96-Y99 PolarHBondContact O-N 2.72Å; L96-M100 HydrophobicContact CD1-CG 4.21Å; L96-M100 HydrophobicContact CD1-SD 4.46Å; L96-M100 HydrophobicContact CG-CE 4.11Å; L96-M100 HydrophobicContact CG-SD 4.4Å; L96-M100 WeakPolarHBondContact O-CG 3.07Å; L96-M100 PolarHBondContact O-N 3.29Å; L96-Y118 HydrophobicContact CD1-CD2 4.1Å; L96-Y118 HydrophobicContact CD1-CE2 4.23Å; L96-P141 HydrophobicContact CB-CB 4.13Å; L96-P141 WeakPolarHBondContact CB-O 3.39Å; L96-P141 HydrophobicContact CD2-CB 4.21Å; L96-P141 HydrophobicContact CG-CB 4.17Å; L96-P141 PolarHBondContact N-O 3.08Å; L96-L144 HydrophobicContact CB-CB 3.96Å; L96-L144 HydrophobicContact CD2-CB 4.37Å; L96-L144 HydrophobicContact CD2-CD1 3.68Å; L96-L144 PolarHBondContact N-O 2.84Å; L96-I146 HydrophobicContact CB-CD1 3.87Å; L96-I146 HydrophobicContact CD1-CD1 3.68Å; L96-I146 HydrophobicContact CG-CD1 4.38Å; L96-I152 HydrophobicContact CD2-CD1 4.37Å; L96-I203 HydrophobicContact CD2-CG2 3.82Å; L96-M207 HydrophobicContact CD1-CG 4.28Å; L96-M207 HydrophobicContact CD1-SD 4.18Å; L96-M207 HydrophobicContact CD2-CG 3.96Å; L96-M207 HydrophobicContact CD2-SD 3.84Å
97	R	93.8	Very high	91	Very high	67 Å²	67	54.4 Å²	54.4	25%	0.253	30%	0.296	S	S	.	.	H	α-helix	trans	-63.5	-52.4	176.4	178.3	53.2	-179	-105.4	-8.4	110.1	D95 Y99 M100 D101 P141 Q142	D95-R97 VanDerWaalsContact C-N 3.25Å; D95-R97 PolarHBondContact O-N 3.32Å; D95-R97 WeakPolarHBondContact OD1-CA 3.17Å; D95-R97 WeakPolarHBondContact OD1-CB 3.41Å; D95-R97 PolarHBondContact OD1-N 3.47Å; R97-Y99 VanDerWaalsContact C-N 3.27Å; R97-Y99 PolarHBondContact O-N 2.99Å; R97-M100 PolarHBondContact O-N 2.96Å; R97-M100 VanDerWaalsContact O-N 3.17Å; R97-D101 IonicContact CZ-OD2 3.77Å; R97-D101 IonicContact NE-OD1 2.94Å; R97-D101 PolarHBondContact NE-OD1 3.37Å; R97-D101 IonicContact NE-OD2 3.41Å; R97-D101 PolarHBondContact NE-OD2 3.41Å; R97-D101 PolarHBondContact O-N 3.12Å; R97-P141 HydrophobicContact CB-CB 3.9Å; R97-P141 PolarHBondContact N-O 2.63Å; R97-Q142 HydrophobicContact CB-CG 4.09Å; R97-Q142 HydrophobicContact CG-CG 4.5Å
98	K	92.6	Very high	90.6	Very high	103 Å²	103	58.5 Å²	58.5	45%	0.448	32%	0.316	S	S	.	.	H	α-helix	trans	-58.4	-40.8	178.2	-167.8	-180	-170.2	-175.9	0	111.3	M94 D95 D101 M102	M94-K98 HydrophobicContact CB-CD 4.24Å; D95-K98 PolarHBondContact O-N 2.99Å; D95-K98 PolarHBondContact OD1-N 3.36Å; K98-D101 PolarHBondContact O-N 3.09Å; K98-M102 HydrophobicContact CD-CE 3.96Å; K98-M102 VanDerWaalsContact CE-CE 3.46Å; K98-M102 HydrophobicContact CG-CE 3.77Å; K98-M102 HydrophobicContact CG-SD 4.39Å; K98-M102 VanDerWaalsContact O-CG 3.28Å; K98-M102 WeakPolarHBondContact O-CG 3.36Å; K98-M102 PolarHBondContact O-N 3.38Å
99	Y	92.1	Very high	90.2	Very high	60 Å²	60	58.9 Å²	58.9	24%	0.235	32%	0.318	C	S	.	.	H	α-helix	trans	-61.3	-46.6	175.9	-175.6	-118.1	0	0	0	112.5	M94 D95 L96 R97 D101 M102 L109 L113 Y118 I146	M94-Y99 HydrophobicContact SD-CD2 3.61Å; M94-Y99 HydrophobicContact SD-CG 4.14Å; D95-Y99 PolarHBondContact O-N 3.05Å; L96-Y99 HydrophobicContact CD1-CD1 4.44Å; L96-Y99 PolarHBondContact O-N 2.72Å; R97-Y99 VanDerWaalsContact C-N 3.27Å; R97-Y99 PolarHBondContact O-N 2.99Å; Y99-D101 VanDerWaalsContact C-N 3.31Å; Y99-D101 PolarHBondContact O-N 3.22Å; Y99-M102 PolarHBondContact O-N 3.02Å; Y99-L109 HydrophobicContact CD1-CD2 3.91Å; Y99-L109 HydrophobicContact CE1-CD2 3.26Å; Y99-L113 HydrophobicContact CE1-CD2 4.1Å; Y99-L113 WeakPolarHBondContact OH-CD2 3.42Å; Y99-Y118 HydrophobicContact CD1-CE2 4.01Å; Y99-Y118 AromaticContact CE1-CE2 3.73Å; Y99-Y118 HydrophobicContact CE1-CE2 3.73Å; Y99-Y118 WeakPolarHBondContact CE1-OH 3.18Å; Y99-I146 HydrophobicContact CD1-CD1 4.08Å; Y99-I146 HydrophobicContact CG-CD1 4.18Å
100	M	92.5	Very high	89.7	Confident	4 Å²	4	62.6 Å²	62.6	2%	0.02	34%	0.338	C	S	.	.	H	α-helix	trans	-65.1	-33.7	176.8	-71	-173.2	-59	0	0	112.8	L96 R97 L109 P141 E206 M207 R210	L96-M100 HydrophobicContact CD1-CG 4.21Å; L96-M100 HydrophobicContact CD1-SD 4.46Å; L96-M100 HydrophobicContact CG-CE 4.11Å; L96-M100 HydrophobicContact CG-SD 4.4Å; L96-M100 WeakPolarHBondContact O-CG 3.07Å; L96-M100 PolarHBondContact O-N 3.29Å; R97-M100 PolarHBondContact O-N 2.96Å; R97-M100 VanDerWaalsContact O-N 3.17Å; M100-L109 HydrophobicContact CG-CD1 3.99Å; M100-L109 HydrophobicContact SD-CD1 4.36Å; M100-P141 HydrophobicContact CE-CB 3.82Å; M100-P141 HydrophobicContact CE-CG 3.93Å; M100-E206 HydrophobicContact CE-CG 3.93Å; M100-E206 HydrophobicContact SD-CG 4.18Å; M100-M207 HydrophobicContact SD-CG 4.15Å; M100-R210 PolarHBondContact O-NE 3.38Å; M100-R210 PolarHBondContact O-NH2 3.04Å
101	D	91.7	Very high	89.3	Confident	97 Å²	97	67.1 Å²	67.1	52%	0.519	36%	0.357	S	S	.	.	H	α-helix	trans	-73.6	-30.7	178.6	-70.7	-20.3	0	0	0	112.2	R97 K98 Y99 L103	R97-D101 IonicContact CZ-OD2 3.77Å; R97-D101 IonicContact NE-OD1 2.94Å; R97-D101 PolarHBondContact NE-OD1 3.37Å; R97-D101 IonicContact NE-OD2 3.41Å; R97-D101 PolarHBondContact NE-OD2 3.41Å; R97-D101 PolarHBondContact O-N 3.12Å; K98-D101 PolarHBondContact O-N 3.09Å; Y99-D101 VanDerWaalsContact C-N 3.31Å; Y99-D101 PolarHBondContact O-N 3.22Å; D101-L103 VanDerWaalsContact C-N 3.33Å; D101-L103 PolarHBondContact O-N 2.91Å
102	M	91.1	Very high	88.6	Confident	114 Å²	114	69.2 Å²	69.2	56%	0.562	37%	0.373	S	S	*	.	H	α-helix	trans	-72	-19.6	178	-77.4	174.6	173.3	0	0	114.6	M94 K98 Y99 S104	M94-M102 HydrophobicContact SD-SD 4.41Å; K98-M102 HydrophobicContact CD-CE 3.96Å; K98-M102 VanDerWaalsContact CE-CE 3.46Å; K98-M102 HydrophobicContact CG-CE 3.77Å; K98-M102 HydrophobicContact CG-SD 4.39Å; K98-M102 VanDerWaalsContact O-CG 3.28Å; K98-M102 WeakPolarHBondContact O-CG 3.36Å; K98-M102 PolarHBondContact O-N 3.38Å; Y99-M102 PolarHBondContact O-N 3.02Å; M102-S104 PolarHBondContact O-N 3.22Å
103	L	87.8	Confident	88.2	Confident	26 Å²	26	70.2 Å²	70.2	14%	0.136	38%	0.378	C	S	.	.	S	Bend	trans	-65.6	134.1	178.9	-66	173.9	0	0	0	110.8	D101 L109 R210	D101-L103 VanDerWaalsContact C-N 3.33Å; D101-L103 PolarHBondContact O-N 2.91Å; L103-L109 HydrophobicContact CD1-CD2 3.85Å; L103-L109 HydrophobicContact CD1-CG 3.76Å; L103-R210 PolarHBondContact O-NH1 3.19Å; L103-R210 PolarHBondContact O-NH2 3.07Å
104	S	86.7	Confident	88	Confident	74 Å²	74	68.8 Å²	68.8	52%	0.517	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-50.3	146.3	177.5	-48.9	0	0	0	0	111.8	M102 G106 K107 R210	M102-S104 PolarHBondContact O-N 3.22Å; S104-G106 PolarHBondContact O-N 2.7Å; S104-K107 WeakPolarHBondContact O-CB 3.3Å; S104-K107 PolarHBondContact O-N 2.94Å; S104-R210 PolarHBondContact O-NH1 3.36Å
105	P	83.8	Confident	87.4	Confident	133 Å²	133	68.2 Å²	68.2	86%	0.864	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	131.9	177.1	-27.4	35.1	0	0	0	111.8	K107	P105-K107 PolarHBondContact O-N 3.38Å
106	G	79.4	Confident	86.3	Confident	79 Å²	79	66.8 Å²	66.8	81%	0.814	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.3	-14.6	-178	0	0	0	0	0	115.6	S104	S104-G106 PolarHBondContact O-N 2.7Å
107	K	86.1	Confident	85.5	Confident	129 Å²	129	70.2 Å²	70.2	56%	0.561	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-76.8	126.2	173.2	-167.3	172.6	-178.4	178.9	0	109.7	S104 P105 R210	S104-K107 WeakPolarHBondContact O-CB 3.3Å; S104-K107 PolarHBondContact O-N 2.94Å; P105-K107 PolarHBondContact O-N 3.38Å; K107-R210 WeakPolarHBondContact O-CD 3.18Å; K107-R210 PolarHBondContact O-NH1 2.82Å
108	M	84.5	Confident	85.3	Confident	85 Å²	85	67.2 Å²	67.2	42%	0.419	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-93.1	162.9	172.7	-52.7	-160.4	91.1	0	0	110.4	A208	M108-A208 WeakPolarHBondContact CE-O 3.46Å
109	L	84.2	Confident	85.4	Confident	12 Å²	12	62.3 Å²	62.3	6%	0.063	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-62.2	142	164.9	-73.5	160.6	0	0	0	108.9	Y99 M100 L103 K111 L113 V114 Y118 M207	Y99-L109 HydrophobicContact CD1-CD2 3.91Å; Y99-L109 HydrophobicContact CE1-CD2 3.26Å; M100-L109 HydrophobicContact CG-CD1 3.99Å; M100-L109 HydrophobicContact SD-CD1 4.36Å; L103-L109 HydrophobicContact CD1-CD2 3.85Å; L103-L109 HydrophobicContact CD1-CG 3.76Å; L109-K111 PolarHBondContact O-N 3.02Å; L109-L113 HydrophobicContact CD2-CD2 3.82Å; L109-V114 HydrophobicContact CB-CG2 3.42Å; L109-V114 VanDerWaalsContact CB-CG2 3.42Å; L109-V114 HydrophobicContact CD1-CG2 4.13Å; L109-V114 HydrophobicContact CG-CG2 4.37Å; L109-Y118 HydrophobicContact CD2-CE2 4.38Å; L109-M207 HydrophobicContact CD1-CB 3.98Å; L109-M207 HydrophobicContact CD1-CG 4.28Å; L109-M207 WeakPolarHBondContact CD1-O 3.33Å
110	D	85.9	Confident	85.6	Confident	96 Å²	96	59.9 Å²	59.9	51%	0.513	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-58.2	137.9	172.1	176.2	-89.3	0	0	0	109.9	D112 L113 V114	D110-D112 VanDerWaalsContact C-N 3.28Å; D110-D112 PolarHBondContact O-N 3.23Å; D110-D112 WeakPolarHBondContact OD1-CA 3.09Å; D110-D112 VanDerWaalsContact OD1-CB 3.31Å; D110-D112 WeakPolarHBondContact OD1-CB 3.45Å; D110-D112 PolarHBondContact OD1-N 3.23Å; D110-L113 HydrophobicContact CB-CB 3.86Å; D110-L113 WeakPolarHBondContact O-CA 3.32Å; D110-L113 WeakPolarHBondContact O-CB 3.13Å; D110-L113 PolarHBondContact O-N 3.1Å; D110-L113 VanDerWaalsContact O-N 3.08Å; D110-L113 PolarHBondContact OD1-N 3.37Å; D110-V114 WeakPolarHBondContact O-CG2 3.26Å; D110-V114 PolarHBondContact O-N 3.27Å
111	K	85.4	Confident	85.7	Confident	133 Å²	133	59.7 Å²	59.7	58%	0.578	33%	0.328	S	S	*	.	H	α-helix	trans	-64.9	-36.2	-173.1	-65.6	-169.5	-174.2	-162.8	0	111.7	L109 V114 K115 S265	L109-K111 PolarHBondContact O-N 3.02Å; K111-V114 PolarHBondContact O-N 2.8Å; K111-K115 VanDerWaalsContact O-CB 3.25Å; K111-K115 WeakPolarHBondContact O-CB 3.38Å; K111-K115 PolarHBondContact O-N 2.79Å; K111-S265 WeakPolarHBondContact CE-O 3.3Å; K111-S265 PolarHBondContact NZ-O 3.39Å
112	D	80.8	Confident	85.9	Confident	105 Å²	105	55.2 Å²	55.2	56%	0.561	30%	0.304	S	S	*	.	H	α-helix	trans	-70.8	-36.8	175.1	-63.5	-35.2	0	0	0	109.7	D110 V114 K115 A116	D110-D112 VanDerWaalsContact C-N 3.28Å; D110-D112 PolarHBondContact O-N 3.23Å; D110-D112 WeakPolarHBondContact OD1-CA 3.09Å; D110-D112 VanDerWaalsContact OD1-CB 3.31Å; D110-D112 WeakPolarHBondContact OD1-CB 3.45Å; D110-D112 PolarHBondContact OD1-N 3.23Å; D112-V114 PolarHBondContact O-N 2.91Å; D112-K115 PolarHBondContact O-N 3.39Å; D112-A116 WeakPolarHBondContact O-CA 3.4Å; D112-A116 WeakPolarHBondContact O-CB 3.42Å; D112-A116 PolarHBondContact O-N 2.92Å
113	L	83.8	Confident	86.2	Confident	33 Å²	33	49.8 Å²	49.8	17%	0.173	28%	0.277	C	S	.	.	I	π-helix	trans	-58.8	-47.1	171.3	-165.4	75	0	0	0	112.7	Y99 L109 D110 Y117 Y118	Y99-L113 HydrophobicContact CE1-CD2 4.1Å; Y99-L113 WeakPolarHBondContact OH-CD2 3.42Å; L109-L113 HydrophobicContact CD2-CD2 3.82Å; D110-L113 HydrophobicContact CB-CB 3.86Å; D110-L113 WeakPolarHBondContact O-CA 3.32Å; D110-L113 WeakPolarHBondContact O-CB 3.13Å; D110-L113 PolarHBondContact O-N 3.1Å; D110-L113 VanDerWaalsContact O-N 3.08Å; D110-L113 PolarHBondContact OD1-N 3.37Å; L113-Y117 HydrophobicContact CD1-CD2 3.77Å; L113-Y117 HydrophobicContact CD1-CE2 4.5Å; L113-Y117 HydrophobicContact CD1-CG 3.8Å; L113-Y117 WeakPolarHBondContact O-CB 3.14Å; L113-Y117 PolarHBondContact O-N 2.97Å; L113-Y117 VanDerWaalsContact O-N 3.12Å; L113-Y118 HydrophobicContact CD2-CE2 3.98Å; L113-Y118 HydrophobicContact CG-CD2 4.45Å; L113-Y118 HydrophobicContact CG-CE2 3.98Å; L113-Y118 PolarHBondContact O-N 3.42Å
114	V	84.7	Confident	86.6	Confident	5 Å²	5	49.3 Å²	49.3	3%	0.03	28%	0.275	C	S	.	.	I	π-helix	trans	-62.3	-47.6	176.5	176.9	0	0	0	0	111.2	L109 D110 K111 D112 L119 F204 M207	L109-V114 HydrophobicContact CB-CG2 3.42Å; L109-V114 VanDerWaalsContact CB-CG2 3.42Å; L109-V114 HydrophobicContact CD1-CG2 4.13Å; L109-V114 HydrophobicContact CG-CG2 4.37Å; D110-V114 WeakPolarHBondContact O-CG2 3.26Å; D110-V114 PolarHBondContact O-N 3.27Å; K111-V114 PolarHBondContact O-N 2.8Å; D112-V114 PolarHBondContact O-N 2.91Å; V114-L119 VanDerWaalsContact O-CB 3.31Å; V114-L119 WeakPolarHBondContact O-CB 3.5Å; V114-L119 PolarHBondContact O-N 3.24Å; V114-F204 HydrophobicContact CG1-CD2 3.94Å; V114-F204 HydrophobicContact CG1-CE2 3.87Å; V114-M207 HydrophobicContact CG1-CB 3.97Å; V114-M207 HydrophobicContact CG1-CE 4.3Å; V114-M207 HydrophobicContact CG2-CB 4.21Å
115	K	80.5	Confident	87	Confident	37 Å²	37	45.8 Å²	45.8	16%	0.161	25%	0.25	C	S	.	.	I	π-helix	trans	-70	-63.7	-176.5	176.8	178.2	-75.6	-175.4	0	111.8	K111 D112 Y120 D267 Y296 F297	K111-K115 VanDerWaalsContact O-CB 3.25Å; K111-K115 WeakPolarHBondContact O-CB 3.38Å; K111-K115 PolarHBondContact O-N 2.79Å; D112-K115 PolarHBondContact O-N 3.39Å; K115-Y120 PolarHBondContact O-N 2.96Å; K115-D267 IonicContact NZ-OD2 3.51Å; K115-D267 PolarHBondContact NZ-OD2 2.9Å; K115-Y296 HydrophobicContact CB-CE1 3.87Å; K115-Y296 HydrophobicContact CD-CE1 4.22Å; K115-Y296 HydrophobicContact CD-CE2 4.43Å; K115-Y296 VanDerWaalsContact CD-O 3.24Å; K115-Y296 WeakPolarHBondContact CD-O 3.37Å; K115-Y296 VanDerWaalsContact CE-CD2 3.46Å; K115-Y296 WeakPolarHBondContact CE-O 3.38Å; K115-Y296 HydrophobicContact CG-CD1 4.07Å; K115-Y296 HydrophobicContact CG-CE1 3.61Å; K115-Y296 PolarHBondContact NZ-O 3.42Å; K115-F297 HydrophobicContact CG-CD1 4.19Å; K115-F297 HydrophobicContact CG-CE1 4.47Å; K115-F297 WeakPolarHBondContact O-CE1 3.35Å
116	A	70.3	Confident	87.7	Confident	10 Å²	10	39.5 Å²	39.5	8%	0.083	21%	0.209	C	C	.	.	I	π-helix	trans	-72.9	-53.5	-171.4	0	0	0	0	0	111.9	D112 L300 L305	D112-A116 WeakPolarHBondContact O-CA 3.4Å; D112-A116 WeakPolarHBondContact O-CB 3.42Å; D112-A116 PolarHBondContact O-N 2.92Å; A116-L300 HydrophobicContact CB-CD1 3.17Å; A116-L300 HydrophobicContact CB-CG 4.46Å; A116-L305 WeakPolarHBondContact O-CD2 3.36Å
117	Y	77	Confident	88.5	Confident	72 Å²	72	36.1 Å²	36.1	28%	0.282	17%	0.173	S	C	.	.	I	π-helix	trans	-83.6	-47.3	-168.3	-71.7	-91.5	0	0	0	111.1	L113 Q121 L305	L113-Y117 HydrophobicContact CD1-CD2 3.77Å; L113-Y117 HydrophobicContact CD1-CE2 4.5Å; L113-Y117 HydrophobicContact CD1-CG 3.8Å; L113-Y117 WeakPolarHBondContact O-CB 3.14Å; L113-Y117 PolarHBondContact O-N 2.97Å; L113-Y117 VanDerWaalsContact O-N 3.12Å; Y117-Q121 WeakPolarHBondContact O-CB 3.34Å; Y117-Q121 WeakPolarHBondContact O-CG 3.38Å; Y117-Q121 PolarHBondContact O-NE2 2.91Å; Y117-L305 HydrophobicContact CD1-CD2 4.21Å; Y117-L305 HydrophobicContact CE1-CD2 4.4Å
118	Y	90.8	Very high	89	Confident	5 Å²	5	31.3 Å²	31.3	2%	0.02	15%	0.152	C	C	.	.	I	π-helix	trans	-95.1	-55.2	-172.4	-59.5	-29.6	0	0	0	114.2	L96 Y99 L109 L113 Y120 Q121 I122 I146 I152 M207	L96-Y118 HydrophobicContact CD1-CD2 4.1Å; L96-Y118 HydrophobicContact CD1-CE2 4.23Å; Y99-Y118 HydrophobicContact CD1-CE2 4.01Å; Y99-Y118 AromaticContact CE1-CE2 3.73Å; Y99-Y118 HydrophobicContact CE1-CE2 3.73Å; Y99-Y118 WeakPolarHBondContact CE1-OH 3.18Å; L109-Y118 HydrophobicContact CD2-CE2 4.38Å; L113-Y118 HydrophobicContact CD2-CE2 3.98Å; L113-Y118 HydrophobicContact CG-CD2 4.45Å; L113-Y118 HydrophobicContact CG-CE2 3.98Å; L113-Y118 PolarHBondContact O-N 3.42Å; Y118-Y120 PolarHBondContact O-N 3.44Å; Y118-Q121 PolarHBondContact O-N 2.86Å; Y118-I122 WeakPolarHBondContact O-CB 3.16Å; Y118-I122 WeakPolarHBondContact O-CD1 3.47Å; Y118-I122 WeakPolarHBondContact O-CG1 3.38Å; Y118-I122 PolarHBondContact O-N 3.5Å; Y118-I146 HydrophobicContact CE1-CD1 4.13Å; Y118-I146 HydrophobicContact CE1-CG1 4.37Å; Y118-I146 HydrophobicContact CE1-CG2 4.09Å; Y118-I146 HydrophobicContact CE2-CD1 4.24Å; Y118-I152 HydrophobicContact CD1-CB 3.82Å; Y118-I152 HydrophobicContact CD1-CD1 3.71Å; Y118-I152 HydrophobicContact CD1-CG1 4.39Å; Y118-I152 HydrophobicContact CD1-CG2 3.95Å; Y118-I152 HydrophobicContact CE1-CB 4.29Å; Y118-I152 HydrophobicContact CE1-CD1 4.37Å; Y118-I152 HydrophobicContact CG-CD1 3.93Å; Y118-M207 VanDerWaalsContact CB-SD 3.52Å; Y118-M207 HydrophobicContact CD2-SD 4.01Å; Y118-M207 HydrophobicContact CG-SD 4.23Å
119	L	95.3	Very high	89.6	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.132	C	C	.	.	I	π-helix	trans	-63.6	-43.3	-173.3	-173.2	62.8	0	0	0	112.6	V114 T123 I200 F204 M207 L273 M277 Y296 F297	V114-L119 VanDerWaalsContact O-CB 3.31Å; V114-L119 WeakPolarHBondContact O-CB 3.5Å; V114-L119 PolarHBondContact O-N 3.24Å; L119-T123 VanDerWaalsContact O-CB 3.3Å; L119-T123 WeakPolarHBondContact O-CB 3.43Å; L119-T123 PolarHBondContact O-N 2.87Å; L119-T123 PolarHBondContact O-OG1 3.45Å; L119-I200 HydrophobicContact CD1-CG2 3.71Å; L119-F204 HydrophobicContact CD1-CB 3.84Å; L119-F204 HydrophobicContact CD1-CD2 4.45Å; L119-F204 HydrophobicContact CD1-CG 4.04Å; L119-F204 HydrophobicContact CD2-CB 4.43Å; L119-F204 HydrophobicContact CD2-CD1 3.74Å; L119-F204 HydrophobicContact CD2-CD2 3.76Å; L119-F204 HydrophobicContact CD2-CE1 3.85Å; L119-F204 HydrophobicContact CD2-CE2 3.89Å; L119-F204 HydrophobicContact CD2-CG 3.71Å; L119-F204 HydrophobicContact CD2-CZ 3.93Å; L119-F204 HydrophobicContact CG-CG 4.45Å; L119-M207 HydrophobicContact CB-CE 4.34Å; L119-L273 HydrophobicContact CD2-CD2 3.94Å; L119-M277 HydrophobicContact CD1-CE 4.06Å; L119-M277 HydrophobicContact CD2-CE 4.3Å; L119-Y296 HydrophobicContact CD2-CD1 4.23Å; L119-Y296 HydrophobicContact CD2-CE1 3.89Å; L119-F297 HydrophobicContact CB-CE1 4.36Å; L119-F297 HydrophobicContact CB-CZ 4.4Å; L119-F297 HydrophobicContact CD2-CE1 4.23Å; L119-F297 HydrophobicContact CD2-CZ 3.76Å; L119-F297 HydrophobicContact CG-CE1 4.33Å; L119-F297 HydrophobicContact CG-CZ 3.88Å
120	Y	94.9	Very high	90.1	Very high	9 Å²	9	27.1 Å²	27.1	4%	0.035	13%	0.132	C	C	.	.	H	α-helix	trans	-63.5	-48.8	179	-174	-92.2	0	0	0	111.7	K115 Y118 T123 D124 K292 F297 L300 K302 L305 Y308	K115-Y120 PolarHBondContact O-N 2.96Å; Y118-Y120 PolarHBondContact O-N 3.44Å; Y120-T123 CarbonylContact O-C 3.57Å; Y120-T123 PolarHBondContact O-N 2.87Å; Y120-D124 WeakPolarHBondContact O-CB 3.43Å; Y120-D124 PolarHBondContact O-N 2.92Å; Y120-K292 HydrophobicContact CE2-CB 4.34Å; Y120-K292 HydrophobicContact CE2-CG 4.29Å; Y120-F297 AromaticContact CD2-CD1 3.95Å; Y120-F297 HydrophobicContact CD2-CD1 3.95Å; Y120-F297 HydrophobicContact CD2-CD2 4.45Å; Y120-F297 HydrophobicContact CD2-CE1 4.22Å; Y120-F297 HydrophobicContact CD2-CG 4.06Å; Y120-F297 HydrophobicContact CG-CD1 4.5Å; Y120-L300 HydrophobicContact CD1-CD2 4.32Å; Y120-L300 HydrophobicContact CD2-CD2 3.82Å; Y120-L300 HydrophobicContact CE2-CD2 4.48Å; Y120-L300 HydrophobicContact CG-CD2 3.73Å; Y120-K302 HydrophobicContact CE1-CD 4.41Å; Y120-K302 HydrophobicContact CE1-CG 4.37Å; Y120-K302 HydrophobicContact CE2-CD 4.35Å; Y120-K302 WeakPolarHBondContact OH-CD 3.17Å; Y120-K302 VanDerWaalsContact OH-CE 3.32Å; Y120-K302 WeakPolarHBondContact OH-CE 3.31Å; Y120-K302 PolarHBondContact OH-NZ 3.24Å; Y120-K302 VanDerWaalsContact OH-NZ 3.12Å; Y120-L305 HydrophobicContact CD1-CD1 3.53Å; Y120-L305 HydrophobicContact CE1-CD1 3.91Å; Y120-L305 HydrophobicContact CG-CD1 4.45Å; Y120-Y308 HydrophobicContact CE1-CE1 4.22Å
121	Q	95	Very high	90.5	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-63.4	-43.2	-179.7	-75.1	-169.7	70.3	0	0	112.6	N71 Y117 Y118 T123 D124 G125 G150 I152 Y308	N71-Q121 VanDerWaalsContact CB-O 3.3Å; N71-Q121 WeakPolarHBondContact CB-O 3.47Å; N71-Q121 WeakPolarHBondContact ND2-CB 3.46Å; N71-Q121 PolarHBondContact ND2-OE1 2.79Å; Y117-Q121 WeakPolarHBondContact O-CB 3.34Å; Y117-Q121 WeakPolarHBondContact O-CG 3.38Å; Y117-Q121 PolarHBondContact O-NE2 2.91Å; Y118-Q121 PolarHBondContact O-N 2.86Å; Q121-T123 VanDerWaalsContact C-N 3.31Å; Q121-T123 PolarHBondContact O-N 3.3Å; Q121-D124 PolarHBondContact O-N 3.46Å; Q121-G125 PolarHBondContact O-N 3.35Å; Q121-G150 PolarHBondContact NE2-O 2.85Å; Q121-I152 HydrophobicContact CB-CG2 3.3Å; Q121-I152 HydrophobicContact CG-CG2 4.23Å; Q121-Y308 HydrophobicContact CG-CE2 4.15Å
122	I	97.1	Very high	90.9	Very high	2 Å²	2	28 Å²	28	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-58.2	-47.2	173.3	-67	162.3	0	0	0	110	Y118 D124 G125 I126 L144 I152 L154 I200 I203 M207	Y118-I122 WeakPolarHBondContact O-CB 3.16Å; Y118-I122 WeakPolarHBondContact O-CD1 3.47Å; Y118-I122 WeakPolarHBondContact O-CG1 3.38Å; Y118-I122 PolarHBondContact O-N 3.5Å; I122-D124 VanDerWaalsContact C-N 3.29Å; I122-D124 PolarHBondContact O-N 2.82Å; I122-G125 PolarHBondContact O-N 3.29Å; I122-I126 PolarHBondContact O-N 2.91Å; I122-L144 HydrophobicContact CD1-CD1 3.61Å; I122-L144 HydrophobicContact CG1-CD1 4.12Å; I122-L144 HydrophobicContact CG1-CD2 4.09Å; I122-L144 HydrophobicContact CG2-CD2 4.43Å; I122-I152 HydrophobicContact CD1-CD1 3.9Å; I122-I152 HydrophobicContact CG1-CD1 3.97Å; I122-I152 HydrophobicContact CG1-CG1 4.28Å; I122-I152 HydrophobicContact CG1-CG2 4.07Å; I122-L154 HydrophobicContact CG2-CD2 4.16Å; I122-I200 HydrophobicContact CG2-CD1 4.02Å; I122-I200 HydrophobicContact CG2-CG1 3.86Å; I122-I200 HydrophobicContact CG2-CG2 4.37Å; I122-I203 HydrophobicContact CD1-CG2 4.48Å; I122-M207 HydrophobicContact CD1-CE 4.25Å
123	T	96.7	Very high	91.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-66	-34.5	-179.4	-55.5	0	0	0	0	111.4	L119 Y120 Q121 I126 C127 S288 I291 K292	L119-T123 VanDerWaalsContact O-CB 3.3Å; L119-T123 WeakPolarHBondContact O-CB 3.43Å; L119-T123 PolarHBondContact O-N 2.87Å; L119-T123 PolarHBondContact O-OG1 3.45Å; Y120-T123 CarbonylContact O-C 3.57Å; Y120-T123 PolarHBondContact O-N 2.87Å; Q121-T123 VanDerWaalsContact C-N 3.31Å; Q121-T123 PolarHBondContact O-N 3.3Å; T123-I126 WeakPolarHBondContact O-CG2 3.5Å; T123-C127 WeakPolarHBondContact O-CB 3.47Å; T123-C127 PolarHBondContact O-N 3.13Å; T123-S288 WeakPolarHBondContact CG2-O 3.32Å; T123-I291 HydrophobicContact CG2-CB 3.59Å; T123-I291 HydrophobicContact CG2-CD1 4.17Å; T123-I291 HydrophobicContact CG2-CG1 4.49Å; T123-I291 HydrophobicContact CG2-CG2 3.44Å; T123-I291 VanDerWaalsContact CG2-CG2 3.44Å; T123-K292 HydrophobicContact CG2-CG 3.77Å
124	D	95.2	Very high	91.8	Very high	17 Å²	17	30.4 Å²	30.4	9%	0.091	13%	0.131	C	C	.	.	H	α-helix	trans	-69	-46.1	177.7	-162.9	47.1	0	0	0	111.9	H69 Y120 Q121 I122 I126 C127 F128 K292 Y308	H69-D124 IonicContact CE1-OD2 2.83Å; H69-D124 PolarHBondContact CE1-OD2 3.42Å; H69-D124 IonicContact NE2-OD2 2.93Å; H69-D124 PolarHBondContact NE2-OD2 2.91Å; Y120-D124 WeakPolarHBondContact O-CB 3.43Å; Y120-D124 PolarHBondContact O-N 2.92Å; Q121-D124 PolarHBondContact O-N 3.46Å; I122-D124 VanDerWaalsContact C-N 3.29Å; I122-D124 PolarHBondContact O-N 2.82Å; D124-I126 VanDerWaalsContact C-N 3.34Å; D124-I126 PolarHBondContact O-N 3.31Å; D124-C127 WeakPolarHBondContact O-CB 3.38Å; D124-C127 PolarHBondContact O-N 2.85Å; D124-F128 PolarHBondContact O-N 2.89Å; D124-K292 WeakPolarHBondContact OD1-CE 3.36Å; D124-K292 IonicContact OD1-NZ 2.59Å; D124-K292 PolarHBondContact OD1-NZ 3.21Å; D124-Y308 WeakPolarHBondContact CB-OH 3.04Å; D124-Y308 WeakPolarHBondContact OD2-CE1 3.29Å; D124-Y308 PolarHBondContact OD2-OH 2.8Å
125	G	96.3	Very high	92.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-55	-47.8	171.6	0	0	0	0	0	112	Q121 I122 C127 F128 C129	Q121-G125 PolarHBondContact O-N 3.35Å; I122-G125 PolarHBondContact O-N 3.29Å; G125-C127 VanDerWaalsContact C-N 3.34Å; G125-C127 PolarHBondContact O-N 2.85Å; G125-F128 WeakPolarHBondContact O-CB 3.48Å; G125-F128 PolarHBondContact O-N 3.44Å; G125-C129 PolarHBondContact O-N 2.96Å; G125-C129 VanDerWaalsContact O-N 3.13Å; G125-C129 PolarHBondContact O-SG 3.42Å
126	I	97.4	Very high	92.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-70.5	-33.1	-179.2	-152	63.1	0	0	0	112	I122 T123 D124 F128 C129 H130 H136 L139 L154 D196 I200	I122-I126 PolarHBondContact O-N 2.91Å; T123-I126 WeakPolarHBondContact O-CG2 3.5Å; D124-I126 VanDerWaalsContact C-N 3.34Å; D124-I126 PolarHBondContact O-N 3.31Å; I126-F128 VanDerWaalsContact C-N 3.27Å; I126-F128 PolarHBondContact O-N 3.42Å; I126-C129 HydrophobicContact CD1-CB 4.35Å; I126-C129 WeakPolarHBondContact O-CB 3.33Å; I126-C129 PolarHBondContact O-N 3.25Å; I126-H130 WeakPolarHBondContact O-CB 3.21Å; I126-H130 PolarHBondContact O-CD2 2.93Å; I126-H130 PolarHBondContact O-N 2.82Å; I126-H136 HydrophobicContact CD1-CB 3.85Å; I126-L139 HydrophobicContact CD1-CD1 3.92Å; I126-L139 HydrophobicContact CG1-CD1 4.29Å; I126-L154 HydrophobicContact CB-CD1 4.3Å; I126-L154 HydrophobicContact CD1-CD1 4Å; I126-D196 HydrophobicContact CD1-CB 4.05Å; I126-D196 HydrophobicContact CG1-CB 3.89Å; I126-I200 HydrophobicContact CB-CD1 3.98Å; I126-I200 HydrophobicContact CG1-CD1 4.15Å; I126-I200 HydrophobicContact CG2-CD1 3.56Å
127	C	96.9	Very high	93.6	Very high	9 Å²	9	28.6 Å²	28.6	6%	0.061	12%	0.121	C	C	.	.	H	α-helix	trans	-60.9	-41.4	174.7	-172.7	0	0	0	0	110.5	T123 D124 G125 H130 M131 S288 K292	T123-C127 WeakPolarHBondContact O-CB 3.47Å; T123-C127 PolarHBondContact O-N 3.13Å; D124-C127 WeakPolarHBondContact O-CB 3.38Å; D124-C127 PolarHBondContact O-N 2.85Å; G125-C127 VanDerWaalsContact C-N 3.34Å; G125-C127 PolarHBondContact O-N 2.85Å; C127-H130 PolarHBondContact O-N 2.9Å; C127-M131 WeakPolarHBondContact O-CB 3.5Å; C127-M131 VanDerWaalsContact O-CG 3.3Å; C127-M131 WeakPolarHBondContact O-CG 3.47Å; C127-M131 PolarHBondContact O-N 3.23Å; C127-S288 WeakPolarHBondContact CA-OG 3.47Å; C127-K292 HydrophobicContact CB-CD 4.09Å
128	F	96.5	Very high	94.2	Very high	27 Å²	27	26.1 Å²	26.1	12%	0.118	11%	0.112	C	C	.	.	H	α-helix	trans	-63.8	-41.8	176.2	-176.4	-101.8	0	0	0	112.5	L66 H69 D124 G125 I126 R132	L66-F128 HydrophobicContact CB-CE1 4.41Å; L66-F128 HydrophobicContact CD2-CD1 3.85Å; L66-F128 HydrophobicContact CD2-CE1 3.99Å; L66-F128 WeakPolarHBondContact O-CE1 3.49Å; H69-F128 HydrophobicContact CB-CD1 3.67Å; H69-F128 HydrophobicContact CB-CD2 4.49Å; H69-F128 HydrophobicContact CB-CE1 3.66Å; H69-F128 HydrophobicContact CB-CE2 4.46Å; H69-F128 HydrophobicContact CB-CG 4.09Å; H69-F128 HydrophobicContact CB-CZ 4.06Å; H69-F128 VanDerWaalsContact CD2-CB 3.44Å; H69-F128 WeakPolarHBondContact CD2-CB 3.21Å; H69-F128 AromaticContact CD2-CD1 3.81Å; H69-F128 AromaticContact CD2-CD2 3.4Å; H69-F128 WeakPolarHBondContact CD2-CD2 3.48Å; H69-F128 AromaticContact CD2-CE2 3.96Å; H69-F128 AromaticContact CD2-CG 3.29Å; H69-F128 WeakPolarHBondContact CD2-CG 3.47Å; H69-F128 AromaticContact CG-CD1 3.83Å; H69-F128 AromaticContact CG-CG 3.78Å; D124-F128 PolarHBondContact O-N 2.89Å; G125-F128 WeakPolarHBondContact O-CB 3.48Å; G125-F128 PolarHBondContact O-N 3.44Å; I126-F128 VanDerWaalsContact C-N 3.27Å; I126-F128 PolarHBondContact O-N 3.42Å; F128-R132 VanDerWaalsContact CZ-NH1 3.29Å; F128-R132 PolarHBondContact O-N 3.28Å; F128-R132 PolarHBondContact O-NH1 2.98Å
129	C	96.3	Very high	94.4	Very high	0 Å²	0	26 Å²	26	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.7	-49.8	172.4	-61.4	0	0	0	0	111.8	L66 G125 I126 M131 R132 R133 I134	L66-C129 HydrophobicContact CD2-CB 4.23Å; G125-C129 PolarHBondContact O-N 2.96Å; G125-C129 VanDerWaalsContact O-N 3.13Å; G125-C129 PolarHBondContact O-SG 3.42Å; I126-C129 HydrophobicContact CD1-CB 4.35Å; I126-C129 WeakPolarHBondContact O-CB 3.33Å; I126-C129 PolarHBondContact O-N 3.25Å; C129-M131 VanDerWaalsContact C-N 3.33Å; C129-M131 PolarHBondContact O-N 3.19Å; C129-R132 CarbonylContact O-C 3.6Å; C129-R132 WeakPolarHBondContact O-CA 3.42Å; C129-R132 PolarHBondContact O-N 3.11Å; C129-R133 PolarHBondContact O-N 3.15Å; C129-I134 CarbonylContact C-O 3.51Å; C129-I134 VanDerWaalsContact C-O 3.28Å; C129-I134 HydrophobicContact CB-CB 4.31Å; C129-I134 WeakPolarHBondContact CB-O 3.41Å; C129-I134 PolarHBondContact O-N 2.79Å
130	H	95.5	Very high	94.4	Very high	10 Å²	10	27.3 Å²	27.3	5%	0.046	12%	0.118	C	C	.	.	H	α-helix	trans	-61.1	-39.5	-179	-74.5	-178.7	0	0	0	112.1	I126 C127 R132 R133 I134 M193 D196 S288	I126-H130 WeakPolarHBondContact O-CB 3.21Å; I126-H130 PolarHBondContact O-CD2 2.93Å; I126-H130 PolarHBondContact O-N 2.82Å; C127-H130 PolarHBondContact O-N 2.9Å; H130-R132 PolarHBondContact O-N 3.48Å; H130-R133 WeakPolarHBondContact O-CA 3.03Å; H130-R133 PolarHBondContact O-N 3.38Å; H130-I134 PolarHBondContact CD2-O 3.29Å; H130-M193 HydrophobicContact CB-CE 4.25Å; H130-M193 HydrophobicContact CB-CG 4.37Å; H130-M193 HydrophobicContact CB-SD 3.56Å; H130-M193 VanDerWaalsContact CB-SD 3.56Å; H130-M193 PolarHBondContact CE1-O 3.35Å; H130-M193 WeakPolarHBondContact O-CE 3.04Å; H130-D196 IonicContact CD2-OD2 2.73Å; H130-D196 IonicContact CE1-OD2 3.15Å; H130-D196 IonicContact NE2-OD2 2.63Å; H130-D196 PolarHBondContact NE2-OD2 2.83Å; H130-S288 PolarHBondContact ND1-OG 2.91Å; H130-S288 VanDerWaalsContact ND1-OG 3.13Å
131	M	94.5	Very high	94.4	Very high	148 Å²	148	26.9 Å²	26.9	73%	0.729	12%	0.116	S	C	*	.	H	α-helix	trans	-61.4	-27.3	174.8	-76.8	178.2	59.3	0	0	113.3	C127 C129 R133	C127-M131 WeakPolarHBondContact O-CB 3.5Å; C127-M131 VanDerWaalsContact O-CG 3.3Å; C127-M131 WeakPolarHBondContact O-CG 3.47Å; C127-M131 PolarHBondContact O-N 3.23Å; C129-M131 VanDerWaalsContact C-N 3.33Å; C129-M131 PolarHBondContact O-N 3.19Å; M131-R133 VanDerWaalsContact C-N 3.3Å
132	R	93.5	Very high	94.3	Very high	99 Å²	99	30 Å²	30	37%	0.374	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	9.9	173	-73.8	164.8	177.2	63.9	7	113.4	E65 F128 C129 H130 I134	E65-R132 WeakPolarHBondContact O-CD 3.44Å; E65-R132 PolarHBondContact O-NE 2.89Å; F128-R132 VanDerWaalsContact CZ-NH1 3.29Å; F128-R132 PolarHBondContact O-N 3.28Å; F128-R132 PolarHBondContact O-NH1 2.98Å; C129-R132 CarbonylContact O-C 3.6Å; C129-R132 WeakPolarHBondContact O-CA 3.42Å; C129-R132 PolarHBondContact O-N 3.11Å; H130-R132 PolarHBondContact O-N 3.48Å; R132-I134 HydrophobicContact CB-CD1 3.95Å; R132-I134 HydrophobicContact CB-CG1 4.14Å; R132-I134 PolarHBondContact O-N 3.13Å
133	R	92.1	Very high	94.2	Very high	184 Å²	184	30.5 Å²	30.5	69%	0.694	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.9	29.2	-175.1	-49.6	-176	-175.1	-175.7	2.2	113.3	C129 H130 M131 C162 V163	C129-R133 PolarHBondContact O-N 3.15Å; H130-R133 WeakPolarHBondContact O-CA 3.03Å; H130-R133 PolarHBondContact O-N 3.38Å; M131-R133 VanDerWaalsContact C-N 3.3Å; R133-C162 CarbonylContact O-C 3.49Å; R133-C162 WeakPolarHBondContact O-CA 3.26Å; R133-V163 HydrophobicContact CB-CB 4.41Å; R133-V163 HydrophobicContact CB-CG2 4.34Å; R133-V163 PolarHBondContact O-N 2.92Å
134	I	91.4	Very high	94.2	Very high	5 Å²	5	30.5 Å²	30.5	3%	0.026	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	126.6	177.7	-59.6	170.4	0	0	0	109	L62 E65 L66 C129 H130 R132 A160	L62-I134 HydrophobicContact CD1-CG2 4.49Å; L62-I134 HydrophobicContact CD2-CD1 3.71Å; L62-I134 HydrophobicContact CD2-CG1 3.82Å; L62-I134 HydrophobicContact CD2-CG2 4.23Å; E65-I134 HydrophobicContact CB-CD1 4.45Å; L66-I134 HydrophobicContact CD1-CD1 4.2Å; L66-I134 HydrophobicContact CD1-CG2 4.36Å; L66-I134 HydrophobicContact CD2-CD1 3.82Å; L66-I134 HydrophobicContact CG-CD1 3.87Å; C129-I134 CarbonylContact C-O 3.51Å; C129-I134 VanDerWaalsContact C-O 3.28Å; C129-I134 HydrophobicContact CB-CB 4.31Å; C129-I134 WeakPolarHBondContact CB-O 3.41Å; C129-I134 PolarHBondContact O-N 2.79Å; H130-I134 PolarHBondContact CD2-O 3.29Å; R132-I134 HydrophobicContact CB-CD1 3.95Å; R132-I134 HydrophobicContact CB-CG1 4.14Å; R132-I134 PolarHBondContact O-N 3.13Å; I134-A160 HydrophobicContact CG2-CB 4.37Å
135	M	91.1	Very high	94.2	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.01	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	138.6	171.5	-61.1	178.7	-63.2	0	0	109.8	R137 A160 R161 V163 T192 M193 D196	M135-R137 HydrophobicContact CB-CG 3.74Å; M135-A160 WeakPolarHBondContact O-CA 3.31Å; M135-A160 VanDerWaalsContact O-CB 3.31Å; M135-A160 WeakPolarHBondContact O-CB 3.44Å; M135-R161 PolarHBondContact N-O 2.95Å; M135-R161 PolarHBondContact O-N 3.45Å; M135-V163 HydrophobicContact CE-CG2 4.27Å; M135-V163 HydrophobicContact CG-CG2 3.81Å; M135-V163 HydrophobicContact SD-CG2 3.94Å; M135-T192 VanDerWaalsContact SD-O 3.36Å; M135-M193 HydrophobicContact CG-CG 4.16Å; M135-D196 VanDerWaalsContact CA-OD2 3.3Å; M135-D196 WeakPolarHBondContact CA-OD2 3.41Å
136	H	92.5	Very high	94	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	14%	0.14	C	C	.	.			trans	-77.3	-47.5	-179.3	-171.7	-79.2	0	0	0	112.1	I126 D138 L139 A155 D156 F157 D196	I126-H136 HydrophobicContact CD1-CB 3.85Å; H136-D138 PolarHBondContact CE1-O 2.94Å; H136-D138 VanDerWaalsContact ND1-C 3.29Å; H136-D138 PolarHBondContact ND1-N 2.91Å; H136-D138 PolarHBondContact O-N 3.27Å; H136-D138 VanDerWaalsContact O-N 3.07Å; H136-L139 HydrophobicContact CB-CD1 4.39Å; H136-L139 HydrophobicContact CB-CD2 4.09Å; H136-L139 HydrophobicContact CB-CG 3.9Å; H136-L139 PolarHBondContact ND1-N 3.37Å; H136-A155 PolarHBondContact CE1-O 3.22Å; H136-A155 PolarHBondContact NE2-O 2.98Å; H136-D156 PolarHBondContact CE1-O 2.96Å; H136-D156 PolarHBondContact NE2-O 3.32Å; H136-F157 AromaticContact CD2-CD1 3.97Å; H136-F157 AromaticContact CD2-CE1 3.72Å; H136-F157 AromaticContact CD2-CZ 3.77Å; H136-D196 PolarHBondContact N-OD1 3.31Å; H136-D196 PolarHBondContact N-OD2 3.39Å
137	R	89.4	Confident	93.6	Very high	12 Å²	12	33.7 Å²	33.7	5%	0.045	15%	0.15	C	C	.	.			trans	69.3	-8.4	173.2	-50.9	179.5	60.6	-122.1	-11.1	117.3	M135 L159 V167 Y170 L195 D196	M135-R137 HydrophobicContact CB-CG 3.74Å; R137-L159 PolarHBondContact NH1-O 3.05Å; R137-V167 VanDerWaalsContact CZ-CG2 3.43Å; R137-Y170 PolarHBondContact NH2-OH 3.33Å; R137-Y170 PolarHBondContact O-OH 2.99Å; R137-Y170 VanDerWaalsContact O-OH 3.12Å; R137-L195 HydrophobicContact CB-CD2 4.46Å; R137-D196 PolarHBondContact N-OD1 3.34Å
138	D	89.8	Confident	93.1	Very high	19 Å²	19	41.9 Å²	41.9	10%	0.102	19%	0.188	C	C	.	.			trans	-134.5	44.7	173.6	-164.9	37.3	0	0	0	112	H136 K140 N143 L159	H136-D138 PolarHBondContact CE1-O 2.94Å; H136-D138 VanDerWaalsContact ND1-C 3.29Å; H136-D138 PolarHBondContact ND1-N 2.91Å; H136-D138 PolarHBondContact O-N 3.27Å; H136-D138 VanDerWaalsContact O-N 3.07Å; D138-K140 PolarHBondContact O-N 3.15Å; D138-K140 IonicContact OD1-NZ 2.75Å; D138-K140 PolarHBondContact OD1-NZ 3.03Å; D138-K140 IonicContact OD2-NZ 3.06Å; D138-K140 PolarHBondContact OD2-NZ 3.15Å; D138-N143 PolarHBondContact O-ND2 3.45Å; D138-N143 PolarHBondContact OD2-ND2 3.35Å; D138-L159 HydrophobicContact CB-CB 4.18Å; D138-L159 HydrophobicContact CB-CD1 3.58Å; D138-L159 HydrophobicContact CB-CG 4.49Å
139	L	95.1	Very high	92.5	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.01	22%	0.217	C	C	.	.			trans	-71.5	122.4	174.8	-71.9	175	0	0	0	109.7	I126 H136 L144 L154 Y179 D196 I200 I203	I126-L139 HydrophobicContact CD1-CD1 3.92Å; I126-L139 HydrophobicContact CG1-CD1 4.29Å; H136-L139 HydrophobicContact CB-CD1 4.39Å; H136-L139 HydrophobicContact CB-CD2 4.09Å; H136-L139 HydrophobicContact CB-CG 3.9Å; H136-L139 PolarHBondContact ND1-N 3.37Å; L139-L144 HydrophobicContact CD2-CD2 4.42Å; L139-L154 HydrophobicContact CD2-CD2 3.83Å; L139-Y179 VanDerWaalsContact O-CB 3.32Å; L139-Y179 WeakPolarHBondContact O-CB 3.31Å; L139-D196 HydrophobicContact CD1-CB 3.84Å; L139-I200 HydrophobicContact CD1-CD1 3.85Å; L139-I200 HydrophobicContact CD1-CG1 3.66Å; L139-I203 HydrophobicContact CB-CD1 4.14Å
140	K	94.8	Very high	91.9	Very high	29 Å²	29	49.2 Å²	49.2	13%	0.126	22%	0.223	C	C	.	.			trans	-156.1	159.3	176.3	60.8	-168.8	-176.6	-140.9	0	108.9	D138 Q142 N143 L144 Y179	D138-K140 PolarHBondContact O-N 3.15Å; D138-K140 IonicContact OD1-NZ 2.75Å; D138-K140 PolarHBondContact OD1-NZ 3.03Å; D138-K140 IonicContact OD2-NZ 3.06Å; D138-K140 PolarHBondContact OD2-NZ 3.15Å; K140-Q142 HydrophobicContact CG-CB 4.29Å; K140-Q142 PolarHBondContact O-N 2.81Å; K140-Q142 VanDerWaalsContact O-N 3.1Å; K140-N143 WeakPolarHBondContact CE-ND2 3.49Å; K140-N143 WeakPolarHBondContact CE-OD1 3.25Å; K140-N143 HydrophobicContact CG-CB 4.04Å; K140-N143 WeakPolarHBondContact O-CA 3.34Å; K140-N143 PolarHBondContact O-N 3.2Å; K140-L144 PolarHBondContact O-N 3.49Å; K140-Y179 HydrophobicContact CB-CD2 3.43Å; K140-Y179 VanDerWaalsContact CB-CD2 3.43Å; K140-Y179 HydrophobicContact CB-CE2 3.46Å; K140-Y179 VanDerWaalsContact CB-CE2 3.46Å; K140-Y179 HydrophobicContact CB-CG 4.16Å
141	P	95.3	Very high	91.7	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-55.7	-29.4	-178.7	-28.2	37.6	0	0	0	114.3	L96 R97 M100 N143 L144 Y179 I203	L96-P141 HydrophobicContact CB-CB 4.13Å; L96-P141 WeakPolarHBondContact CB-O 3.39Å; L96-P141 HydrophobicContact CD2-CB 4.21Å; L96-P141 HydrophobicContact CG-CB 4.17Å; L96-P141 PolarHBondContact N-O 3.08Å; R97-P141 HydrophobicContact CB-CB 3.9Å; R97-P141 PolarHBondContact N-O 2.63Å; M100-P141 HydrophobicContact CE-CB 3.82Å; M100-P141 HydrophobicContact CE-CG 3.93Å; P141-N143 VanDerWaalsContact C-N 3.26Å; P141-N143 PolarHBondContact O-N 2.71Å; P141-L144 PolarHBondContact O-N 2.9Å; P141-Y179 WeakPolarHBondContact CD-OH 3.38Å; P141-Y179 HydrophobicContact CG-CE1 4.07Å; P141-Y179 WeakPolarHBondContact CG-OH 3.44Å; P141-I203 HydrophobicContact CG-CG1 4.32Å
142	Q	93.4	Very high	91.7	Very high	65 Å²	65	42.3 Å²	42.3	30%	0.304	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-68.7	-23	175.2	-60.2	84.2	-4.1	0	0	113.6	R97 K140	R97-Q142 HydrophobicContact CB-CG 4.09Å; R97-Q142 HydrophobicContact CG-CG 4.5Å; K140-Q142 HydrophobicContact CG-CB 4.29Å; K140-Q142 PolarHBondContact O-N 2.81Å; K140-Q142 VanDerWaalsContact O-N 3.1Å
143	N	94.4	Very high	91.8	Very high	13 Å²	13	38.9 Å²	38.9	7%	0.07	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-99.9	12.1	179.8	-70.5	0.6	0	0	0	111.9	D138 K140 P141 A155	D138-N143 PolarHBondContact O-ND2 3.45Å; D138-N143 PolarHBondContact OD2-ND2 3.35Å; K140-N143 WeakPolarHBondContact CE-ND2 3.49Å; K140-N143 WeakPolarHBondContact CE-OD1 3.25Å; K140-N143 HydrophobicContact CG-CB 4.04Å; K140-N143 WeakPolarHBondContact O-CA 3.34Å; K140-N143 PolarHBondContact O-N 3.2Å; P141-N143 VanDerWaalsContact C-N 3.26Å; P141-N143 PolarHBondContact O-N 2.71Å; N143-A155 WeakPolarHBondContact CB-O 3.18Å; N143-A155 PolarHBondContact O-N 2.83Å
144	L	96.2	Very high	92	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	106	175.2	-65.9	177.8	0	0	0	108.4	D95 L96 I122 L139 K140 P141 I152 K153 L154 I203	D95-L144 CarbonylContact C-O 3.59Å; D95-L144 VanDerWaalsContact CA-O 3.31Å; D95-L144 WeakPolarHBondContact CA-O 3.42Å; L96-L144 HydrophobicContact CB-CB 3.96Å; L96-L144 HydrophobicContact CD2-CB 4.37Å; L96-L144 HydrophobicContact CD2-CD1 3.68Å; L96-L144 PolarHBondContact N-O 2.84Å; I122-L144 HydrophobicContact CD1-CD1 3.61Å; I122-L144 HydrophobicContact CG1-CD1 4.12Å; I122-L144 HydrophobicContact CG1-CD2 4.09Å; I122-L144 HydrophobicContact CG2-CD2 4.43Å; L139-L144 HydrophobicContact CD2-CD2 4.42Å; K140-L144 PolarHBondContact O-N 3.49Å; P141-L144 PolarHBondContact O-N 2.9Å; L144-I152 HydrophobicContact CB-CD1 4.08Å; L144-I152 HydrophobicContact CB-CG1 4.23Å; L144-K153 WeakPolarHBondContact CA-O 3.1Å; L144-L154 HydrophobicContact CD2-CD2 3.41Å; L144-L154 VanDerWaalsContact CD2-CD2 3.41Å; L144-I203 HydrophobicContact CD1-CD1 3.96Å; L144-I203 HydrophobicContact CD1-CG2 3.85Å
145	L	95.6	Very high	92.1	Very high	40 Å²	40	30.5 Å²	30.5	21%	0.209	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	140.5	-174.9	-60.4	-175.7	0	0	0	110.8	L92 D95 I152 K153 A155	L92-L145 HydrophobicContact CB-CB 3.79Å; L92-L145 HydrophobicContact CB-CD1 4.37Å; L92-L145 HydrophobicContact CD1-CB 3.93Å; L92-L145 HydrophobicContact CD1-CD1 3.83Å; L92-L145 HydrophobicContact CD2-CB 3.82Å; L92-L145 HydrophobicContact CG-CB 4.05Å; D95-L145 HydrophobicContact CB-CD2 3.98Å; L145-I152 CarbonylContact O-C 3.49Å; L145-I152 VanDerWaalsContact O-CA 3.26Å; L145-I152 WeakPolarHBondContact O-CA 3.32Å; L145-K153 PolarHBondContact N-O 2.92Å; L145-K153 PolarHBondContact O-N 3.34Å; L145-A155 HydrophobicContact CD1-CB 3.62Å; L145-A155 HydrophobicContact CG-CB 3.71Å
146	I	93.2	Very high	92	Very high	4 Å²	4	32.8 Å²	32.8	2%	0.021	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	139.2	-175.5	-54.2	172.8	0	0	0	109.4	S93 M94 L96 Y99 Y118 T151 I152	S93-I146 PolarHBondContact N-O 3.35Å; S93-I146 PolarHBondContact OG-O 3.19Å; M94-I146 HydrophobicContact CG-CB 4.31Å; M94-I146 PolarHBondContact N-O 3.24Å; M94-I146 PolarHBondContact O-N 3.18Å; L96-I146 HydrophobicContact CB-CD1 3.87Å; L96-I146 HydrophobicContact CD1-CD1 3.68Å; L96-I146 HydrophobicContact CG-CD1 4.38Å; Y99-I146 HydrophobicContact CD1-CD1 4.08Å; Y99-I146 HydrophobicContact CG-CD1 4.18Å; Y118-I146 HydrophobicContact CE1-CD1 4.13Å; Y118-I146 HydrophobicContact CE1-CG1 4.37Å; Y118-I146 HydrophobicContact CE1-CG2 4.09Å; Y118-I146 HydrophobicContact CE2-CD1 4.24Å; I146-T151 VanDerWaalsContact CA-O 3.3Å; I146-T151 WeakPolarHBondContact CA-O 3.37Å; I146-I152 HydrophobicContact CD1-CD1 4.26Å; I146-I152 HydrophobicContact CG1-CB 4.41Å; I146-I152 HydrophobicContact CG1-CD1 3.96Å; I146-I152 HydrophobicContact CG1-CG1 3.98Å
147	D	89.3	Confident	91.6	Very high	39 Å²	39	32.9 Å²	32.9	21%	0.209	16%	0.161	C	C	.	.			trans	-103	171.8	170.3	74.8	14.5	0	0	0	112.4	L92 K149 G150 T151	L92-D147 HydrophobicContact CD2-CB 4.26Å; D147-K149 PolarHBondContact O-N 2.77Å; D147-K149 VanDerWaalsContact O-N 3.15Å; D147-K149 WeakPolarHBondContact OD1-CA 3.28Å; D147-K149 WeakPolarHBondContact OD1-CB 3.44Å; D147-K149 PolarHBondContact OD1-N 3.24Å; D147-G150 PolarHBondContact O-N 2.87Å; D147-G150 PolarHBondContact OD1-N 3.48Å; D147-T151 VanDerWaalsContact CG-CB 3.42Å; D147-T151 VanDerWaalsContact CG-OG1 3.28Å; D147-T151 PolarHBondContact N-O 3.38Å; D147-T151 VanDerWaalsContact N-O 3.09Å; D147-T151 WeakPolarHBondContact OD1-CB 3.26Å; D147-T151 PolarHBondContact OD1-N 2.9Å; D147-T151 PolarHBondContact OD1-OG1 3.44Å; D147-T151 WeakPolarHBondContact OD2-CB 3.3Å; D147-T151 PolarHBondContact OD2-OG1 3.39Å
148	E	84.5	Confident	91	Very high	182 Å²	182	32.8 Å²	32.8	85%	0.85	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-12.6	-179.5	-60.4	-178.4	-177.3	0	0	113.8
149	K	84	Confident	90.2	Very high	169 Å²	169	33.1 Å²	33.1	74%	0.735	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-3.1	179.2	-58.2	178.1	-177.7	174.9	0	112.1	D147 P306	D147-K149 PolarHBondContact O-N 2.77Å; D147-K149 VanDerWaalsContact O-N 3.15Å; D147-K149 WeakPolarHBondContact OD1-CA 3.28Å; D147-K149 WeakPolarHBondContact OD1-CB 3.44Å; D147-K149 PolarHBondContact OD1-N 3.24Å; K149-P306 VanDerWaalsContact O-CG 3.28Å; K149-P306 WeakPolarHBondContact O-CG 3.31Å
150	G	84.5	Confident	89	Confident	12 Å²	12	33.1 Å²	33.1	12%	0.124	17%	0.165	C	C	.	.	S	Bend	trans	82.5	14.9	-176.2	0	0	0	0	0	113.8	Q121 D147	Q121-G150 PolarHBondContact NE2-O 2.85Å; D147-G150 PolarHBondContact O-N 2.87Å; D147-G150 PolarHBondContact OD1-N 3.48Å
151	T	90.9	Very high	88.2	Confident	11 Å²	11	34.3 Å²	34.3	7%	0.067	17%	0.169	C	C	.	.			trans	-71.2	138	167.6	-42	0	0	0	0	108.7	I146 D147 K153 P306	I146-T151 VanDerWaalsContact CA-O 3.3Å; I146-T151 WeakPolarHBondContact CA-O 3.37Å; D147-T151 VanDerWaalsContact CG-CB 3.42Å; D147-T151 VanDerWaalsContact CG-OG1 3.28Å; D147-T151 PolarHBondContact N-O 3.38Å; D147-T151 VanDerWaalsContact N-O 3.09Å; D147-T151 WeakPolarHBondContact OD1-CB 3.26Å; D147-T151 PolarHBondContact OD1-N 2.9Å; D147-T151 PolarHBondContact OD1-OG1 3.44Å; D147-T151 WeakPolarHBondContact OD2-CB 3.3Å; D147-T151 PolarHBondContact OD2-OG1 3.39Å; T151-K153 HydrophobicContact CG2-CG 4.18Å; T151-P306 WeakPolarHBondContact OG1-CB 3.23Å
152	I	94.5	Very high	87	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	136.6	169.4	-168.2	161.2	0	0	0	110.4	N71 L96 Y118 Q121 I122 L144 L145 I146	N71-I152 WeakPolarHBondContact CA-O 3.34Å; N71-I152 WeakPolarHBondContact CB-O 3.43Å; N71-I152 PolarHBondContact ND2-O 3.24Å; L96-I152 HydrophobicContact CD2-CD1 4.37Å; Y118-I152 HydrophobicContact CD1-CB 3.82Å; Y118-I152 HydrophobicContact CD1-CD1 3.71Å; Y118-I152 HydrophobicContact CD1-CG1 4.39Å; Y118-I152 HydrophobicContact CD1-CG2 3.95Å; Y118-I152 HydrophobicContact CE1-CB 4.29Å; Y118-I152 HydrophobicContact CE1-CD1 4.37Å; Y118-I152 HydrophobicContact CG-CD1 3.93Å; Q121-I152 HydrophobicContact CB-CG2 3.3Å; Q121-I152 HydrophobicContact CG-CG2 4.23Å; I122-I152 HydrophobicContact CD1-CD1 3.9Å; I122-I152 HydrophobicContact CG1-CD1 3.97Å; I122-I152 HydrophobicContact CG1-CG1 4.28Å; I122-I152 HydrophobicContact CG1-CG2 4.07Å; L144-I152 HydrophobicContact CB-CD1 4.08Å; L144-I152 HydrophobicContact CB-CG1 4.23Å; L145-I152 CarbonylContact O-C 3.49Å; L145-I152 VanDerWaalsContact O-CA 3.26Å; L145-I152 WeakPolarHBondContact O-CA 3.32Å; I146-I152 HydrophobicContact CD1-CD1 4.26Å; I146-I152 HydrophobicContact CG1-CB 4.41Å; I146-I152 HydrophobicContact CG1-CD1 3.96Å; I146-I152 HydrophobicContact CG1-CG1 3.98Å
153	K	96	Very high	85.7	Confident	28 Å²	28	36.9 Å²	36.9	12%	0.122	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	139	-176.4	-56	-161.4	179.9	-157.6	0	111.9	P70 N71 E90 L92 L144 L145 T151	P70-K153 WeakPolarHBondContact O-CD 3.3Å; P70-K153 WeakPolarHBondContact O-CE 3.45Å; P70-K153 WeakPolarHBondContact O-CG 3.48Å; N71-K153 WeakPolarHBondContact O-CA 3.41Å; E90-K153 WeakPolarHBondContact OE1-CD 3.33Å; E90-K153 IonicContact OE1-NZ 3.46Å; E90-K153 PolarHBondContact OE1-NZ 3.33Å; E90-K153 WeakPolarHBondContact OE2-CE 3.38Å; E90-K153 IonicContact OE2-NZ 3.37Å; E90-K153 PolarHBondContact OE2-NZ 3.25Å; L92-K153 HydrophobicContact CD1-CD 4.36Å; L92-K153 HydrophobicContact CD2-CB 4.28Å; L92-K153 HydrophobicContact CD2-CD 4.08Å; L92-K153 HydrophobicContact CD2-CG 3.94Å; L144-K153 WeakPolarHBondContact CA-O 3.1Å; L145-K153 PolarHBondContact N-O 2.92Å; L145-K153 PolarHBondContact O-N 3.34Å; T151-K153 HydrophobicContact CG2-CG 4.18Å
154	L	96.9	Very high	84.1	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	131.9	169.3	-54.8	-176	0	0	0	109.5	N71 V72 V73 I122 I126 L139 L144 F157	N71-L154 WeakPolarHBondContact O-CG 3.5Å; N71-L154 PolarHBondContact O-N 2.95Å; V72-L154 HydrophobicContact CG2-CD1 4.48Å; V73-L154 WeakPolarHBondContact CB-O 3.47Å; V73-L154 WeakPolarHBondContact CG1-O 3.4Å; V73-L154 PolarHBondContact N-O 3.27Å; I122-L154 HydrophobicContact CG2-CD2 4.16Å; I126-L154 HydrophobicContact CB-CD1 4.3Å; I126-L154 HydrophobicContact CD1-CD1 4Å; L139-L154 HydrophobicContact CD2-CD2 3.83Å; L144-L154 HydrophobicContact CD2-CD2 3.41Å; L144-L154 VanDerWaalsContact CD2-CD2 3.41Å; L154-F157 HydrophobicContact CB-CE2 4.1Å; L154-F157 HydrophobicContact CB-CZ 4.01Å; L154-F157 HydrophobicContact CD1-CZ 4.49Å
155	A	93.8	Very high	82.4	Confident	11 Å²	11	42.2 Å²	42.2	9%	0.091	24%	0.237	C	C	.	.			trans	-135.5	167.5	178.6	0	0	0	0	0	112.2	V73 H136 N143 L145	V73-A155 HydrophobicContact CB-CB 4.28Å; V73-A155 HydrophobicContact CG1-CB 4.04Å; H136-A155 PolarHBondContact CE1-O 3.22Å; H136-A155 PolarHBondContact NE2-O 2.98Å; N143-A155 WeakPolarHBondContact CB-O 3.18Å; N143-A155 PolarHBondContact O-N 2.83Å; L145-A155 HydrophobicContact CD1-CB 3.62Å; L145-A155 HydrophobicContact CG-CB 3.71Å
156	D	87.1	Confident	80.5	Confident	50 Å²	50	45.1 Å²	45.1	27%	0.267	26%	0.258	S	S	.	.			trans	60.9	70.8	-179.8	-159.1	16.9	0	0	0	115	K41 H136 G158	K41-D156 IonicContact NZ-OD1 2.63Å; K41-D156 PolarHBondContact NZ-OD1 3.11Å; H136-D156 PolarHBondContact CE1-O 2.96Å; H136-D156 PolarHBondContact NE2-O 3.32Å; D156-G158 PolarHBondContact O-N 2.82Å
157	F	85.4	Confident	78.7	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.009	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-81.9	15.1	176.1	-73.9	-102.6	0	0	0	112.9	E59 L63 L66 V72 H136 L154 L159 A160	E59-F157 HydrophobicContact CG-CB 4.34Å; L63-F157 HydrophobicContact CD2-CB 4.42Å; L63-F157 HydrophobicContact CD2-CD2 3.71Å; L63-F157 HydrophobicContact CD2-CE2 4.23Å; L63-F157 HydrophobicContact CD2-CG 4.17Å; L63-F157 HydrophobicContact CG-CB 4.45Å; L66-F157 HydrophobicContact CD1-CD1 3.76Å; L66-F157 HydrophobicContact CD1-CE1 3.29Å; L66-F157 HydrophobicContact CD1-CZ 3.78Å; V72-F157 HydrophobicContact CG1-CE2 3.77Å; V72-F157 HydrophobicContact CG1-CZ 3.78Å; H136-F157 AromaticContact CD2-CD1 3.97Å; H136-F157 AromaticContact CD2-CE1 3.72Å; H136-F157 AromaticContact CD2-CZ 3.77Å; L154-F157 HydrophobicContact CB-CE2 4.1Å; L154-F157 HydrophobicContact CB-CZ 4.01Å; L154-F157 HydrophobicContact CD1-CZ 4.49Å; F157-L159 PolarHBondContact O-N 3.13Å; F157-L159 VanDerWaalsContact O-N 3.07Å; F157-A160 HydrophobicContact CB-CB 3.85Å; F157-A160 HydrophobicContact CD1-CB 3.66Å; F157-A160 HydrophobicContact CG-CB 4.21Å; F157-A160 WeakPolarHBondContact O-CB 3.39Å; F157-A160 PolarHBondContact O-N 2.97Å
158	G	76.2	Confident	77	Confident	10 Å²	10	54.8 Å²	54.8	10%	0.103	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-58.6	-24	-179.2	0	0	0	0	0	114.2	D156	D156-G158 PolarHBondContact O-N 2.82Å
159	L	73	Confident	75.3	Confident	27 Å²	27	51 Å²	51	14%	0.141	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-102.4	-2.6	176.3	-74.7	168.9	0	0	0	114.3	Y23 R137 D138 F157 Y170	Y23-L159 HydrophobicContact CE2-CG 4.15Å; Y23-L159 WeakPolarHBondContact OH-CD2 3.31Å; R137-L159 PolarHBondContact NH1-O 3.05Å; D138-L159 HydrophobicContact CB-CB 4.18Å; D138-L159 HydrophobicContact CB-CD1 3.58Å; D138-L159 HydrophobicContact CB-CG 4.49Å; F157-L159 PolarHBondContact O-N 3.13Å; F157-L159 VanDerWaalsContact O-N 3.07Å; L159-Y170 HydrophobicContact CD1-CE1 3.81Å; L159-Y170 HydrophobicContact CD2-CD1 4.49Å; L159-Y170 HydrophobicContact CD2-CE1 3.76Å; L159-Y170 HydrophobicContact CG-CE1 4.37Å
160	A	71.1	Confident	73.6	Confident	2 Å²	2	44.5 Å²	44.5	2%	0.017	26%	0.256	C	S	.	.			trans	-68.4	145.2	-175.2	0	0	0	0	0	111.9	L62 I134 M135 F157	L62-A160 HydrophobicContact CD1-CB 3.74Å; L62-A160 WeakPolarHBondContact CD1-O 3.46Å; I134-A160 HydrophobicContact CG2-CB 4.37Å; M135-A160 WeakPolarHBondContact O-CA 3.31Å; M135-A160 VanDerWaalsContact O-CB 3.31Å; M135-A160 WeakPolarHBondContact O-CB 3.44Å; F157-A160 HydrophobicContact CB-CB 3.85Å; F157-A160 HydrophobicContact CD1-CB 3.66Å; F157-A160 HydrophobicContact CG-CB 4.21Å; F157-A160 WeakPolarHBondContact O-CB 3.39Å; F157-A160 PolarHBondContact O-N 2.97Å
161	R	77.2	Confident	71.8	Confident	54 Å²	54	49.7 Å²	49.7	20%	0.204	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	154.1	-179.7	-73.4	-157.5	176.5	-157	-3	112.6	M135 P166	M135-R161 PolarHBondContact N-O 2.95Å; M135-R161 PolarHBondContact O-N 3.45Å; R161-P166 PolarHBondContact NH1-O 3.07Å
162	C	69.5	Low	69.4	Low	59 Å²	59	55.5 Å²	55.5	40%	0.399	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	144.7	166.7	-59.5	0	0	0	0	110.9	R133 G164 V165	R133-C162 CarbonylContact O-C 3.49Å; R133-C162 WeakPolarHBondContact O-CA 3.26Å; C162-G164 PolarHBondContact O-N 2.88Å; C162-V165 HydrophobicContact CB-CG2 4.01Å; C162-V165 WeakPolarHBondContact O-CG2 3.49Å; C162-V165 PolarHBondContact O-N 3.07Å
163	V	66.9	Low	66.8	Low	59 Å²	59	64.1 Å²	64.1	36%	0.358	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	137.7	175.5	175.1	0	0	0	0	111	R133 M135 V165 M193	R133-V163 HydrophobicContact CB-CB 4.41Å; R133-V163 HydrophobicContact CB-CG2 4.34Å; R133-V163 PolarHBondContact O-N 2.92Å; M135-V163 HydrophobicContact CE-CG2 4.27Å; M135-V163 HydrophobicContact CG-CG2 3.81Å; M135-V163 HydrophobicContact SD-CG2 3.94Å; V163-V165 VanDerWaalsContact C-N 3.29Å; V163-V165 PolarHBondContact O-N 2.93Å; V163-M193 HydrophobicContact CG2-CE 3.6Å; V163-M193 HydrophobicContact CG2-CG 3.88Å
164	G	59.9	Low	64.6	Low	64 Å²	64	68.8 Å²	68.8	66%	0.66	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.4	-6.9	177.1	0	0	0	0	0	115	C162 P166	C162-G164 PolarHBondContact O-N 2.88Å; G164-P166 VanDerWaalsContact O-CD 3.31Å; G164-P166 WeakPolarHBondContact O-CD 3.49Å
165	V	60.1	Low	63.2	Low	62 Å²	62	70.6 Å²	70.6	38%	0.376	39%	0.394	S	S	.	.			trans	-74.1	117.6	172.4	-177	0	0	0	0	108.7	C162 V163	C162-V165 HydrophobicContact CB-CG2 4.01Å; C162-V165 WeakPolarHBondContact O-CG2 3.49Å; C162-V165 PolarHBondContact O-N 3.07Å; V163-V165 VanDerWaalsContact C-N 3.29Å; V163-V165 PolarHBondContact O-N 2.93Å
166	P	56.9	Low	62.4	Low	100 Å²	100	72.7 Å²	72.7	65%	0.649	41%	0.405	S	S	*	.			trans	-57.3	144.4	176.1	-20.2	31.2	0	0	0	110	R161 G164	R161-P166 PolarHBondContact NH1-O 3.07Å; G164-P166 VanDerWaalsContact O-CD 3.31Å; G164-P166 WeakPolarHBondContact O-CD 3.49Å
167	V	54.8	Low	62.6	Low	28 Å²	28	71.3 Å²	71.3	17%	0.17	40%	0.398	C	S	.	.			trans	-115.8	134.6	-179.9	-159.1	0	0	0	0	107.6	R137 Y191	R137-V167 VanDerWaalsContact CZ-CG2 3.43Å; V167-Y191 HydrophobicContact CB-CD2 4.39Å; V167-Y191 HydrophobicContact CB-CE2 3.91Å; V167-Y191 HydrophobicContact CG2-CD2 3.69Å; V167-Y191 HydrophobicContact CG2-CE2 3.74Å
168	R	54.5	Low	63.1	Low	219 Å²	219	74.4 Å²	74.4	83%	0.826	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-56.4	139.2	163	-69.9	-175.1	178.1	178.1	-0.1	107.9	Y170	R168-Y170 PolarHBondContact O-N 2.75Å
169	P	49	Very low	64.1	Low	101 Å²	101	74.4 Å²	74.4	66%	0.656	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-47.2	139.5	169.9	-23.6	31.9	0	0	0	109.2	T171	P169-T171 PolarHBondContact O-N 3.06Å
170	Y	48.1	Very low	65.1	Low	33 Å²	33	74.3 Å²	74.3	13%	0.129	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-54.1	139.1	171.7	-73	-82.7	0	0	0	108.4	R137 L159 R168 H172 V184	R137-Y170 PolarHBondContact NH2-OH 3.33Å; R137-Y170 PolarHBondContact O-OH 2.99Å; R137-Y170 VanDerWaalsContact O-OH 3.12Å; L159-Y170 HydrophobicContact CD1-CE1 3.81Å; L159-Y170 HydrophobicContact CD2-CD1 4.49Å; L159-Y170 HydrophobicContact CD2-CE1 3.76Å; L159-Y170 HydrophobicContact CG-CE1 4.37Å; R168-Y170 PolarHBondContact O-N 2.75Å; Y170-H172 PolarHBondContact O-N 3.49Å; Y170-V184 HydrophobicContact CE2-CG1 4.46Å
171	T	46.1	Very low	66.3	Low	121 Å²	121	74.2 Å²	74.2	74%	0.742	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-59.8	124.1	166.1	41.7	0	0	0	0	107.4	P169 E173	P169-T171 PolarHBondContact O-N 3.06Å; T171-E173 PolarHBondContact O-N 3.19Å
172	H	41.3	Very low	67.1	Low	134 Å²	134	71.6 Å²	71.6	62%	0.62	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-8	-160.4	-80	-86.2	0	0	0	115.4	Y170 E219	Y170-H172 PolarHBondContact O-N 3.49Å; H172-E219 IonicContact CE1-OE1 3.87Å; H172-E219 IonicContact CE1-OE2 3.47Å; H172-E219 PolarHBondContact CE1-OE2 2.76Å; H172-E219 IonicContact ND1-OE1 3.78Å; H172-E219 PolarHBondContact ND1-OE1 3.18Å; H172-E219 IonicContact ND1-OE2 2.88Å; H172-E219 PolarHBondContact ND1-OE2 3.01Å
173	E	38.4	Very low	68.3	Low	182 Å²	182	68.9 Å²	68.9	85%	0.85	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	-11.2	-156.4	-70.4	-173.2	150.4	0	0	117.5	T171	T171-E173 PolarHBondContact O-N 3.19Å
174	V	50.8	Low	69.4	Low	126 Å²	126	66.9 Å²	66.9	76%	0.764	36%	0.363	S	S	*	.	S	Bend	trans	-147	40	-170	-151.2	0	0	0	0	115.5
175	V	66.6	Low	71	Confident	39 Å²	39	64.3 Å²	64.3	24%	0.236	33%	0.334	C	S	.	.	S	Bend	trans	-135	133	176.6	-168.1	0	0	0	0	111.1	L177	V175-L177 PolarHBondContact O-N 2.91Å
176	T	77.9	Confident	72.6	Confident	55 Å²	55	61.3 Å²	61.3	34%	0.337	32%	0.316	S	S	.	.			trans	-53.4	121.2	174.7	-53	0	0	0	0	111.1	W178 Y179	T176-W178 HydrophobicContact CG2-CB 4.01Å; T176-W178 HydrophobicContact CG2-CD2 3.73Å; T176-W178 HydrophobicContact CG2-CE3 4.01Å; T176-W178 HydrophobicContact CG2-CG 3.73Å; T176-Y179 HydrophobicContact CG2-CD2 4.27Å; T176-Y179 HydrophobicContact CG2-CE2 3.85Å
177	L	91.6	Very high	74.2	Confident	20 Å²	20	57.6 Å²	57.6	11%	0.105	30%	0.296	C	S	.	.			trans	-84.5	-13.4	-176.7	-60	177.9	0	0	0	113.6	V175 Y179 R180 S218 E219 Q222	V175-L177 PolarHBondContact O-N 2.91Å; L177-Y179 PolarHBondContact O-N 3.04Å; L177-R180 VanDerWaalsContact CD2-NH1 3.27Å; L177-R180 WeakPolarHBondContact O-CB 3.5Å; L177-R180 PolarHBondContact O-N 3.36Å; L177-S218 WeakPolarHBondContact CD1-O 3.39Å; L177-E219 HydrophobicContact CD1-CG 4.18Å; L177-E219 HydrophobicContact CD2-CG 4.33Å; L177-Q222 HydrophobicContact CB-CB 4.24Å; L177-Q222 HydrophobicContact CB-CG 4.05Å; L177-Q222 HydrophobicContact CD1-CB 4.48Å; L177-Q222 VanDerWaalsContact O-CD 3.28Å; L177-Q222 PolarHBondContact O-NE2 3.36Å
178	W	96.1	Very high	75.7	Confident	68 Å²	68	57.6 Å²	57.6	26%	0.258	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-22.8	-162.9	-55.8	-13.5	0	0	0	115.2	T176 P212 F214 G216 Q222	T176-W178 HydrophobicContact CG2-CB 4.01Å; T176-W178 HydrophobicContact CG2-CD2 3.73Å; T176-W178 HydrophobicContact CG2-CE3 4.01Å; T176-W178 HydrophobicContact CG2-CG 3.73Å; W178-P212 HydrophobicContact CD2-CB 4.13Å; W178-P212 HydrophobicContact CD2-CG 4.32Å; W178-P212 HydrophobicContact CE3-CB 3.59Å; W178-P212 HydrophobicContact CE3-CG 3.42Å; W178-P212 VanDerWaalsContact CE3-CG 3.42Å; W178-P212 HydrophobicContact CH2-CG 4.26Å; W178-P212 HydrophobicContact CZ3-CB 4.08Å; W178-P212 HydrophobicContact CZ3-CG 3.38Å; W178-F214 VanDerWaalsContact CA-O 3.22Å; W178-F214 WeakPolarHBondContact CA-O 3.36Å; W178-F214 WeakPolarHBondContact CB-O 3.06Å; W178-G216 PolarHBondContact NE1-O 3.44Å; W178-Q222 PolarHBondContact O-NE2 3.37Å
179	Y	96.3	Very high	76.9	Confident	9 Å²	9	54.8 Å²	54.8	4%	0.035	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	5.1	-179.7	-41.9	-80.1	0	0	0	112.5	L139 K140 P141 T176 L177 S199 C202 I203 E206	L139-Y179 VanDerWaalsContact O-CB 3.32Å; L139-Y179 WeakPolarHBondContact O-CB 3.31Å; K140-Y179 HydrophobicContact CB-CD2 3.43Å; K140-Y179 VanDerWaalsContact CB-CD2 3.43Å; K140-Y179 HydrophobicContact CB-CE2 3.46Å; K140-Y179 VanDerWaalsContact CB-CE2 3.46Å; K140-Y179 HydrophobicContact CB-CG 4.16Å; P141-Y179 WeakPolarHBondContact CD-OH 3.38Å; P141-Y179 HydrophobicContact CG-CE1 4.07Å; P141-Y179 WeakPolarHBondContact CG-OH 3.44Å; T176-Y179 HydrophobicContact CG2-CD2 4.27Å; T176-Y179 HydrophobicContact CG2-CE2 3.85Å; L177-Y179 PolarHBondContact O-N 3.04Å; Y179-S199 PolarHBondContact O-OG 3.48Å; Y179-C202 HydrophobicContact CD1-CB 3.77Å; Y179-I203 HydrophobicContact CD1-CG1 3.77Å; Y179-I203 HydrophobicContact CE1-CG1 3.93Å; Y179-E206 WeakPolarHBondContact CE1-OE2 3.28Å; Y179-E206 PolarHBondContact OH-OE2 3.39Å
180	R	94	Very high	78.2	Confident	25 Å²	25	60.4 Å²	60.4	9%	0.094	30%	0.301	C	S	.	.			trans	-76.5	131.1	-177.3	-170	172.2	-72.6	179	3.7	110.2	L177 V184 L185 W198 E219	L177-R180 VanDerWaalsContact CD2-NH1 3.27Å; L177-R180 WeakPolarHBondContact O-CB 3.5Å; L177-R180 PolarHBondContact O-N 3.36Å; R180-V184 HydrophobicContact CG-CB 3.79Å; R180-V184 HydrophobicContact CG-CG1 3.88Å; R180-V184 HydrophobicContact CG-CG2 4.46Å; R180-L185 HydrophobicContact CG-CD2 4.18Å; R180-L185 HydrophobicContact CG-CG 4.1Å; R180-W198 PolarHBondContact O-NE1 2.81Å; R180-E219 IonicContact NH1-OE1 3.43Å; R180-E219 PolarHBondContact NH1-OE1 3.14Å
181	A	95.2	Very high	79.6	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.3	C	S	.	.			trans	-72.4	148.5	-179	0	0	0	0	0	111.9	E183 V184 L185 L195 W198	A181-E183 HydrophobicContact CB-CG 4.33Å; A181-E183 WeakPolarHBondContact CB-OE1 3.46Å; A181-E183 VanDerWaalsContact CB-OE2 3.31Å; A181-E183 WeakPolarHBondContact CB-OE2 3.18Å; A181-E183 PolarHBondContact O-N 3.34Å; A181-V184 HydrophobicContact CB-CG2 4.41Å; A181-V184 WeakPolarHBondContact O-CB 3.48Å; A181-V184 PolarHBondContact O-N 2.85Å; A181-L185 PolarHBondContact O-N 3.28Å; A181-L195 HydrophobicContact CB-CG 4.27Å; A181-W198 VanDerWaalsContact CA-CD1 3.46Å; A181-W198 HydrophobicContact CB-CB 3.78Å; A181-W198 HydrophobicContact CB-CD2 4.3Å; A181-W198 HydrophobicContact CB-CG 3.7Å
182	P	95.8	Very high	81.5	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-60.7	-32.3	-176.2	24.6	-34.7	0	0	0	112.3	V184 L185 L186 W198 Y280	P182-V184 PolarHBondContact O-N 3.47Å; P182-L185 PolarHBondContact O-N 3.4Å; P182-L186 VanDerWaalsContact O-CB 3.29Å; P182-L186 WeakPolarHBondContact O-CB 3.45Å; P182-L186 VanDerWaalsContact O-CG 3.28Å; P182-L186 WeakPolarHBondContact O-CG 3.41Å; P182-L186 PolarHBondContact O-N 3.01Å; P182-W198 HydrophobicContact CG-CE3 4.16Å; P182-W198 HydrophobicContact CG-CH2 3.86Å; P182-W198 HydrophobicContact CG-CZ2 4.29Å; P182-W198 HydrophobicContact CG-CZ3 3.79Å; P182-Y280 HydrophobicContact CB-CD1 4.14Å; P182-Y280 HydrophobicContact CB-CE1 4.28Å; P182-Y280 HydrophobicContact CG-CD1 3.88Å; P182-Y280 HydrophobicContact CG-CE1 4.33Å
183	E	93.7	Very high	84	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.009	27%	0.266	C	S	.	.	H	α-helix	trans	-63.4	-28.9	175.7	64.5	-89.1	-155.5	0	0	114	A181 G187 C188 W238 P282 R285	A181-E183 HydrophobicContact CB-CG 4.33Å; A181-E183 WeakPolarHBondContact CB-OE1 3.46Å; A181-E183 VanDerWaalsContact CB-OE2 3.31Å; A181-E183 WeakPolarHBondContact CB-OE2 3.18Å; A181-E183 PolarHBondContact O-N 3.34Å; E183-G187 PolarHBondContact O-N 3.5Å; E183-C188 HydrophobicContact CB-CB 4.02Å; E183-C188 WeakPolarHBondContact O-CB 3.21Å; E183-C188 PolarHBondContact O-N 2.77Å; E183-W238 HydrophobicContact CB-CH2 3.43Å; E183-W238 VanDerWaalsContact CB-CH2 3.43Å; E183-W238 HydrophobicContact CB-CZ2 4.17Å; E183-W238 HydrophobicContact CB-CZ3 4.24Å; E183-P282 HydrophobicContact CB-CG 4.01Å; E183-P282 HydrophobicContact CG-CG 3.9Å; E183-R285 IonicContact OE1-CZ 3.92Å; E183-R285 IonicContact OE1-NH1 2.95Å; E183-R285 PolarHBondContact OE1-NH1 3.23Å; E183-R285 IonicContact OE1-NH2 3.57Å; E183-R285 IonicContact OE2-CZ 2.71Å; E183-R285 IonicContact OE2-NH1 2.87Å; E183-R285 PolarHBondContact OE2-NH1 3.35Å; E183-R285 IonicContact OE2-NH2 3.62Å; E183-R285 PolarHBondContact OE2-NH2 2.88Å
184	V	91.2	Very high	86.6	Confident	16 Å²	16	45.4 Å²	45.4	10%	0.097	23%	0.23	C	C	.	.	H	α-helix	trans	-75.3	-45.5	175.1	-175.6	0	0	0	0	109.7	Y170 R180 A181 P182 L186 G187 Y191 L195	Y170-V184 HydrophobicContact CE2-CG1 4.46Å; R180-V184 HydrophobicContact CG-CB 3.79Å; R180-V184 HydrophobicContact CG-CG1 3.88Å; R180-V184 HydrophobicContact CG-CG2 4.46Å; A181-V184 HydrophobicContact CB-CG2 4.41Å; A181-V184 WeakPolarHBondContact O-CB 3.48Å; A181-V184 PolarHBondContact O-N 2.85Å; P182-V184 PolarHBondContact O-N 3.47Å; V184-L186 VanDerWaalsContact C-N 3.25Å; V184-L186 PolarHBondContact O-N 3.23Å; V184-G187 PolarHBondContact O-N 2.94Å; V184-G187 VanDerWaalsContact O-N 3.13Å; V184-Y191 HydrophobicContact CB-CE1 4.35Å; V184-Y191 HydrophobicContact CG1-CE1 4.44Å; V184-Y191 HydrophobicContact CG2-CD1 4.04Å; V184-Y191 HydrophobicContact CG2-CE1 3.81Å; V184-L195 HydrophobicContact CG2-CD1 3.53Å; V184-L195 HydrophobicContact CG2-CG 4.15Å
185	L	93.2	Very high	88.7	Confident	10 Å²	10	39.7 Å²	39.7	5%	0.052	20%	0.195	C	C	.	.	H	α-helix	trans	-64.3	-30.7	178.5	-65.2	167.9	0	0	0	112.6	R180 A181 P182 G187 E219 Q222 L223 I226	R180-L185 HydrophobicContact CG-CD2 4.18Å; R180-L185 HydrophobicContact CG-CG 4.1Å; A181-L185 PolarHBondContact O-N 3.28Å; P182-L185 PolarHBondContact O-N 3.4Å; L185-G187 VanDerWaalsContact C-N 3.29Å; L185-E219 HydrophobicContact CD2-CB 4Å; L185-E219 HydrophobicContact CD2-CG 4.17Å; L185-Q222 HydrophobicContact CD1-CB 4.18Å; L185-Q222 HydrophobicContact CD1-CG 3.6Å; L185-Q222 HydrophobicContact CD2-CB 4.44Å; L185-Q222 HydrophobicContact CD2-CG 4.32Å; L185-L223 HydrophobicContact CB-CD1 4.12Å; L185-L223 HydrophobicContact CD1-CB 4.44Å; L185-L223 HydrophobicContact CD1-CD1 4.31Å; L185-I226 HydrophobicContact CD1-CD1 3.79Å
186	L	94.1	Very high	90	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	3.8	177.7	-69.2	168.1	0	0	0	113.2	P182 V184 L223 W238 V241 L244 E246 Y247 F251	P182-L186 VanDerWaalsContact O-CB 3.29Å; P182-L186 WeakPolarHBondContact O-CB 3.45Å; P182-L186 VanDerWaalsContact O-CG 3.28Å; P182-L186 WeakPolarHBondContact O-CG 3.41Å; P182-L186 PolarHBondContact O-N 3.01Å; V184-L186 VanDerWaalsContact C-N 3.25Å; V184-L186 PolarHBondContact O-N 3.23Å; L186-L223 HydrophobicContact CD1-CD1 4.43Å; L186-L223 HydrophobicContact CD2-CD1 4.23Å; L186-L223 HydrophobicContact CD2-CD2 3.73Å; L186-L223 HydrophobicContact CG-CD1 4.07Å; L186-L223 HydrophobicContact CG-CD2 4.42Å; L186-W238 HydrophobicContact CD1-CH2 4.48Å; L186-W238 HydrophobicContact CD1-CZ3 3.84Å; L186-V241 HydrophobicContact CD1-CG2 3.86Å; L186-L244 HydrophobicContact CB-CB 4.06Å; L186-L244 HydrophobicContact CB-CD1 3.58Å; L186-L244 HydrophobicContact CB-CG 4.45Å; L186-L244 HydrophobicContact CD1-CD1 3.81Å; L186-L244 HydrophobicContact CG-CD1 4.31Å; L186-L244 WeakPolarHBondContact O-CB 3.33Å; L186-E246 PolarHBondContact O-N 3.14Å; L186-Y247 HydrophobicContact CD2-CD2 4.2Å; L186-F251 HydrophobicContact CD2-CE2 3.94Å
187	G	89.7	Confident	91	Very high	22 Å²	22	35.3 Å²	35.3	23%	0.227	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	22.4	173.6	0	0	0	0	0	114.9	E183 V184 L185 Q189 P245	E183-G187 PolarHBondContact O-N 3.5Å; V184-G187 PolarHBondContact O-N 2.94Å; V184-G187 VanDerWaalsContact O-N 3.13Å; L185-G187 VanDerWaalsContact C-N 3.29Å; G187-Q189 PolarHBondContact O-N 3.44Å; G187-P245 WeakPolarHBondContact O-CD 3.31Å; G187-P245 WeakPolarHBondContact O-CG 3.3Å
188	C	87.1	Confident	91.3	Very high	28 Å²	28	34.3 Å²	34.3	19%	0.189	16%	0.163	C	C	.	.			trans	-60.2	132.7	172.7	-169.6	0	0	0	0	110.1	E183 R190 Y191 L244	E183-C188 HydrophobicContact CB-CB 4.02Å; E183-C188 WeakPolarHBondContact O-CB 3.21Å; E183-C188 PolarHBondContact O-N 2.77Å; C188-R190 PolarHBondContact SG-O 3.43Å; C188-Y191 WeakPolarHBondContact O-CE1 3.15Å; C188-Y191 PolarHBondContact O-OH 3.28Å; C188-L244 HydrophobicContact CB-CD2 3.99Å
189	Q	78.1	Confident	91.4	Very high	159 Å²	159	31.2 Å²	31.2	74%	0.743	15%	0.152	S	C	*	.	S	Bend	trans	-86.2	-18.6	-178.1	-65.3	-166.1	-5.9	0	0	114	G187	G187-Q189 PolarHBondContact O-N 3.44Å
190	R	77.3	Confident	91.5	Very high	220 Å²	220	30.8 Å²	30.8	83%	0.83	15%	0.15	S	C	*	.	S	Bend	trans	-117.4	109	-176.6	-68.2	-175.2	-179.9	-179.7	0.9	109.7	C188	C188-R190 PolarHBondContact SG-O 3.43Å
191	Y	78	Confident	91.7	Very high	29 Å²	29	29.6 Å²	29.6	11%	0.114	15%	0.145	C	C	.	.			trans	-89.5	145.8	178.4	-50.3	-49.3	0	0	0	111.5	V167 V184 C188 L195	V167-Y191 HydrophobicContact CB-CD2 4.39Å; V167-Y191 HydrophobicContact CB-CE2 3.91Å; V167-Y191 HydrophobicContact CG2-CD2 3.69Å; V167-Y191 HydrophobicContact CG2-CE2 3.74Å; V184-Y191 HydrophobicContact CB-CE1 4.35Å; V184-Y191 HydrophobicContact CG1-CE1 4.44Å; V184-Y191 HydrophobicContact CG2-CD1 4.04Å; V184-Y191 HydrophobicContact CG2-CE1 3.81Å; C188-Y191 WeakPolarHBondContact O-CE1 3.15Å; C188-Y191 PolarHBondContact O-OH 3.28Å; Y191-L195 HydrophobicContact CD1-CD1 4.41Å; Y191-L195 HydrophobicContact CG-CD1 4.17Å
192	T	86	Confident	91.8	Very high	60 Å²	60	29.7 Å²	29.7	37%	0.368	15%	0.146	S	C	.	.			trans	-111.7	171.5	172.7	75.5	0	0	0	0	109.7	M135 G194 L195	M135-T192 VanDerWaalsContact SD-O 3.36Å; T192-G194 PolarHBondContact O-N 3.48Å; T192-G194 PolarHBondContact OG1-N 2.85Å; T192-G194 VanDerWaalsContact OG1-N 3.13Å; T192-L195 WeakPolarHBondContact O-CB 3.46Å; T192-L195 PolarHBondContact O-N 3.03Å; T192-L195 VanDerWaalsContact O-N 3.14Å
193	M	92	Very high	91.9	Very high	58 Å²	58	29.7 Å²	29.7	29%	0.286	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-18.3	171.2	-66.6	174.5	-171.5	0	0	113.1	H130 M135 V163 L195 D196	H130-M193 HydrophobicContact CB-CE 4.25Å; H130-M193 HydrophobicContact CB-CG 4.37Å; H130-M193 HydrophobicContact CB-SD 3.56Å; H130-M193 VanDerWaalsContact CB-SD 3.56Å; H130-M193 PolarHBondContact CE1-O 3.35Å; H130-M193 WeakPolarHBondContact O-CE 3.04Å; M135-M193 HydrophobicContact CG-CG 4.16Å; V163-M193 HydrophobicContact CG2-CE 3.6Å; V163-M193 HydrophobicContact CG2-CG 3.88Å; M193-L195 PolarHBondContact O-N 3Å; M193-D196 PolarHBondContact O-N 2.91Å
194	G	94.3	Very high	92.1	Very high	8 Å²	8	29.6 Å²	29.6	8%	0.082	15%	0.146	C	C	.	.	H	α-helix	trans	-58.3	-26.3	175.5	0	0	0	0	0	113.1	T192 D196 I197 W198 R285	T192-G194 PolarHBondContact O-N 3.48Å; T192-G194 PolarHBondContact OG1-N 2.85Å; T192-G194 VanDerWaalsContact OG1-N 3.13Å; G194-D196 PolarHBondContact O-N 3.34Å; G194-I197 WeakPolarHBondContact O-CB 3.46Å; G194-I197 PolarHBondContact O-N 2.82Å; G194-I197 VanDerWaalsContact O-N 3.17Å; G194-W198 PolarHBondContact O-N 3.31Å; G194-R285 WeakPolarHBondContact O-CD 3.4Å; G194-R285 PolarHBondContact O-NH1 3.24Å
195	L	93.6	Very high	92.3	Very high	5 Å²	5	28.9 Å²	28.9	3%	0.026	14%	0.141	C	C	.	.	H	α-helix	trans	-57.4	-49.3	176.8	-174.4	166.3	0	0	0	111	R137 A181 V184 Y191 T192 M193 I197 W198 S199	R137-L195 HydrophobicContact CB-CD2 4.46Å; A181-L195 HydrophobicContact CB-CG 4.27Å; V184-L195 HydrophobicContact CG2-CD1 3.53Å; V184-L195 HydrophobicContact CG2-CG 4.15Å; Y191-L195 HydrophobicContact CD1-CD1 4.41Å; Y191-L195 HydrophobicContact CG-CD1 4.17Å; T192-L195 WeakPolarHBondContact O-CB 3.46Å; T192-L195 PolarHBondContact O-N 3.03Å; T192-L195 VanDerWaalsContact O-N 3.14Å; M193-L195 PolarHBondContact O-N 3Å; L195-I197 VanDerWaalsContact C-N 3.27Å; L195-I197 PolarHBondContact O-N 3.43Å; L195-W198 WeakPolarHBondContact O-CB 3.31Å; L195-W198 PolarHBondContact O-N 3.17Å; L195-S199 PolarHBondContact O-N 3.2Å; L195-S199 PolarHBondContact O-OG 3.45Å
196	D	95.6	Very high	92.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63.7	-36.3	178.6	-65.5	-31.7	0	0	0	111.4	I126 H130 M135 H136 R137 L139 M193 G194 W198 S199 I200	I126-D196 HydrophobicContact CD1-CB 4.05Å; I126-D196 HydrophobicContact CG1-CB 3.89Å; H130-D196 IonicContact CD2-OD2 2.73Å; H130-D196 IonicContact CE1-OD2 3.15Å; H130-D196 IonicContact NE2-OD2 2.63Å; H130-D196 PolarHBondContact NE2-OD2 2.83Å; M135-D196 VanDerWaalsContact CA-OD2 3.3Å; M135-D196 WeakPolarHBondContact CA-OD2 3.41Å; H136-D196 PolarHBondContact N-OD1 3.31Å; H136-D196 PolarHBondContact N-OD2 3.39Å; R137-D196 PolarHBondContact N-OD1 3.34Å; L139-D196 HydrophobicContact CD1-CB 3.84Å; M193-D196 PolarHBondContact O-N 2.91Å; G194-D196 PolarHBondContact O-N 3.34Å; D196-W198 VanDerWaalsContact C-N 3.34Å; D196-W198 PolarHBondContact O-N 2.99Å; D196-S199 PolarHBondContact O-N 3.42Å; D196-I200 VanDerWaalsContact O-CG1 3.26Å; D196-I200 WeakPolarHBondContact O-CG1 3.32Å; D196-I200 PolarHBondContact O-N 2.93Å
197	I	98.3	Very high	92.4	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-64.2	-40	178.1	-55.3	-56.1	0	0	0	111.6	G194 L195 I200 G201 M277 R285 I286 I291	G194-I197 WeakPolarHBondContact O-CB 3.46Å; G194-I197 PolarHBondContact O-N 2.82Å; G194-I197 VanDerWaalsContact O-N 3.17Å; L195-I197 VanDerWaalsContact C-N 3.27Å; L195-I197 PolarHBondContact O-N 3.43Å; I197-I200 PolarHBondContact O-N 2.95Å; I197-G201 PolarHBondContact O-N 2.9Å; I197-M277 HydrophobicContact CG2-CB 4.09Å; I197-M277 HydrophobicContact CG2-CG 4.05Å; I197-R285 HydrophobicContact CB-CG 4.32Å; I197-R285 HydrophobicContact CG2-CG 3.96Å; I197-I286 WeakPolarHBondContact CG1-O 3.37Å; I197-I286 HydrophobicContact CG2-CG2 4.1Å; I197-I286 WeakPolarHBondContact CG2-O 3.5Å; I197-I291 HydrophobicContact CD1-CD1 3.84Å; I197-I291 HydrophobicContact CG2-CD1 3.92Å
198	W	98.2	Very high	92.6	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.1	-49.5	175	178.6	-83.3	0	0	0	110.9	R180 A181 P182 G194 L195 D196 I200 G201 C202 F214 I226 L230 L278	R180-W198 PolarHBondContact O-NE1 2.81Å; A181-W198 VanDerWaalsContact CA-CD1 3.46Å; A181-W198 HydrophobicContact CB-CB 3.78Å; A181-W198 HydrophobicContact CB-CD2 4.3Å; A181-W198 HydrophobicContact CB-CG 3.7Å; P182-W198 HydrophobicContact CG-CE3 4.16Å; P182-W198 HydrophobicContact CG-CH2 3.86Å; P182-W198 HydrophobicContact CG-CZ2 4.29Å; P182-W198 HydrophobicContact CG-CZ3 3.79Å; G194-W198 PolarHBondContact O-N 3.31Å; L195-W198 WeakPolarHBondContact O-CB 3.31Å; L195-W198 PolarHBondContact O-N 3.17Å; D196-W198 VanDerWaalsContact C-N 3.34Å; D196-W198 PolarHBondContact O-N 2.99Å; W198-I200 VanDerWaalsContact C-N 3.29Å; W198-I200 PolarHBondContact O-N 3.35Å; W198-G201 WeakPolarHBondContact O-CA 3.4Å; W198-G201 PolarHBondContact O-N 3.16Å; W198-C202 PolarHBondContact O-N 3.45Å; W198-F214 HydrophobicContact CH2-CE2 4.37Å; W198-F214 HydrophobicContact CZ2-CD2 4.23Å; W198-F214 AromaticContact CZ2-CE2 3.59Å; W198-F214 HydrophobicContact CZ2-CE2 3.59Å; W198-F214 HydrophobicContact CZ2-CZ 4.16Å; W198-I226 HydrophobicContact CH2-CG2 3.66Å; W198-I226 HydrophobicContact CZ2-CD1 3.77Å; W198-I226 HydrophobicContact CZ2-CG1 3.96Å; W198-I226 HydrophobicContact CZ2-CG2 3.83Å; W198-L230 HydrophobicContact CH2-CD1 3.55Å; W198-L230 HydrophobicContact CZ2-CD1 4.48Å; W198-L230 HydrophobicContact CZ3-CD1 4.14Å; W198-L278 HydrophobicContact CD2-CD2 3.82Å; W198-L278 HydrophobicContact CE3-CB 4.41Å; W198-L278 HydrophobicContact CE3-CD2 3.87Å; W198-L278 HydrophobicContact CG-CD2 4.34Å; W198-L278 HydrophobicContact CH2-CD2 4.37Å; W198-L278 HydrophobicContact CZ2-CD2 4.3Å; W198-L278 HydrophobicContact CZ3-CB 4.1Å; W198-L278 HydrophobicContact CZ3-CD2 4.16Å; W198-L278 WeakPolarHBondContact CZ3-O 3.28Å
199	S	97.4	Very high	92.8	Very high	3 Å²	3	28 Å²	28	2%	0.021	13%	0.132	C	C	.	.	H	α-helix	trans	-58.3	-42.1	178.1	-54	0	0	0	0	111.6	Y179 L195 D196 G201 C202 I203	Y179-S199 PolarHBondContact O-OG 3.48Å; L195-S199 PolarHBondContact O-N 3.2Å; L195-S199 PolarHBondContact O-OG 3.45Å; D196-S199 PolarHBondContact O-N 3.42Å; S199-G201 VanDerWaalsContact C-N 3.34Å; S199-G201 PolarHBondContact O-N 3.32Å; S199-C202 WeakPolarHBondContact O-CB 3.46Å; S199-C202 PolarHBondContact O-N 3.02Å; S199-I203 WeakPolarHBondContact O-CD1 3.16Å; S199-I203 VanDerWaalsContact O-CG1 3.22Å; S199-I203 WeakPolarHBondContact O-CG1 2.79Å; S199-I203 PolarHBondContact O-N 3.25Å
200	I	98.2	Very high	93.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.1	-39.1	174.8	-67.2	166.3	0	0	0	111.5	L119 I122 I126 L139 D196 I197 W198 I203 F204 M277	L119-I200 HydrophobicContact CD1-CG2 3.71Å; I122-I200 HydrophobicContact CG2-CD1 4.02Å; I122-I200 HydrophobicContact CG2-CG1 3.86Å; I122-I200 HydrophobicContact CG2-CG2 4.37Å; I126-I200 HydrophobicContact CB-CD1 3.98Å; I126-I200 HydrophobicContact CG1-CD1 4.15Å; I126-I200 HydrophobicContact CG2-CD1 3.56Å; L139-I200 HydrophobicContact CD1-CD1 3.85Å; L139-I200 HydrophobicContact CD1-CG1 3.66Å; D196-I200 VanDerWaalsContact O-CG1 3.26Å; D196-I200 WeakPolarHBondContact O-CG1 3.32Å; D196-I200 PolarHBondContact O-N 2.93Å; I197-I200 PolarHBondContact O-N 2.95Å; W198-I200 VanDerWaalsContact C-N 3.29Å; W198-I200 PolarHBondContact O-N 3.35Å; I200-I203 PolarHBondContact O-N 3.42Å; I200-F204 WeakPolarHBondContact O-CB 3.26Å; I200-F204 PolarHBondContact O-N 3.38Å; I200-M277 HydrophobicContact CG2-CE 4.21Å
201	G	98	Very high	94	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-59.2	-47.7	173.2	0	0	0	0	0	112.1	I197 W198 S199 I203 F204 A205 L274	I197-G201 PolarHBondContact O-N 2.9Å; W198-G201 WeakPolarHBondContact O-CA 3.4Å; W198-G201 PolarHBondContact O-N 3.16Å; S199-G201 VanDerWaalsContact C-N 3.34Å; S199-G201 PolarHBondContact O-N 3.32Å; G201-I203 VanDerWaalsContact C-N 3.33Å; G201-I203 PolarHBondContact O-N 3.33Å; G201-F204 PolarHBondContact O-N 2.94Å; G201-A205 PolarHBondContact O-N 3.07Å; G201-L274 WeakPolarHBondContact O-CD1 3.28Å
202	C	98.3	Very high	94.9	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.007	10%	0.103	C	C	.	.	H	α-helix	trans	-58.5	-44.5	174.6	-65.5	0	0	0	0	112	Y179 W198 S199 A205 E206 F214	Y179-C202 HydrophobicContact CD1-CB 3.77Å; W198-C202 PolarHBondContact O-N 3.45Å; S199-C202 WeakPolarHBondContact O-CB 3.46Å; S199-C202 PolarHBondContact O-N 3.02Å; C202-A205 PolarHBondContact O-N 3.29Å; C202-E206 WeakPolarHBondContact O-CB 3.28Å; C202-E206 PolarHBondContact O-N 2.94Å; C202-F214 VanDerWaalsContact SG-CD2 3.53Å
203	I	97.3	Very high	95.4	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-65.5	-39.3	178.4	-65.6	161.9	0	0	0	110.9	L96 I122 L139 P141 L144 Y179 S199 I200 G201 E206 M207	L96-I203 HydrophobicContact CD2-CG2 3.82Å; I122-I203 HydrophobicContact CD1-CG2 4.48Å; L139-I203 HydrophobicContact CB-CD1 4.14Å; P141-I203 HydrophobicContact CG-CG1 4.32Å; L144-I203 HydrophobicContact CD1-CD1 3.96Å; L144-I203 HydrophobicContact CD1-CG2 3.85Å; Y179-I203 HydrophobicContact CD1-CG1 3.77Å; Y179-I203 HydrophobicContact CE1-CG1 3.93Å; S199-I203 WeakPolarHBondContact O-CD1 3.16Å; S199-I203 VanDerWaalsContact O-CG1 3.22Å; S199-I203 WeakPolarHBondContact O-CG1 2.79Å; S199-I203 PolarHBondContact O-N 3.25Å; I200-I203 PolarHBondContact O-N 3.42Å; G201-I203 VanDerWaalsContact C-N 3.33Å; G201-I203 PolarHBondContact O-N 3.33Å; I203-E206 PolarHBondContact O-N 3.42Å; I203-M207 HydrophobicContact CG2-CE 4.2Å; I203-M207 HydrophobicContact CG2-CG 4.34Å; I203-M207 HydrophobicContact CG2-SD 4.45Å; I203-M207 WeakPolarHBondContact O-CG 3.33Å; I203-M207 PolarHBondContact O-N 3.32Å
204	F	97.4	Very high	95.7	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-60.5	-48.3	175.8	177.5	-153.5	0	0	0	111.2	V114 L119 I200 G201 E206 M207 A208 I266 L273 L274 M277 Y296	V114-F204 HydrophobicContact CG1-CD2 3.94Å; V114-F204 HydrophobicContact CG1-CE2 3.87Å; L119-F204 HydrophobicContact CD1-CB 3.84Å; L119-F204 HydrophobicContact CD1-CD2 4.45Å; L119-F204 HydrophobicContact CD1-CG 4.04Å; L119-F204 HydrophobicContact CD2-CB 4.43Å; L119-F204 HydrophobicContact CD2-CD1 3.74Å; L119-F204 HydrophobicContact CD2-CD2 3.76Å; L119-F204 HydrophobicContact CD2-CE1 3.85Å; L119-F204 HydrophobicContact CD2-CE2 3.89Å; L119-F204 HydrophobicContact CD2-CG 3.71Å; L119-F204 HydrophobicContact CD2-CZ 3.93Å; L119-F204 HydrophobicContact CG-CG 4.45Å; I200-F204 WeakPolarHBondContact O-CB 3.26Å; I200-F204 PolarHBondContact O-N 3.38Å; G201-F204 PolarHBondContact O-N 2.94Å; F204-E206 VanDerWaalsContact C-N 3.31Å; F204-E206 PolarHBondContact O-N 2.78Å; F204-M207 PolarHBondContact O-N 3Å; F204-A208 WeakPolarHBondContact O-CB 3.43Å; F204-A208 PolarHBondContact O-N 3.04Å; F204-I266 HydrophobicContact CD2-CD1 4.44Å; F204-I266 HydrophobicContact CE1-CD1 4.25Å; F204-I266 HydrophobicContact CE2-CD1 3.89Å; F204-I266 HydrophobicContact CE2-CG2 4.41Å; F204-I266 HydrophobicContact CZ-CD1 3.78Å; F204-I266 HydrophobicContact CZ-CG2 3.79Å; F204-L273 HydrophobicContact CE1-CD2 4.4Å; F204-L274 HydrophobicContact CB-CD1 4.33Å; F204-L274 HydrophobicContact CD1-CB 4.27Å; F204-L274 HydrophobicContact CD1-CD1 3.81Å; F204-L274 HydrophobicContact CE1-CB 4.27Å; F204-L274 HydrophobicContact CG-CD1 4.43Å; F204-M277 HydrophobicContact CD1-SD 4.11Å; F204-Y296 HydrophobicContact CE1-CE1 4.48Å; F204-Y296 HydrophobicContact CE2-CE1 4.15Å; F204-Y296 AromaticContact CZ-CE1 3.71Å; F204-Y296 HydrophobicContact CZ-CE1 3.71Å; F204-Y296 HydrophobicContact CZ-CE2 4.25Å; F204-Y296 AromaticContact CZ-CZ 3.55Å; F204-Y296 WeakPolarHBondContact CZ-OH 3.28Å
205	A	96.2	Very high	95.7	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-60.7	-40.7	175.1	0	0	0	0	0	112.1	G201 C202 A208 T209 L213 V263 L274	G201-A205 PolarHBondContact O-N 3.07Å; C202-A205 PolarHBondContact O-N 3.29Å; A205-A208 PolarHBondContact O-N 2.91Å; A205-T209 WeakPolarHBondContact O-CB 3.46Å; A205-T209 VanDerWaalsContact O-CG2 3.3Å; A205-T209 WeakPolarHBondContact O-CG2 3.45Å; A205-T209 PolarHBondContact O-N 2.97Å; A205-T209 PolarHBondContact O-OG1 3.26Å; A205-L213 HydrophobicContact CB-CB 3.93Å; A205-L213 HydrophobicContact CB-CD1 4.26Å; A205-L213 HydrophobicContact CB-CD2 3.77Å; A205-L213 HydrophobicContact CB-CG 4.2Å; A205-V263 HydrophobicContact CB-CG1 3.74Å; A205-L274 HydrophobicContact CB-CD1 4.37Å; A205-L274 HydrophobicContact CB-CD2 4.07Å
206	E	95.7	Very high	95.8	Very high	5 Å²	5	19.7 Å²	19.7	2%	0.023	10%	0.095	C	C	.	.	H	α-helix	trans	-67.2	-42.6	178	-175.6	168.4	163.2	0	0	112.3	M100 Y179 C202 I203 F204 A208 T209 R210 K211 P212	M100-E206 HydrophobicContact CE-CG 3.93Å; M100-E206 HydrophobicContact SD-CG 4.18Å; Y179-E206 WeakPolarHBondContact CE1-OE2 3.28Å; Y179-E206 PolarHBondContact OH-OE2 3.39Å; C202-E206 WeakPolarHBondContact O-CB 3.28Å; C202-E206 PolarHBondContact O-N 2.94Å; I203-E206 PolarHBondContact O-N 3.42Å; F204-E206 VanDerWaalsContact C-N 3.31Å; F204-E206 PolarHBondContact O-N 2.78Å; E206-A208 PolarHBondContact O-N 3.47Å; E206-T209 PolarHBondContact O-N 3.35Å; E206-R210 WeakPolarHBondContact O-CA 3.38Å; E206-R210 PolarHBondContact O-N 3.31Å; E206-K211 WeakPolarHBondContact CA-O 3.1Å; E206-P212 WeakPolarHBondContact OE2-CA 3.44Å
207	M	94.5	Very high	95.6	Very high	1 Å²	1	26 Å²	26	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-59.2	-40.2	173.1	-72.3	-171.5	-64.2	0	0	111.4	L96 M100 L109 V114 Y118 L119 I122 I203 F204 T209	L96-M207 HydrophobicContact CD1-CG 4.28Å; L96-M207 HydrophobicContact CD1-SD 4.18Å; L96-M207 HydrophobicContact CD2-CG 3.96Å; L96-M207 HydrophobicContact CD2-SD 3.84Å; M100-M207 HydrophobicContact SD-CG 4.15Å; L109-M207 HydrophobicContact CD1-CB 3.98Å; L109-M207 HydrophobicContact CD1-CG 4.28Å; L109-M207 WeakPolarHBondContact CD1-O 3.33Å; V114-M207 HydrophobicContact CG1-CB 3.97Å; V114-M207 HydrophobicContact CG1-CE 4.3Å; V114-M207 HydrophobicContact CG2-CB 4.21Å; Y118-M207 VanDerWaalsContact CB-SD 3.52Å; Y118-M207 HydrophobicContact CD2-SD 4.01Å; Y118-M207 HydrophobicContact CG-SD 4.23Å; L119-M207 HydrophobicContact CB-CE 4.34Å; I122-M207 HydrophobicContact CD1-CE 4.25Å; I203-M207 HydrophobicContact CG2-CE 4.2Å; I203-M207 HydrophobicContact CG2-CG 4.34Å; I203-M207 HydrophobicContact CG2-SD 4.45Å; I203-M207 WeakPolarHBondContact O-CG 3.33Å; I203-M207 PolarHBondContact O-N 3.32Å; F204-M207 PolarHBondContact O-N 3Å; M207-T209 PolarHBondContact O-N 3.11Å
208	A	92.6	Very high	95.4	Very high	9 Å²	9	28 Å²	28	7%	0.074	14%	0.143	C	C	.	.	H	α-helix	trans	-73.3	-24.9	-179.3	0	0	0	0	0	113.9	M108 F204 A205 E206 S265 I266	M108-A208 WeakPolarHBondContact CE-O 3.46Å; F204-A208 WeakPolarHBondContact O-CB 3.43Å; F204-A208 PolarHBondContact O-N 3.04Å; A205-A208 PolarHBondContact O-N 2.91Å; E206-A208 PolarHBondContact O-N 3.47Å; A208-S265 WeakPolarHBondContact O-CB 3.04Å; A208-S265 PolarHBondContact O-OG 2.88Å; A208-I266 HydrophobicContact CB-CD1 3.42Å; A208-I266 VanDerWaalsContact CB-CD1 3.42Å; A208-I266 HydrophobicContact CB-CG1 3.39Å
209	T	91.5	Very high	95.1	Very high	28 Å²	28	31 Å²	31	17%	0.172	16%	0.157	C	C	.	.	H	α-helix	trans	-121	-11.4	-170.1	63.6	0	0	0	0	114.2	A205 E206 M207 K211 H262 V263	A205-T209 WeakPolarHBondContact O-CB 3.46Å; A205-T209 VanDerWaalsContact O-CG2 3.3Å; A205-T209 WeakPolarHBondContact O-CG2 3.45Å; A205-T209 PolarHBondContact O-N 2.97Å; A205-T209 PolarHBondContact O-OG1 3.26Å; E206-T209 PolarHBondContact O-N 3.35Å; M207-T209 PolarHBondContact O-N 3.11Å; T209-K211 PolarHBondContact O-N 3.34Å; T209-K211 PolarHBondContact OG1-N 2.94Å; T209-K211 PolarHBondContact OG1-O 3.2Å; T209-K211 VanDerWaalsContact OG1-O 3.09Å; T209-H262 VanDerWaalsContact CG2-O 3.31Å; T209-H262 WeakPolarHBondContact CG2-O 3.46Å; T209-V263 HydrophobicContact CG2-CB 4.41Å; T209-V263 HydrophobicContact CG2-CG1 4.02Å
210	R	89.9	Confident	95	Very high	67 Å²	67	34.7 Å²	34.7	25%	0.253	18%	0.175	S	C	.	.	S	Bend	trans	58.4	15.2	-168.5	-61.6	-174.6	61.1	-171	-0.2	114.9	M100 L103 S104 K107 E206	M100-R210 PolarHBondContact O-NE 3.38Å; M100-R210 PolarHBondContact O-NH2 3.04Å; L103-R210 PolarHBondContact O-NH1 3.19Å; L103-R210 PolarHBondContact O-NH2 3.07Å; S104-R210 PolarHBondContact O-NH1 3.36Å; K107-R210 WeakPolarHBondContact O-CD 3.18Å; K107-R210 PolarHBondContact O-NH1 2.82Å; E206-R210 WeakPolarHBondContact O-CA 3.38Å; E206-R210 PolarHBondContact O-N 3.31Å
211	K	91.7	Very high	94.8	Very high	153 Å²	153	36.2 Å²	36.2	67%	0.665	18%	0.184	S	C	*	.	S	Bend	trans	-129.4	135.7	180	-66	-178.6	-176.8	177.8	0	109.2	E206 T209 L213	E206-K211 WeakPolarHBondContact CA-O 3.1Å; T209-K211 PolarHBondContact O-N 3.34Å; T209-K211 PolarHBondContact OG1-N 2.94Å; T209-K211 PolarHBondContact OG1-O 3.2Å; T209-K211 VanDerWaalsContact OG1-O 3.09Å; K211-L213 PolarHBondContact O-N 3.34Å
212	P	95.4	Very high	94.8	Very high	27 Å²	27	36.2 Å²	36.2	18%	0.175	18%	0.184	C	C	.	.			trans	-57.3	128.3	173	-19.1	28.6	0	0	0	109.8	W178 E206 F214 H215	W178-P212 HydrophobicContact CD2-CB 4.13Å; W178-P212 HydrophobicContact CD2-CG 4.32Å; W178-P212 HydrophobicContact CE3-CB 3.59Å; W178-P212 HydrophobicContact CE3-CG 3.42Å; W178-P212 VanDerWaalsContact CE3-CG 3.42Å; W178-P212 HydrophobicContact CH2-CG 4.26Å; W178-P212 HydrophobicContact CZ3-CB 4.08Å; W178-P212 HydrophobicContact CZ3-CG 3.38Å; E206-P212 WeakPolarHBondContact OE2-CA 3.44Å; P212-F214 VanDerWaalsContact C-N 3.31Å; P212-F214 PolarHBondContact O-N 2.87Å; P212-H215 HydrophobicContact CB-CB 4.25Å
213	L	97.5	Very high	94.7	Very high	15 Å²	15	36.4 Å²	36.4	8%	0.079	18%	0.184	C	C	.	.	S	Bend	trans	-62.1	-40.8	-176.5	-178.8	62.6	0	0	0	111.8	A205 K211 I229 L259 H262 L278	A205-L213 HydrophobicContact CB-CB 3.93Å; A205-L213 HydrophobicContact CB-CD1 4.26Å; A205-L213 HydrophobicContact CB-CD2 3.77Å; A205-L213 HydrophobicContact CB-CG 4.2Å; K211-L213 PolarHBondContact O-N 3.34Å; L213-I229 HydrophobicContact CD1-CD1 4.01Å; L213-I229 HydrophobicContact CG-CD1 4.43Å; L213-I229 WeakPolarHBondContact O-CD1 3.43Å; L213-L259 HydrophobicContact CD1-CD1 4.13Å; L213-L259 HydrophobicContact CD2-CD1 3.9Å; L213-H262 HydrophobicContact CD1-CB 4.07Å; L213-L278 HydrophobicContact CD2-CD1 3.59Å
214	F	97.7	Very high	94.8	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.	S	Bend	trans	-127.1	96.1	179.6	-49.3	-60.6	0	0	0	109.5	W178 W198 C202 P212 G216 Q222 R225 I226 I229 L230 L278	W178-F214 VanDerWaalsContact CA-O 3.22Å; W178-F214 WeakPolarHBondContact CA-O 3.36Å; W178-F214 WeakPolarHBondContact CB-O 3.06Å; W198-F214 HydrophobicContact CH2-CE2 4.37Å; W198-F214 HydrophobicContact CZ2-CD2 4.23Å; W198-F214 AromaticContact CZ2-CE2 3.59Å; W198-F214 HydrophobicContact CZ2-CE2 3.59Å; W198-F214 HydrophobicContact CZ2-CZ 4.16Å; C202-F214 VanDerWaalsContact SG-CD2 3.53Å; P212-F214 VanDerWaalsContact C-N 3.31Å; P212-F214 PolarHBondContact O-N 2.87Å; F214-G216 PolarHBondContact O-N 3.1Å; F214-Q222 PolarHBondContact O-NE2 3.46Å; F214-Q222 PolarHBondContact O-OE1 3.29Å; F214-Q222 VanDerWaalsContact O-OE1 3.12Å; F214-R225 HydrophobicContact CB-CB 4.48Å; F214-I226 HydrophobicContact CB-CG1 4.23Å; F214-I226 HydrophobicContact CD1-CB 4.38Å; F214-I226 HydrophobicContact CD1-CG1 3.85Å; F214-I226 HydrophobicContact CD2-CG1 3.9Å; F214-I226 HydrophobicContact CE1-CB 4.36Å; F214-I226 HydrophobicContact CE1-CG1 4.13Å; F214-I226 HydrophobicContact CE2-CG1 4.17Å; F214-I226 HydrophobicContact CG-CG1 3.73Å; F214-I226 HydrophobicContact CZ-CG1 4.28Å; F214-I229 HydrophobicContact CD1-CD1 3.91Å; F214-I229 HydrophobicContact CE1-CB 4Å; F214-I229 HydrophobicContact CE1-CD1 3.82Å; F214-I229 HydrophobicContact CE1-CG1 4.32Å; F214-I229 HydrophobicContact CE1-CG2 4.31Å; F214-L230 HydrophobicContact CZ-CD1 4.11Å; F214-L230 HydrophobicContact CZ-CG 4.28Å; F214-L278 HydrophobicContact CE2-CD1 4.43Å; F214-L278 HydrophobicContact CE2-CD2 4.39Å; F214-L278 HydrophobicContact CZ-CD1 4.29Å
215	H	95.2	Very high	94.8	Very high	97 Å²	97	42.4 Å²	42.4	45%	0.449	21%	0.209	S	C	.	.			trans	-100.3	59.5	-172.6	62.7	90.6	0	0	0	113.2	P212 R225	P212-H215 HydrophobicContact CB-CB 4.25Å; H215-R225 VanDerWaalsContact C-NE 3.33Å; H215-R225 VanDerWaalsContact CE1-CZ 3.5Å; H215-R225 PolarHBondContact CE1-NH1 3.12Å; H215-R225 PolarHBondContact ND1-NH1 3.14Å; H215-R225 PolarHBondContact NE2-NH1 3.27Å; H215-R225 PolarHBondContact O-NE 2.95Å
216	G	95.1	Very high	94.9	Very high	5 Å²	5	42.4 Å²	42.4	5%	0.052	21%	0.209	C	C	.	.			trans	-70.2	144.5	-178.6	0	0	0	0	0	114.1	W178 F214 D221 Q222	W178-G216 PolarHBondContact NE1-O 3.44Å; F214-G216 PolarHBondContact O-N 3.1Å; G216-D221 VanDerWaalsContact CA-OD2 3.27Å; G216-D221 WeakPolarHBondContact CA-OD2 3.1Å; G216-Q222 VanDerWaalsContact CA-OE1 3.23Å
217	D	91.7	Very high	95	Very high	132 Å²	132	42.2 Å²	42.2	71%	0.706	21%	0.208	S	C	*	.	S	Bend	trans	-96.8	-14.4	173.3	63.4	14.2	0	0	0	114.1	D221	D217-D221 PolarHBondContact N-OD2 3.23Å; D217-D221 VanDerWaalsContact N-OD2 3.09Å; D217-D221 WeakPolarHBondContact OD1-CB 3.37Å
218	S	92.9	Very high	95.1	Very high	44 Å²	44	48.6 Å²	48.6	31%	0.308	24%	0.235	S	C	.	.	S	Bend	trans	-147.1	166.5	179.8	57.4	0	0	0	0	109.5	L177 I220 D221 Q222	L177-S218 WeakPolarHBondContact CD1-O 3.39Å; S218-I220 VanDerWaalsContact C-N 3.27Å; S218-I220 PolarHBondContact O-N 3.44Å; S218-D221 PolarHBondContact O-N 2.88Å; S218-D221 VanDerWaalsContact OG-CB 3.25Å; S218-D221 WeakPolarHBondContact OG-CB 3.09Å; S218-D221 PolarHBondContact OG-N 2.72Å; S218-Q222 VanDerWaalsContact O-CB 3.25Å; S218-Q222 WeakPolarHBondContact O-CB 3.45Å; S218-Q222 PolarHBondContact O-N 3.17Å
219	E	92.3	Very high	95.4	Very high	63 Å²	63	48.6 Å²	48.6	29%	0.294	23%	0.234	S	C	.	.	H	α-helix	trans	-61.5	-38.3	-179.3	-65	-170.1	148	0	0	112	H172 L177 R180 L185 L223	H172-E219 IonicContact CE1-OE1 3.87Å; H172-E219 IonicContact CE1-OE2 3.47Å; H172-E219 PolarHBondContact CE1-OE2 2.76Å; H172-E219 IonicContact ND1-OE1 3.78Å; H172-E219 PolarHBondContact ND1-OE1 3.18Å; H172-E219 IonicContact ND1-OE2 2.88Å; H172-E219 PolarHBondContact ND1-OE2 3.01Å; L177-E219 HydrophobicContact CD1-CG 4.18Å; L177-E219 HydrophobicContact CD2-CG 4.33Å; R180-E219 IonicContact NH1-OE1 3.43Å; R180-E219 PolarHBondContact NH1-OE1 3.14Å; L185-E219 HydrophobicContact CD2-CB 4Å; L185-E219 HydrophobicContact CD2-CG 4.17Å; E219-L223 WeakPolarHBondContact O-CB 3.48Å; E219-L223 PolarHBondContact O-N 2.73Å
220	I	95	Very high	95.7	Very high	80 Å²	80	47.9 Å²	47.9	41%	0.41	23%	0.229	S	C	.	.	H	α-helix	trans	-71.4	-42.1	177.4	-167.7	61	0	0	0	112.1	S218 L223 F224 F251	S218-I220 VanDerWaalsContact C-N 3.27Å; S218-I220 PolarHBondContact O-N 3.44Å; I220-L223 HydrophobicContact CD1-CD2 4.49Å; I220-L223 PolarHBondContact O-N 2.8Å; I220-F224 HydrophobicContact CD1-CD1 4.15Å; I220-F224 HydrophobicContact CD1-CE1 3.51Å; I220-F224 HydrophobicContact CD1-CE2 4.18Å; I220-F224 HydrophobicContact CD1-CZ 3.53Å; I220-F224 HydrophobicContact CG1-CD2 4.28Å; I220-F224 HydrophobicContact CG1-CE1 4.05Å; I220-F224 HydrophobicContact CG1-CE2 3.79Å; I220-F224 HydrophobicContact CG1-CZ 3.67Å; I220-F224 WeakPolarHBondContact O-CG 3.19Å; I220-F224 PolarHBondContact O-N 3.07Å; I220-F251 HydrophobicContact CD1-CD1 4.44Å; I220-F251 HydrophobicContact CD1-CE1 3.71Å; I220-F251 HydrophobicContact CD1-CZ 4.28Å
221	D	95.8	Very high	96	Very high	33 Å²	33	45 Å²	45	18%	0.176	22%	0.22	C	C	.	.	H	α-helix	trans	-64.9	-41.7	175.9	-176.2	50.1	0	0	0	110.9	G216 D217 S218 L223 F224 R225	G216-D221 VanDerWaalsContact CA-OD2 3.27Å; G216-D221 WeakPolarHBondContact CA-OD2 3.1Å; D217-D221 PolarHBondContact N-OD2 3.23Å; D217-D221 VanDerWaalsContact N-OD2 3.09Å; D217-D221 WeakPolarHBondContact OD1-CB 3.37Å; S218-D221 PolarHBondContact O-N 2.88Å; S218-D221 VanDerWaalsContact OG-CB 3.25Å; S218-D221 WeakPolarHBondContact OG-CB 3.09Å; S218-D221 PolarHBondContact OG-N 2.72Å; D221-L223 VanDerWaalsContact C-N 3.31Å; D221-L223 PolarHBondContact O-N 2.97Å; D221-F224 PolarHBondContact O-N 3.48Å; D221-R225 VanDerWaalsContact O-CG 3.32Å; D221-R225 WeakPolarHBondContact O-CG 3.43Å; D221-R225 PolarHBondContact O-N 3.04Å; D221-R225 IonicContact OD1-CZ 3.44Å; D221-R225 IonicContact OD1-NE 2.72Å; D221-R225 IonicContact OD1-NH2 3.92Å; D221-R225 PolarHBondContact OD1-NH2 3.27Å; D221-R225 IonicContact OD2-CZ 2.72Å; D221-R225 VanDerWaalsContact OD2-CZ 3.26Å; D221-R225 IonicContact OD2-NE 3.43Å; D221-R225 PolarHBondContact OD2-NE 2.85Å; D221-R225 IonicContact OD2-NH2 3.31Å; D221-R225 PolarHBondContact OD2-NH2 3.02Å
222	Q	96.9	Very high	96.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-56.4	-47.2	173.9	-176.9	65.7	32.6	0	0	111	L177 W178 L185 F214 G216 S218 R225 I226	L177-Q222 HydrophobicContact CB-CB 4.24Å; L177-Q222 HydrophobicContact CB-CG 4.05Å; L177-Q222 HydrophobicContact CD1-CB 4.48Å; L177-Q222 VanDerWaalsContact O-CD 3.28Å; L177-Q222 PolarHBondContact O-NE2 3.36Å; W178-Q222 PolarHBondContact O-NE2 3.37Å; L185-Q222 HydrophobicContact CD1-CB 4.18Å; L185-Q222 HydrophobicContact CD1-CG 3.6Å; L185-Q222 HydrophobicContact CD2-CB 4.44Å; L185-Q222 HydrophobicContact CD2-CG 4.32Å; F214-Q222 PolarHBondContact O-NE2 3.46Å; F214-Q222 PolarHBondContact O-OE1 3.29Å; F214-Q222 VanDerWaalsContact O-OE1 3.12Å; G216-Q222 VanDerWaalsContact CA-OE1 3.23Å; S218-Q222 VanDerWaalsContact O-CB 3.25Å; S218-Q222 WeakPolarHBondContact O-CB 3.45Å; S218-Q222 PolarHBondContact O-N 3.17Å; Q222-R225 PolarHBondContact O-N 2.72Å; Q222-I226 HydrophobicContact CG-CD1 4.45Å; Q222-I226 VanDerWaalsContact O-CG1 3.32Å; Q222-I226 WeakPolarHBondContact O-CG1 3.32Å; Q222-I226 PolarHBondContact O-N 3.15Å; Q222-I226 VanDerWaalsContact O-N 3.14Å
223	L	97	Very high	96.3	Very high	5 Å²	5	37 Å²	37	3%	0.026	18%	0.184	C	C	.	.	H	α-helix	trans	-63.1	-43.9	178.2	-169.9	68.3	0	0	0	111.8	L185 L186 E219 I220 D221 R225 I226 F227 F251	L185-L223 HydrophobicContact CB-CD1 4.12Å; L185-L223 HydrophobicContact CD1-CB 4.44Å; L185-L223 HydrophobicContact CD1-CD1 4.31Å; L186-L223 HydrophobicContact CD1-CD1 4.43Å; L186-L223 HydrophobicContact CD2-CD1 4.23Å; L186-L223 HydrophobicContact CD2-CD2 3.73Å; L186-L223 HydrophobicContact CG-CD1 4.07Å; L186-L223 HydrophobicContact CG-CD2 4.42Å; E219-L223 WeakPolarHBondContact O-CB 3.48Å; E219-L223 PolarHBondContact O-N 2.73Å; I220-L223 HydrophobicContact CD1-CD2 4.49Å; I220-L223 PolarHBondContact O-N 2.8Å; D221-L223 VanDerWaalsContact C-N 3.31Å; D221-L223 PolarHBondContact O-N 2.97Å; L223-R225 PolarHBondContact O-N 3.43Å; L223-I226 WeakPolarHBondContact O-CB 3.22Å; L223-I226 PolarHBondContact O-N 3.46Å; L223-F227 HydrophobicContact CD1-CD1 4.38Å; L223-F227 HydrophobicContact CD1-CE1 3.49Å; L223-F227 VanDerWaalsContact CD1-CE1 3.49Å; L223-F227 HydrophobicContact CD1-CE2 4.32Å; L223-F227 HydrophobicContact CD1-CZ 3.48Å; L223-F227 VanDerWaalsContact CD1-CZ 3.48Å; L223-F227 HydrophobicContact CD2-CE2 3.88Å; L223-F227 HydrophobicContact CD2-CZ 3.67Å; L223-F227 HydrophobicContact CG-CD1 4.41Å; L223-F227 HydrophobicContact CG-CD2 4.38Å; L223-F227 HydrophobicContact CG-CE1 3.74Å; L223-F227 HydrophobicContact CG-CE2 3.69Å; L223-F227 HydrophobicContact CG-CZ 3.35Å; L223-F227 VanDerWaalsContact O-CD1 3.32Å; L223-F227 WeakPolarHBondContact O-CD1 3.21Å; L223-F227 VanDerWaalsContact O-CG 3.28Å; L223-F227 WeakPolarHBondContact O-CG 3.49Å; L223-F227 PolarHBondContact O-N 2.88Å; L223-F251 HydrophobicContact CD2-CE2 3.75Å; L223-F251 HydrophobicContact CD2-CZ 3.74Å
224	F	97.8	Very high	96	Very high	56 Å²	56	39.4 Å²	39.4	25%	0.246	20%	0.199	C	C	.	.	H	α-helix	trans	-66.7	-34.6	178.5	-71.4	-5.7	0	0	0	113	I220 D221 I226 F227 K228 F251 P252 W254	I220-F224 HydrophobicContact CD1-CD1 4.15Å; I220-F224 HydrophobicContact CD1-CE1 3.51Å; I220-F224 HydrophobicContact CD1-CE2 4.18Å; I220-F224 HydrophobicContact CD1-CZ 3.53Å; I220-F224 HydrophobicContact CG1-CD2 4.28Å; I220-F224 HydrophobicContact CG1-CE1 4.05Å; I220-F224 HydrophobicContact CG1-CE2 3.79Å; I220-F224 HydrophobicContact CG1-CZ 3.67Å; I220-F224 WeakPolarHBondContact O-CG 3.19Å; I220-F224 PolarHBondContact O-N 3.07Å; D221-F224 PolarHBondContact O-N 3.48Å; F224-I226 VanDerWaalsContact C-N 3.34Å; F224-F227 HydrophobicContact CD1-CD2 4.19Å; F224-F227 PolarHBondContact O-N 2.87Å; F224-K228 WeakPolarHBondContact O-CB 3.42Å; F224-K228 PolarHBondContact O-N 2.82Å; F224-F251 AromaticContact CE1-CD1 3.72Å; F224-F251 HydrophobicContact CE1-CD1 3.72Å; F224-F251 HydrophobicContact CE1-CE1 4.17Å; F224-F251 HydrophobicContact CE1-CG 4.25Å; F224-F251 HydrophobicContact CZ-CD1 4.15Å; F224-P252 HydrophobicContact CE2-CG 4.5Å; F224-P252 HydrophobicContact CZ-CG 4.28Å; F224-W254 HydrophobicContact CB-CH2 3.81Å; F224-W254 HydrophobicContact CB-CZ3 4.12Å; F224-W254 HydrophobicContact CD1-CH2 4.14Å; F224-W254 AromaticContact CD1-CZ3 3.94Å; F224-W254 HydrophobicContact CD1-CZ3 3.94Å; F224-W254 HydrophobicContact CD2-CH2 4.19Å; F224-W254 AromaticContact CG-CH2 3.8Å; F224-W254 HydrophobicContact CG-CH2 3.8Å; F224-W254 HydrophobicContact CG-CZ3 4.05Å
225	R	97.9	Very high	95.7	Very high	71 Å²	71	42 Å²	42	27%	0.268	22%	0.221	S	C	.	.	H	α-helix	trans	-63.7	-40.4	171.9	-72.1	178.4	-167.6	-74.4	-5.9	112.1	F214 H215 D221 Q222 L223 K228 I229	F214-R225 HydrophobicContact CB-CB 4.48Å; H215-R225 VanDerWaalsContact C-NE 3.33Å; H215-R225 VanDerWaalsContact CE1-CZ 3.5Å; H215-R225 PolarHBondContact CE1-NH1 3.12Å; H215-R225 PolarHBondContact ND1-NH1 3.14Å; H215-R225 PolarHBondContact NE2-NH1 3.27Å; H215-R225 PolarHBondContact O-NE 2.95Å; D221-R225 VanDerWaalsContact O-CG 3.32Å; D221-R225 WeakPolarHBondContact O-CG 3.43Å; D221-R225 PolarHBondContact O-N 3.04Å; D221-R225 IonicContact OD1-CZ 3.44Å; D221-R225 IonicContact OD1-NE 2.72Å; D221-R225 IonicContact OD1-NH2 3.92Å; D221-R225 PolarHBondContact OD1-NH2 3.27Å; D221-R225 IonicContact OD2-CZ 2.72Å; D221-R225 VanDerWaalsContact OD2-CZ 3.26Å; D221-R225 IonicContact OD2-NE 3.43Å; D221-R225 PolarHBondContact OD2-NE 2.85Å; D221-R225 IonicContact OD2-NH2 3.31Å; D221-R225 PolarHBondContact OD2-NH2 3.02Å; Q222-R225 PolarHBondContact O-N 2.72Å; L223-R225 PolarHBondContact O-N 3.43Å; R225-K228 PolarHBondContact O-N 3.23Å; R225-I229 PolarHBondContact O-N 3.3Å
226	I	98.3	Very high	95.5	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.3	-50.2	173.6	-65.2	166.5	0	0	0	109.6	L185 W198 F214 Q222 L223 F224 K228 I229 L230 Y280	L185-I226 HydrophobicContact CD1-CD1 3.79Å; W198-I226 HydrophobicContact CH2-CG2 3.66Å; W198-I226 HydrophobicContact CZ2-CD1 3.77Å; W198-I226 HydrophobicContact CZ2-CG1 3.96Å; W198-I226 HydrophobicContact CZ2-CG2 3.83Å; F214-I226 HydrophobicContact CB-CG1 4.23Å; F214-I226 HydrophobicContact CD1-CB 4.38Å; F214-I226 HydrophobicContact CD1-CG1 3.85Å; F214-I226 HydrophobicContact CD2-CG1 3.9Å; F214-I226 HydrophobicContact CE1-CB 4.36Å; F214-I226 HydrophobicContact CE1-CG1 4.13Å; F214-I226 HydrophobicContact CE2-CG1 4.17Å; F214-I226 HydrophobicContact CG-CG1 3.73Å; F214-I226 HydrophobicContact CZ-CG1 4.28Å; Q222-I226 HydrophobicContact CG-CD1 4.45Å; Q222-I226 VanDerWaalsContact O-CG1 3.32Å; Q222-I226 WeakPolarHBondContact O-CG1 3.32Å; Q222-I226 PolarHBondContact O-N 3.15Å; Q222-I226 VanDerWaalsContact O-N 3.14Å; L223-I226 WeakPolarHBondContact O-CB 3.22Å; L223-I226 PolarHBondContact O-N 3.46Å; F224-I226 VanDerWaalsContact C-N 3.34Å; I226-K228 VanDerWaalsContact C-N 3.33Å; I226-K228 PolarHBondContact O-N 2.96Å; I226-I229 PolarHBondContact O-N 2.88Å; I226-L230 HydrophobicContact CG2-CD1 3.93Å; I226-L230 PolarHBondContact O-N 3.18Å; I226-Y280 HydrophobicContact CG2-CE1 3.79Å
227	F	97.8	Very high	95.4	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.5	-36.3	-177.8	-63.1	-6.8	0	0	0	112.8	L223 F224 I229 G231 T232 P233 F251 W254 Y280	L223-F227 HydrophobicContact CD1-CD1 4.38Å; L223-F227 HydrophobicContact CD1-CE1 3.49Å; L223-F227 VanDerWaalsContact CD1-CE1 3.49Å; L223-F227 HydrophobicContact CD1-CE2 4.32Å; L223-F227 HydrophobicContact CD1-CZ 3.48Å; L223-F227 VanDerWaalsContact CD1-CZ 3.48Å; L223-F227 HydrophobicContact CD2-CE2 3.88Å; L223-F227 HydrophobicContact CD2-CZ 3.67Å; L223-F227 HydrophobicContact CG-CD1 4.41Å; L223-F227 HydrophobicContact CG-CD2 4.38Å; L223-F227 HydrophobicContact CG-CE1 3.74Å; L223-F227 HydrophobicContact CG-CE2 3.69Å; L223-F227 HydrophobicContact CG-CZ 3.35Å; L223-F227 VanDerWaalsContact O-CD1 3.32Å; L223-F227 WeakPolarHBondContact O-CD1 3.21Å; L223-F227 VanDerWaalsContact O-CG 3.28Å; L223-F227 WeakPolarHBondContact O-CG 3.49Å; L223-F227 PolarHBondContact O-N 2.88Å; F224-F227 HydrophobicContact CD1-CD2 4.19Å; F224-F227 PolarHBondContact O-N 2.87Å; F227-I229 VanDerWaalsContact C-N 3.28Å; F227-I229 PolarHBondContact O-N 2.85Å; F227-G231 CarbonylContact O-C 3.21Å; F227-G231 WeakPolarHBondContact O-CA 3.42Å; F227-G231 PolarHBondContact O-N 2.64Å; F227-T232 HydrophobicContact CD2-CG2 4.02Å; F227-T232 HydrophobicContact CE2-CG2 4.19Å; F227-T232 HydrophobicContact CG-CG2 4.47Å; F227-P233 HydrophobicContact CD1-CG 4.45Å; F227-P233 HydrophobicContact CE1-CG 3.78Å; F227-P233 HydrophobicContact CZ-CG 4.07Å; F227-F251 HydrophobicContact CE2-CB 4.34Å; F227-F251 AromaticContact CE2-CD2 3.76Å; F227-F251 HydrophobicContact CE2-CD2 3.76Å; F227-F251 HydrophobicContact CE2-CE2 4.26Å; F227-F251 HydrophobicContact CE2-CG 4.2Å; F227-F251 HydrophobicContact CZ-CD2 4.33Å; F227-W254 HydrophobicContact CB-CD2 4.43Å; F227-W254 HydrophobicContact CB-CE3 3.5Å; F227-W254 VanDerWaalsContact CB-CE3 3.5Å; F227-W254 HydrophobicContact CB-CZ3 3.89Å; F227-W254 HydrophobicContact CD2-CE3 4.38Å; F227-W254 HydrophobicContact CD2-CZ3 4.21Å; F227-W254 HydrophobicContact CG-CE3 4.48Å; F227-W254 WeakPolarHBondContact O-CB 3.47Å; F227-Y280 HydrophobicContact CD1-CE1 4.22Å; F227-Y280 WeakPolarHBondContact CD1-OH 3.38Å; F227-Y280 HydrophobicContact CE1-CE1 4.14Å
228	K	97.7	Very high	95.6	Very high	136 Å²	136	42.7 Å²	42.7	59%	0.591	22%	0.223	S	C	*	.	H	α-helix	trans	-63.5	-34.4	178.1	-171	174.5	-179	179.7	0	112.6	F224 R225 I226 W254	F224-K228 WeakPolarHBondContact O-CB 3.42Å; F224-K228 PolarHBondContact O-N 2.82Å; R225-K228 PolarHBondContact O-N 3.23Å; I226-K228 VanDerWaalsContact C-N 3.33Å; I226-K228 PolarHBondContact O-N 2.96Å; K228-W254 HydrophobicContact CB-CD2 4.41Å; K228-W254 HydrophobicContact CB-CG 4.44Å
229	I	97.7	Very high	95.6	Very high	9 Å²	9	48 Å²	48	5%	0.046	24%	0.24	C	C	.	.	H	α-helix	trans	-89.1	-42.8	-179.7	-61.9	-177	0	0	0	111.5	L213 F214 R225 I226 F227 N257 H258 L259	L213-I229 HydrophobicContact CD1-CD1 4.01Å; L213-I229 HydrophobicContact CG-CD1 4.43Å; L213-I229 WeakPolarHBondContact O-CD1 3.43Å; F214-I229 HydrophobicContact CD1-CD1 3.91Å; F214-I229 HydrophobicContact CE1-CB 4Å; F214-I229 HydrophobicContact CE1-CD1 3.82Å; F214-I229 HydrophobicContact CE1-CG1 4.32Å; F214-I229 HydrophobicContact CE1-CG2 4.31Å; R225-I229 PolarHBondContact O-N 3.3Å; I226-I229 PolarHBondContact O-N 2.88Å; F227-I229 VanDerWaalsContact C-N 3.28Å; F227-I229 PolarHBondContact O-N 2.85Å; I229-N257 CarbonylContact O-C 3.29Å; I229-H258 PolarHBondContact O-N 3.26Å; I229-L259 HydrophobicContact CG2-CB 4.31Å; I229-L259 HydrophobicContact CG2-CD1 4.15Å
230	L	97.7	Very high	95.6	Very high	12 Å²	12	49.1 Å²	49.1	6%	0.063	25%	0.248	C	C	.	.	H	α-helix	trans	-97.9	-7.5	-172.7	-57.9	-177.2	0	0	0	114.1	W198 F214 I226 G256 L259 L278 Y280	W198-L230 HydrophobicContact CH2-CD1 3.55Å; W198-L230 HydrophobicContact CZ2-CD1 4.48Å; W198-L230 HydrophobicContact CZ3-CD1 4.14Å; F214-L230 HydrophobicContact CZ-CD1 4.11Å; F214-L230 HydrophobicContact CZ-CG 4.28Å; I226-L230 HydrophobicContact CG2-CD1 3.93Å; I226-L230 PolarHBondContact O-N 3.18Å; L230-G256 CarbonylContact C-O 3.48Å; L230-G256 VanDerWaalsContact C-O 3.29Å; L230-L259 HydrophobicContact CD2-CB 4.13Å; L230-L259 HydrophobicContact CD2-CD1 4.34Å; L230-L259 HydrophobicContact CD2-CD2 4.28Å; L230-L278 HydrophobicContact CD1-CB 4.17Å; L230-Y280 HydrophobicContact CB-CE2 3.89Å; L230-Y280 WeakPolarHBondContact CB-OH 3.42Å
231	G	97.3	Very high	95.6	Very high	7 Å²	7	45.3 Å²	45.3	7%	0.072	23%	0.229	C	C	.	.			trans	84.9	150	-168.3	0	0	0	0	0	111.3	F227 W254 G256 Y280	F227-G231 CarbonylContact O-C 3.21Å; F227-G231 WeakPolarHBondContact O-CA 3.42Å; F227-G231 PolarHBondContact O-N 2.64Å; G231-W254 WeakPolarHBondContact CA-O 3.31Å; G231-G256 VanDerWaalsContact CA-O 3.27Å; G231-G256 WeakPolarHBondContact CA-O 3.38Å; G231-G256 PolarHBondContact N-O 3.23Å; G231-G256 VanDerWaalsContact N-O 3.08Å; G231-Y280 VanDerWaalsContact O-CE2 3.3Å; G231-Y280 WeakPolarHBondContact O-CE2 3.28Å; G231-Y280 VanDerWaalsContact O-CZ 3.29Å; G231-Y280 PolarHBondContact O-OH 3.2Å
232	T	97.1	Very high	95.5	Very high	11 Å²	11	48.8 Å²	48.8	7%	0.067	25%	0.246	C	C	.	.			trans	-67.7	125.7	175.7	-54.7	0	0	0	0	109.2	F227 T234 P252 K253 W254	F227-T232 HydrophobicContact CD2-CG2 4.02Å; F227-T232 HydrophobicContact CE2-CG2 4.19Å; F227-T232 HydrophobicContact CG-CG2 4.47Å; T232-T234 PolarHBondContact O-N 2.97Å; T232-P252 PolarHBondContact OG1-O 2.94Å; T232-K253 HydrophobicContact CG2-CD 4.16Å; T232-W254 PolarHBondContact N-O 3Å; T232-W254 PolarHBondContact OG1-N 2.63Å
233	P	96	Very high	95.3	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.006	28%	0.277	C	S	.	.			trans	-64.4	133.4	-175	26.2	-34	0	0	0	110.8	F227 V241 Y280	F227-P233 HydrophobicContact CD1-CG 4.45Å; F227-P233 HydrophobicContact CE1-CG 3.78Å; F227-P233 HydrophobicContact CZ-CG 4.07Å; P233-V241 HydrophobicContact CB-CG2 4.26Å; P233-V241 HydrophobicContact CG-CG2 3.98Å; P233-Y280 HydrophobicContact CB-CD1 4.08Å; P233-Y280 HydrophobicContact CB-CD2 3.85Å; P233-Y280 HydrophobicContact CB-CE1 4.26Å; P233-Y280 HydrophobicContact CB-CE2 4.01Å; P233-Y280 HydrophobicContact CB-CG 3.88Å; P233-Y280 HydrophobicContact CG-CD1 4.21Å; P233-Y280 HydrophobicContact CG-CE1 4.07Å; P233-Y280 HydrophobicContact CG-CE2 4.49Å
234	T	91.1	Very high	95.2	Very high	66 Å²	66	54.4 Å²	54.4	41%	0.405	28%	0.28	S	S	.	.			trans	-107.2	177.4	168.4	76.1	0	0	0	0	110	T232 N236 E237 W238	T232-T234 PolarHBondContact O-N 2.97Å; T234-N236 PolarHBondContact O-N 2.71Å; T234-N236 WeakPolarHBondContact OG1-CB 3.03Å; T234-N236 PolarHBondContact OG1-N 3.41Å; T234-N236 VanDerWaalsContact OG1-N 3.15Å; T234-E237 WeakPolarHBondContact CA-OE2 3.42Å; T234-E237 WeakPolarHBondContact CB-OE2 3.12Å; T234-E237 PolarHBondContact N-OE2 3.09Å; T234-E237 PolarHBondContact O-N 3.23Å; T234-E237 VanDerWaalsContact O-N 3.08Å; T234-E237 PolarHBondContact OG1-OE2 3.24Å; T234-W238 PolarHBondContact O-N 2.74Å
235	A	90.2	Very high	95	Very high	54 Å²	54	55.2 Å²	55.2	45%	0.446	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-16.4	171.8	0	0	0	0	0	113.3	K239	A235-K239 VanDerWaalsContact O-CA 3.28Å; A235-K239 WeakPolarHBondContact O-CA 3.49Å; A235-K239 PolarHBondContact O-N 3.24Å
236	N	91.8	Very high	94.8	Very high	145 Å²	145	56.5 Å²	56.5	78%	0.775	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-40.3	174.1	-65.5	-23.1	0	0	0	112.3	T234	T234-N236 PolarHBondContact O-N 2.71Å; T234-N236 WeakPolarHBondContact OG1-CB 3.03Å; T234-N236 PolarHBondContact OG1-N 3.41Å; T234-N236 VanDerWaalsContact OG1-N 3.15Å
237	E	93.5	Very high	94.6	Very high	89 Å²	89	58 Å²	58	42%	0.416	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-31.1	179.2	-68.5	69.9	-136.1	0	0	112.2	T234 Y280	T234-E237 WeakPolarHBondContact CA-OE2 3.42Å; T234-E237 WeakPolarHBondContact CB-OE2 3.12Å; T234-E237 PolarHBondContact N-OE2 3.09Å; T234-E237 PolarHBondContact O-N 3.23Å; T234-E237 VanDerWaalsContact O-N 3.08Å; T234-E237 PolarHBondContact OG1-OE2 3.24Å; E237-Y280 HydrophobicContact CB-CD2 4.1Å
238	W	95.2	Very high	94.5	Very high	15 Å²	15	62.1 Å²	62.1	6%	0.057	32%	0.324	C	S	.	.			trans	-154	102.5	177	-178.9	6.2	0	0	0	110.3	E183 L186 T234 D240 V241 L244 D281 P282	E183-W238 HydrophobicContact CB-CH2 3.43Å; E183-W238 VanDerWaalsContact CB-CH2 3.43Å; E183-W238 HydrophobicContact CB-CZ2 4.17Å; E183-W238 HydrophobicContact CB-CZ3 4.24Å; L186-W238 HydrophobicContact CD1-CH2 4.48Å; L186-W238 HydrophobicContact CD1-CZ3 3.84Å; T234-W238 PolarHBondContact O-N 2.74Å; W238-D240 VanDerWaalsContact C-N 3.28Å; W238-D240 PolarHBondContact O-N 3.3Å; W238-D240 VanDerWaalsContact O-N 3.14Å; W238-V241 HydrophobicContact CB-CB 3.96Å; W238-V241 HydrophobicContact CD2-CB 3.78Å; W238-V241 HydrophobicContact CD2-CG2 3.97Å; W238-V241 HydrophobicContact CE3-CB 3.94Å; W238-V241 HydrophobicContact CE3-CG2 3.59Å; W238-V241 HydrophobicContact CG-CB 3.79Å; W238-V241 HydrophobicContact CG-CG2 4.44Å; W238-V241 HydrophobicContact CZ3-CG2 4.09Å; W238-V241 WeakPolarHBondContact O-CB 3.44Å; W238-V241 VanDerWaalsContact O-CG1 3.31Å; W238-V241 WeakPolarHBondContact O-CG1 2.87Å; W238-V241 PolarHBondContact O-N 3.01Å; W238-V241 VanDerWaalsContact O-N 3.1Å; W238-L244 HydrophobicContact CE3-CD1 4.38Å; W238-L244 HydrophobicContact CH2-CD1 3.19Å; W238-L244 HydrophobicContact CH2-CG 4.41Å; W238-L244 HydrophobicContact CZ2-CD1 3.47Å; W238-L244 VanDerWaalsContact CZ2-CD1 3.47Å; W238-L244 HydrophobicContact CZ2-CD2 4.21Å; W238-L244 HydrophobicContact CZ2-CG 4.33Å; W238-L244 HydrophobicContact CZ3-CD1 3.72Å; W238-D281 HydrophobicContact CB-CB 4.16Å; W238-D281 HydrophobicContact CG-CB 4.1Å; W238-P282 HydrophobicContact CZ2-CG 4.44Å
239	K	93.5	Very high	94.2	Very high	154 Å²	154	61.5 Å²	61.5	67%	0.67	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.6	-45.3	-171.7	-171.7	-178.2	175.1	-175.9	0	114.1	A235	A235-K239 VanDerWaalsContact O-CA 3.28Å; A235-K239 WeakPolarHBondContact O-CA 3.49Å; A235-K239 PolarHBondContact O-N 3.24Å
240	D	92.6	Very high	94	Very high	88 Å²	88	67.3 Å²	67.3	47%	0.471	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	15.2	-172.1	-52.1	-39.2	0	0	0	112.6	W238 I242 T243	W238-D240 VanDerWaalsContact C-N 3.28Å; W238-D240 PolarHBondContact O-N 3.3Å; W238-D240 VanDerWaalsContact O-N 3.14Å; D240-I242 PolarHBondContact O-N 3.23Å; D240-T243 PolarHBondContact O-N 2.93Å; D240-T243 VanDerWaalsContact O-N 3.07Å; D240-T243 PolarHBondContact O-OG1 3.25Å
241	V	94.6	Very high	94	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-58.7	-36	-177.9	72.5	0	0	0	0	112.4	L186 P233 W238 T243 L244 Y247	L186-V241 HydrophobicContact CD1-CG2 3.86Å; P233-V241 HydrophobicContact CB-CG2 4.26Å; P233-V241 HydrophobicContact CG-CG2 3.98Å; W238-V241 HydrophobicContact CB-CB 3.96Å; W238-V241 HydrophobicContact CD2-CB 3.78Å; W238-V241 HydrophobicContact CD2-CG2 3.97Å; W238-V241 HydrophobicContact CE3-CB 3.94Å; W238-V241 HydrophobicContact CE3-CG2 3.59Å; W238-V241 HydrophobicContact CG-CB 3.79Å; W238-V241 HydrophobicContact CG-CG2 4.44Å; W238-V241 HydrophobicContact CZ3-CG2 4.09Å; W238-V241 WeakPolarHBondContact O-CB 3.44Å; W238-V241 VanDerWaalsContact O-CG1 3.31Å; W238-V241 WeakPolarHBondContact O-CG1 2.87Å; W238-V241 PolarHBondContact O-N 3.01Å; W238-V241 VanDerWaalsContact O-N 3.1Å; V241-T243 PolarHBondContact O-N 3.31Å; V241-L244 HydrophobicContact CG2-CD1 4.05Å; V241-L244 WeakPolarHBondContact O-CB 3.44Å; V241-L244 WeakPolarHBondContact O-CG 3.3Å; V241-L244 PolarHBondContact O-N 2.93Å; V241-Y247 HydrophobicContact CG1-CE2 4.23Å; V241-Y247 HydrophobicContact CG2-CD2 3.84Å; V241-Y247 HydrophobicContact CG2-CE2 4.09Å; V241-Y247 WeakPolarHBondContact O-CB 3.31Å
242	I	93.5	Very high	93.9	Very high	106 Å²	106	69.6 Å²	69.6	54%	0.544	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-70.2	-15.2	-178	65.7	171.7	0	0	0	113.1	D240 Y247	D240-I242 PolarHBondContact O-N 3.23Å; I242-Y247 HydrophobicContact CB-CD1 4.29Å; I242-Y247 HydrophobicContact CB-CE1 4.22Å; I242-Y247 HydrophobicContact CG2-CD1 4.33Å; I242-Y247 HydrophobicContact CG2-CE1 3.8Å
243	T	93.4	Very high	93.9	Very high	104 Å²	104	74.6 Å²	74.6	64%	0.638	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-92.3	-1.9	179.4	70	0	0	0	0	112.6	D240 V241	D240-T243 PolarHBondContact O-N 2.93Å; D240-T243 VanDerWaalsContact O-N 3.07Å; D240-T243 PolarHBondContact O-OG1 3.25Å; V241-T243 PolarHBondContact O-N 3.31Å
244	L	93.5	Very high	93.9	Very high	19 Å²	19	78.3 Å²	78.3	10%	0.099	41%	0.41	C	S	.	.	S	Bend	trans	-76.1	142.5	-178	-61.5	171.8	0	0	0	111.2	L186 C188 W238 V241 E246 Y247	L186-L244 HydrophobicContact CB-CB 4.06Å; L186-L244 HydrophobicContact CB-CD1 3.58Å; L186-L244 HydrophobicContact CB-CG 4.45Å; L186-L244 HydrophobicContact CD1-CD1 3.81Å; L186-L244 HydrophobicContact CG-CD1 4.31Å; L186-L244 WeakPolarHBondContact O-CB 3.33Å; C188-L244 HydrophobicContact CB-CD2 3.99Å; W238-L244 HydrophobicContact CE3-CD1 4.38Å; W238-L244 HydrophobicContact CH2-CD1 3.19Å; W238-L244 HydrophobicContact CH2-CG 4.41Å; W238-L244 HydrophobicContact CZ2-CD1 3.47Å; W238-L244 VanDerWaalsContact CZ2-CD1 3.47Å; W238-L244 HydrophobicContact CZ2-CD2 4.21Å; W238-L244 HydrophobicContact CZ2-CG 4.33Å; W238-L244 HydrophobicContact CZ3-CD1 3.72Å; V241-L244 HydrophobicContact CG2-CD1 4.05Å; V241-L244 WeakPolarHBondContact O-CB 3.44Å; V241-L244 WeakPolarHBondContact O-CG 3.3Å; V241-L244 PolarHBondContact O-N 2.93Å; L244-E246 VanDerWaalsContact C-N 3.29Å; L244-E246 PolarHBondContact O-N 2.93Å; L244-Y247 WeakPolarHBondContact O-CB 3.4Å; L244-Y247 PolarHBondContact O-N 3.45Å
245	P	93.5	Very high	94.1	Very high	73 Å²	73	85.6 Å²	85.6	47%	0.474	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-40.1	-171.8	-29.1	36.8	0	0	0	114.9	G187	G187-P245 WeakPolarHBondContact O-CD 3.31Å; G187-P245 WeakPolarHBondContact O-CG 3.3Å
246	E	94.4	Very high	94.1	Very high	97 Å²	97	85.3 Å²	85.3	45%	0.453	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	5.3	-176.8	-54.9	-51.4	147.2	0	0	113.7	L186 L244 K248 F251	L186-E246 PolarHBondContact O-N 3.14Å; L244-E246 VanDerWaalsContact C-N 3.29Å; L244-E246 PolarHBondContact O-N 2.93Å; E246-K248 PolarHBondContact O-N 3.05Å; E246-K248 IonicContact OE2-NZ 3.49Å; E246-K248 PolarHBondContact OE2-NZ 3.05Å; E246-F251 VanDerWaalsContact O-CZ 3.29Å; E246-F251 WeakPolarHBondContact O-CZ 3.34Å
247	Y	95.1	Very high	94.2	Very high	32 Å²	32	81.8 Å²	81.8	13%	0.125	41%	0.413	C	S	.	.			trans	-71.8	128.5	172.6	-174.5	-89.5	0	0	0	110.8	L186 V241 I242 L244 F251	L186-Y247 HydrophobicContact CD2-CD2 4.2Å; V241-Y247 HydrophobicContact CG1-CE2 4.23Å; V241-Y247 HydrophobicContact CG2-CD2 3.84Å; V241-Y247 HydrophobicContact CG2-CE2 4.09Å; V241-Y247 WeakPolarHBondContact O-CB 3.31Å; I242-Y247 HydrophobicContact CB-CD1 4.29Å; I242-Y247 HydrophobicContact CB-CE1 4.22Å; I242-Y247 HydrophobicContact CG2-CD1 4.33Å; I242-Y247 HydrophobicContact CG2-CE1 3.8Å; L244-Y247 WeakPolarHBondContact O-CB 3.4Å; L244-Y247 PolarHBondContact O-N 3.45Å; Y247-F251 HydrophobicContact CD2-CD2 4.17Å; Y247-F251 HydrophobicContact CD2-CE2 4.13Å; Y247-F251 HydrophobicContact CE2-CD2 4.19Å; Y247-F251 HydrophobicContact CG-CE2 4.47Å
248	K	95.4	Very high	94.2	Very high	87 Å²	87	80.6 Å²	80.6	38%	0.378	41%	0.408	S	S	.	.			trans	-116.9	133.6	175.1	-44.5	-62.6	175.4	-160	0	110.7	E246 D250 F251	E246-K248 PolarHBondContact O-N 3.05Å; E246-K248 IonicContact OE2-NZ 3.49Å; E246-K248 PolarHBondContact OE2-NZ 3.05Å; K248-D250 WeakPolarHBondContact CB-OD1 3.46Å; K248-D250 PolarHBondContact O-N 3Å; K248-F251 HydrophobicContact CB-CD1 3.87Å; K248-F251 HydrophobicContact CB-CD2 4.48Å; K248-F251 HydrophobicContact CB-CE1 3.66Å; K248-F251 HydrophobicContact CB-CE2 4.33Å; K248-F251 HydrophobicContact CB-CG 4.29Å; K248-F251 HydrophobicContact CB-CZ 3.92Å; K248-F251 HydrophobicContact CG-CD1 4.32Å; K248-F251 HydrophobicContact CG-CE1 3.62Å; K248-F251 HydrophobicContact CG-CZ 3.75Å; K248-F251 VanDerWaalsContact O-CD2 3.23Å; K248-F251 WeakPolarHBondContact O-CD2 3.49Å; K248-F251 VanDerWaalsContact O-CG 3.26Å; K248-F251 WeakPolarHBondContact O-CG 3.17Å; K248-F251 PolarHBondContact O-N 2.83Å
249	V	91.4	Very high	94.3	Very high	123 Å²	123	79.9 Å²	79.9	75%	0.745	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-27.8	-177.2	-68.3	0	0	0	0	112.7	K253	V249-K253 PolarHBondContact O-NZ 2.63Å
250	D	93.8	Very high	94.3	Very high	131 Å²	131	74.6 Å²	74.6	70%	0.701	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	2.5	-178.6	62.9	-17.8	0	0	0	114	K248	K248-D250 WeakPolarHBondContact CB-OD1 3.46Å; K248-D250 PolarHBondContact O-N 3Å
251	F	95.9	Very high	94.4	Very high	14 Å²	14	76.6 Å²	76.6	6%	0.061	39%	0.392	C	S	.	.	S	Bend	trans	-51.7	139.1	169.9	-72.3	-26.2	0	0	0	111.3	L186 I220 L223 F224 F227 E246 Y247 K248 K253	L186-F251 HydrophobicContact CD2-CE2 3.94Å; I220-F251 HydrophobicContact CD1-CD1 4.44Å; I220-F251 HydrophobicContact CD1-CE1 3.71Å; I220-F251 HydrophobicContact CD1-CZ 4.28Å; L223-F251 HydrophobicContact CD2-CE2 3.75Å; L223-F251 HydrophobicContact CD2-CZ 3.74Å; F224-F251 AromaticContact CE1-CD1 3.72Å; F224-F251 HydrophobicContact CE1-CD1 3.72Å; F224-F251 HydrophobicContact CE1-CE1 4.17Å; F224-F251 HydrophobicContact CE1-CG 4.25Å; F224-F251 HydrophobicContact CZ-CD1 4.15Å; F227-F251 HydrophobicContact CE2-CB 4.34Å; F227-F251 AromaticContact CE2-CD2 3.76Å; F227-F251 HydrophobicContact CE2-CD2 3.76Å; F227-F251 HydrophobicContact CE2-CE2 4.26Å; F227-F251 HydrophobicContact CE2-CG 4.2Å; F227-F251 HydrophobicContact CZ-CD2 4.33Å; E246-F251 VanDerWaalsContact O-CZ 3.29Å; E246-F251 WeakPolarHBondContact O-CZ 3.34Å; Y247-F251 HydrophobicContact CD2-CD2 4.17Å; Y247-F251 HydrophobicContact CD2-CE2 4.13Å; Y247-F251 HydrophobicContact CE2-CD2 4.19Å; Y247-F251 HydrophobicContact CG-CE2 4.47Å; K248-F251 HydrophobicContact CB-CD1 3.87Å; K248-F251 HydrophobicContact CB-CD2 4.48Å; K248-F251 HydrophobicContact CB-CE1 3.66Å; K248-F251 HydrophobicContact CB-CE2 4.33Å; K248-F251 HydrophobicContact CB-CG 4.29Å; K248-F251 HydrophobicContact CB-CZ 3.92Å; K248-F251 HydrophobicContact CG-CD1 4.32Å; K248-F251 HydrophobicContact CG-CE1 3.62Å; K248-F251 HydrophobicContact CG-CZ 3.75Å; K248-F251 VanDerWaalsContact O-CD2 3.23Å; K248-F251 WeakPolarHBondContact O-CD2 3.49Å; K248-F251 VanDerWaalsContact O-CG 3.26Å; K248-F251 WeakPolarHBondContact O-CG 3.17Å; K248-F251 PolarHBondContact O-N 2.83Å; F251-K253 WeakPolarHBondContact O-CD 3.49Å; F251-K253 VanDerWaalsContact O-CE 3.31Å; F251-K253 WeakPolarHBondContact O-CE 3.19Å; F251-K253 PolarHBondContact O-NZ 3.18Å
252	P	96.9	Very high	94.4	Very high	52 Å²	52	81 Å²	81	34%	0.338	41%	0.413	S	S	.	.			trans	-57.2	144.7	179.8	-19.1	29.2	0	0	0	111.2	F224 T232 W254	F224-P252 HydrophobicContact CE2-CG 4.5Å; F224-P252 HydrophobicContact CZ-CG 4.28Å; T232-P252 PolarHBondContact OG1-O 2.94Å; P252-W254 HydrophobicContact CB-CD2 4.31Å; P252-W254 HydrophobicContact CB-CE3 3.91Å; P252-W254 HydrophobicContact CB-CH2 3.49Å; P252-W254 VanDerWaalsContact CB-CH2 3.49Å; P252-W254 HydrophobicContact CB-CZ2 3.88Å; P252-W254 HydrophobicContact CB-CZ3 3.5Å; P252-W254 HydrophobicContact CG-CH2 3.53Å; P252-W254 HydrophobicContact CG-CZ2 4.22Å; P252-W254 HydrophobicContact CG-CZ3 3.77Å; P252-W254 PolarHBondContact O-N 3.31Å
253	K	95.9	Very high	94.4	Very high	116 Å²	116	76 Å²	76	50%	0.504	39%	0.387	S	S	.	.			trans	-102	80	-173.3	-55.5	-54.1	-178.8	-145.3	0	110.8	T232 V249 F251	T232-K253 HydrophobicContact CG2-CD 4.16Å; V249-K253 PolarHBondContact O-NZ 2.63Å; F251-K253 WeakPolarHBondContact O-CD 3.49Å; F251-K253 VanDerWaalsContact O-CE 3.31Å; F251-K253 WeakPolarHBondContact O-CE 3.19Å; F251-K253 PolarHBondContact O-NZ 3.18Å
254	W	97.2	Very high	94	Very high	80 Å²	80	77.4 Å²	77.4	30%	0.303	39%	0.391	S	S	.	.			trans	-73.2	137.8	169.3	-67.2	-80.4	0	0	0	109.9	F224 F227 K228 G231 T232 P252	F224-W254 HydrophobicContact CB-CH2 3.81Å; F224-W254 HydrophobicContact CB-CZ3 4.12Å; F224-W254 HydrophobicContact CD1-CH2 4.14Å; F224-W254 AromaticContact CD1-CZ3 3.94Å; F224-W254 HydrophobicContact CD1-CZ3 3.94Å; F224-W254 HydrophobicContact CD2-CH2 4.19Å; F224-W254 AromaticContact CG-CH2 3.8Å; F224-W254 HydrophobicContact CG-CH2 3.8Å; F224-W254 HydrophobicContact CG-CZ3 4.05Å; F227-W254 HydrophobicContact CB-CD2 4.43Å; F227-W254 HydrophobicContact CB-CE3 3.5Å; F227-W254 VanDerWaalsContact CB-CE3 3.5Å; F227-W254 HydrophobicContact CB-CZ3 3.89Å; F227-W254 HydrophobicContact CD2-CE3 4.38Å; F227-W254 HydrophobicContact CD2-CZ3 4.21Å; F227-W254 HydrophobicContact CG-CE3 4.48Å; F227-W254 WeakPolarHBondContact O-CB 3.47Å; K228-W254 HydrophobicContact CB-CD2 4.41Å; K228-W254 HydrophobicContact CB-CG 4.44Å; G231-W254 WeakPolarHBondContact CA-O 3.31Å; T232-W254 PolarHBondContact N-O 3Å; T232-W254 PolarHBondContact OG1-N 2.63Å; P252-W254 HydrophobicContact CB-CD2 4.31Å; P252-W254 HydrophobicContact CB-CE3 3.91Å; P252-W254 HydrophobicContact CB-CH2 3.49Å; P252-W254 VanDerWaalsContact CB-CH2 3.49Å; P252-W254 HydrophobicContact CB-CZ2 3.88Å; P252-W254 HydrophobicContact CB-CZ3 3.5Å; P252-W254 HydrophobicContact CG-CH2 3.53Å; P252-W254 HydrophobicContact CG-CZ2 4.22Å; P252-W254 HydrophobicContact CG-CZ3 3.77Å; P252-W254 PolarHBondContact O-N 3.31Å
255	R	94.1	Very high	93.6	Very high	219 Å²	219	77.4 Å²	77.4	83%	0.826	39%	0.392	S	S	*	.			trans	-114.2	146.7	-176.9	-65	-175.2	179.6	-175.2	0.6	110.1	H258	R255-H258 PolarHBondContact O-NE2 3.4Å
256	G	91.4	Very high	93.4	Very high	48 Å²	48	74.7 Å²	74.7	50%	0.495	37%	0.374	S	S	.	.	S	Bend	trans	84.2	163.9	175.7	0	0	0	0	0	113.2	L230 G231	L230-G256 CarbonylContact C-O 3.48Å; L230-G256 VanDerWaalsContact C-O 3.29Å; G231-G256 VanDerWaalsContact CA-O 3.27Å; G231-G256 WeakPolarHBondContact CA-O 3.38Å; G231-G256 PolarHBondContact N-O 3.23Å; G231-G256 VanDerWaalsContact N-O 3.08Å
257	N	92.3	Very high	93.3	Very high	71 Å²	71	72.9 Å²	72.9	38%	0.38	37%	0.367	S	S	.	.			trans	-112	105.1	175.8	-175	-64.5	0	0	0	108.3	I229 L259	I229-N257 CarbonylContact O-C 3.29Å; N257-L259 VanDerWaalsContact C-N 3.32Å; N257-L259 WeakPolarHBondContact OD1-CB 3.18Å; N257-L259 PolarHBondContact OD1-N 3.3Å
258	H	95.4	Very high	93.2	Very high	64 Å²	64	77.8 Å²	77.8	30%	0.296	40%	0.396	S	S	.	.			trans	-91.3	8.3	-178.3	-61.1	-70.3	0	0	0	112.6	I229 R255 P260 E261 H262	I229-H258 PolarHBondContact O-N 3.26Å; R255-H258 PolarHBondContact O-NE2 3.4Å; H258-P260 VanDerWaalsContact C-N 3.33Å; H258-E261 IonicContact CE1-OE1 3.26Å; H258-E261 IonicContact CG-OE1 3.55Å; H258-E261 IonicContact CG-OE2 3.3Å; H258-E261 IonicContact ND1-OE1 2.77Å; H258-E261 PolarHBondContact ND1-OE1 3.4Å; H258-E261 IonicContact ND1-OE2 3.33Å; H258-E261 PolarHBondContact ND1-OE2 3.21Å; H258-E261 WeakPolarHBondContact O-CB 3.44Å; H258-E261 PolarHBondContact O-N 3Å; H258-H262 PolarHBondContact O-CD2 3.42Å
259	L	95.6	Very high	93.2	Very high	0 Å²	0	80 Å²	80	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-50.2	-44.5	-178.2	-174.2	64.4	0	0	0	113.5	L213 I229 L230 N257 E261 H262 V263 L274 K275 L278	L213-L259 HydrophobicContact CD1-CD1 4.13Å; L213-L259 HydrophobicContact CD2-CD1 3.9Å; I229-L259 HydrophobicContact CG2-CB 4.31Å; I229-L259 HydrophobicContact CG2-CD1 4.15Å; L230-L259 HydrophobicContact CD2-CB 4.13Å; L230-L259 HydrophobicContact CD2-CD1 4.34Å; L230-L259 HydrophobicContact CD2-CD2 4.28Å; N257-L259 VanDerWaalsContact C-N 3.32Å; N257-L259 WeakPolarHBondContact OD1-CB 3.18Å; N257-L259 PolarHBondContact OD1-N 3.3Å; L259-E261 PolarHBondContact O-N 3.01Å; L259-H262 PolarHBondContact O-N 3.4Å; L259-V263 HydrophobicContact CG-CG2 4.38Å; L259-V263 WeakPolarHBondContact O-CG2 2.95Å; L259-V263 PolarHBondContact O-N 2.74Å; L259-L274 HydrophobicContact CD1-CD2 3.84Å; L259-L274 HydrophobicContact CD1-CG 4.49Å; L259-L274 HydrophobicContact CD2-CB 4.36Å; L259-L274 HydrophobicContact CD2-CD2 3.91Å; L259-L274 HydrophobicContact CD2-CG 3.91Å; L259-L274 HydrophobicContact CG-CD2 3.99Å; L259-K275 HydrophobicContact CD2-CG 3.89Å; L259-L278 HydrophobicContact CD1-CD1 3.97Å; L259-L278 HydrophobicContact CD2-CD1 4.08Å
260	P	95	Very high	93.3	Very high	42 Å²	42	74.1 Å²	74.1	27%	0.273	37%	0.367	S	S	.	.	H	α-helix	trans	-58.6	-31.8	179	-24.3	35.9	0	0	0	114.2	H258 H262 V263 N264 I271	H258-P260 VanDerWaalsContact C-N 3.33Å; P260-H262 PolarHBondContact O-N 3.44Å; P260-V263 PolarHBondContact O-N 3.21Å; P260-N264 PolarHBondContact O-N 3.41Å; P260-I271 HydrophobicContact CB-CD1 4.37Å; P260-I271 HydrophobicContact CB-CG2 4.35Å; P260-I271 HydrophobicContact CG-CG2 3.97Å
261	E	94.8	Very high	93.4	Very high	130 Å²	130	68.9 Å²	68.9	61%	0.607	34%	0.339	S	S	*	.	H	α-helix	trans	-68.6	-27.7	178.9	-58.4	162.1	-150.8	0	0	111.3	H258 L259	H258-E261 IonicContact CE1-OE1 3.26Å; H258-E261 IonicContact CG-OE1 3.55Å; H258-E261 IonicContact CG-OE2 3.3Å; H258-E261 IonicContact ND1-OE1 2.77Å; H258-E261 PolarHBondContact ND1-OE1 3.4Å; H258-E261 IonicContact ND1-OE2 3.33Å; H258-E261 PolarHBondContact ND1-OE2 3.21Å; H258-E261 WeakPolarHBondContact O-CB 3.44Å; H258-E261 PolarHBondContact O-N 3Å; L259-E261 PolarHBondContact O-N 3.01Å
262	H	94.5	Very high	93.5	Very high	93 Å²	93	71.2 Å²	71.2	43%	0.431	35%	0.352	S	S	.	.	H	α-helix	trans	-90.1	-17.6	-179.6	-74.5	-88.7	0	0	0	114	T209 L213 H258 L259 P260	T209-H262 VanDerWaalsContact CG2-O 3.31Å; T209-H262 WeakPolarHBondContact CG2-O 3.46Å; L213-H262 HydrophobicContact CD1-CB 4.07Å; H258-H262 PolarHBondContact O-CD2 3.42Å; L259-H262 PolarHBondContact O-N 3.4Å; P260-H262 PolarHBondContact O-N 3.44Å
263	V	92	Very high	93.5	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.336	C	S	.	.			trans	-127.9	41.3	-178	-64.2	0	0	0	0	113.1	A205 T209 L259 P260 S265 I266 I271 L274	A205-V263 HydrophobicContact CB-CG1 3.74Å; T209-V263 HydrophobicContact CG2-CB 4.41Å; T209-V263 HydrophobicContact CG2-CG1 4.02Å; L259-V263 HydrophobicContact CG-CG2 4.38Å; L259-V263 WeakPolarHBondContact O-CG2 2.95Å; L259-V263 PolarHBondContact O-N 2.74Å; P260-V263 PolarHBondContact O-N 3.21Å; V263-S265 PolarHBondContact O-N 2.58Å; V263-I266 HydrophobicContact CB-CD1 3.86Å; V263-I266 HydrophobicContact CB-CG1 4.3Å; V263-I266 HydrophobicContact CG1-CD1 4.35Å; V263-I266 HydrophobicContact CG2-CD1 4.31Å; V263-I266 PolarHBondContact O-N 3.12Å; V263-I266 VanDerWaalsContact O-N 3.14Å; V263-I271 HydrophobicContact CG2-CG1 4.25Å; V263-L274 HydrophobicContact CB-CD2 4.31Å; V263-L274 HydrophobicContact CG1-CD2 3.83Å; V263-L274 HydrophobicContact CG2-CD2 3.8Å
264	N	85.5	Confident	93.6	Very high	134 Å²	134	63.2 Å²	63.2	72%	0.717	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-7.8	-176.4	65.1	10.5	0	0	0	115.7	P260	P260-N264 PolarHBondContact O-N 3.41Å
265	S	85.5	Confident	93.6	Very high	19 Å²	19	63.5 Å²	63.5	13%	0.133	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-16	176.3	54.7	0	0	0	0	113.5	K111 A208 V263	K111-S265 WeakPolarHBondContact CE-O 3.3Å; K111-S265 PolarHBondContact NZ-O 3.39Å; A208-S265 WeakPolarHBondContact O-CB 3.04Å; A208-S265 PolarHBondContact O-OG 2.88Å; V263-S265 PolarHBondContact O-N 2.58Å
266	I	89.3	Confident	93.8	Very high	16 Å²	16	56.4 Å²	56.4	8%	0.082	29%	0.29	C	S	.	.	S	Bend	trans	-95.6	147.2	-176.2	-45.6	176.8	0	0	0	110.5	F204 A208 V263 I271 Y296	F204-I266 HydrophobicContact CD2-CD1 4.44Å; F204-I266 HydrophobicContact CE1-CD1 4.25Å; F204-I266 HydrophobicContact CE2-CD1 3.89Å; F204-I266 HydrophobicContact CE2-CG2 4.41Å; F204-I266 HydrophobicContact CZ-CD1 3.78Å; F204-I266 HydrophobicContact CZ-CG2 3.79Å; A208-I266 HydrophobicContact CB-CD1 3.42Å; A208-I266 VanDerWaalsContact CB-CD1 3.42Å; A208-I266 HydrophobicContact CB-CG1 3.39Å; V263-I266 HydrophobicContact CB-CD1 3.86Å; V263-I266 HydrophobicContact CB-CG1 4.3Å; V263-I266 HydrophobicContact CG1-CD1 4.35Å; V263-I266 HydrophobicContact CG2-CD1 4.31Å; V263-I266 PolarHBondContact O-N 3.12Å; V263-I266 VanDerWaalsContact O-N 3.14Å; I266-I271 HydrophobicContact CB-CG1 4.5Å; I266-Y296 HydrophobicContact CG2-CE2 4.01Å
267	D	91.6	Very high	94.1	Very high	59 Å²	59	54.1 Å²	54.1	32%	0.316	27%	0.267	S	S	.	.			trans	-68.1	168	172.4	67.2	34.1	0	0	0	112.9	K115 Y269 G270 I271 Y296	K115-D267 IonicContact NZ-OD2 3.51Å; K115-D267 PolarHBondContact NZ-OD2 2.9Å; D267-Y269 PolarHBondContact O-N 3.23Å; D267-Y269 WeakPolarHBondContact OD1-CB 3.33Å; D267-Y269 PolarHBondContact OD1-N 2.95Å; D267-Y269 VanDerWaalsContact OD1-N 3.13Å; D267-G270 PolarHBondContact O-N 3.4Å; D267-G270 PolarHBondContact OD1-N 3.08Å; D267-I271 PolarHBondContact O-N 3.41Å; D267-Y296 WeakPolarHBondContact OD1-CD2 3.08Å; D267-Y296 WeakPolarHBondContact OD1-CE2 3.41Å
268	D	93.8	Very high	94.4	Very high	136 Å²	136	51 Å²	51	73%	0.727	25%	0.25	S	S	*	.	H	α-helix	trans	-58.7	-34.2	-178.5	-70.3	-27.8	0	0	0	113.1	G270 I271 D272	D268-G270 VanDerWaalsContact C-N 3.32Å; D268-I271 PolarHBondContact O-N 2.58Å; D268-D272 VanDerWaalsContact O-CB 3.26Å; D268-D272 WeakPolarHBondContact O-CB 3.41Å; D268-D272 PolarHBondContact O-N 3.14Å
269	Y	94.6	Very high	94.5	Very high	132 Å²	132	52.8 Å²	52.8	52%	0.518	26%	0.257	S	S	.	.	H	α-helix	trans	-68	-34.5	176.8	-68.1	-64.9	0	0	0	111.9	D267 L273 H294 P295	D267-Y269 PolarHBondContact O-N 3.23Å; D267-Y269 WeakPolarHBondContact OD1-CB 3.33Å; D267-Y269 PolarHBondContact OD1-N 2.95Å; D267-Y269 VanDerWaalsContact OD1-N 3.13Å; Y269-L273 WeakPolarHBondContact O-CB 3.49Å; Y269-L273 PolarHBondContact O-N 3.2Å; Y269-H294 PolarHBondContact O-CE1 3.05Å; Y269-H294 VanDerWaalsContact O-CE1 3.22Å; Y269-P295 HydrophobicContact CD1-CB 3.73Å; Y269-P295 HydrophobicContact CE1-CB 3.89Å
270	G	94.6	Very high	94.6	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-77.6	-35.8	177.5	0	0	0	0	0	111.9	D267 D268 D272 L273 L274	D267-G270 PolarHBondContact O-N 3.4Å; D267-G270 PolarHBondContact OD1-N 3.08Å; D268-G270 VanDerWaalsContact C-N 3.32Å; G270-D272 VanDerWaalsContact C-N 3.33Å; G270-L273 PolarHBondContact O-N 3.4Å; G270-L274 VanDerWaalsContact O-CB 3.28Å; G270-L274 WeakPolarHBondContact O-CB 3.35Å; G270-L274 PolarHBondContact O-N 3.1Å
271	I	95.8	Very high	94.6	Very high	22 Å²	22	52.6 Å²	52.6	11%	0.113	25%	0.253	C	S	.	.	H	α-helix	trans	-61.1	-45	169.6	-65.9	171.2	0	0	0	110.2	P260 V263 I266 D267 D268 L274 K275	P260-I271 HydrophobicContact CB-CD1 4.37Å; P260-I271 HydrophobicContact CB-CG2 4.35Å; P260-I271 HydrophobicContact CG-CG2 3.97Å; V263-I271 HydrophobicContact CG2-CG1 4.25Å; I266-I271 HydrophobicContact CB-CG1 4.5Å; D267-I271 PolarHBondContact O-N 3.41Å; D268-I271 PolarHBondContact O-N 2.58Å; I271-L274 PolarHBondContact O-N 2.94Å; I271-K275 HydrophobicContact CG2-CD 4.37Å; I271-K275 WeakPolarHBondContact O-CG 3.32Å; I271-K275 PolarHBondContact O-N 3.07Å
272	D	96.9	Very high	94.5	Very high	63 Å²	63	47.4 Å²	47.4	34%	0.337	23%	0.231	S	C	.	.	H	α-helix	trans	-61.3	-44.6	175.9	176.4	47.2	0	0	0	112	D268 G270 L274 K275 K276 H294	D268-D272 VanDerWaalsContact O-CB 3.26Å; D268-D272 WeakPolarHBondContact O-CB 3.41Å; D268-D272 PolarHBondContact O-N 3.14Å; G270-D272 VanDerWaalsContact C-N 3.33Å; D272-L274 PolarHBondContact O-N 2.95Å; D272-K275 PolarHBondContact O-N 2.85Å; D272-K276 WeakPolarHBondContact O-CG 3.21Å; D272-K276 PolarHBondContact O-N 3.38Å; D272-K276 IonicContact OD1-NZ 3.03Å; D272-K276 PolarHBondContact OD1-NZ 2.88Å; D272-K276 IonicContact OD2-NZ 2.92Å; D272-K276 PolarHBondContact OD2-NZ 3.36Å; D272-H294 IonicContact OD2-CE1 3.72Å; D272-H294 PolarHBondContact OD2-CE1 2.97Å; D272-H294 IonicContact OD2-NE2 2.75Å; D272-H294 PolarHBondContact OD2-NE2 3.39Å
273	L	97.6	Very high	94.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.3	-47.6	174.2	179.5	54.1	0	0	0	111.7	L119 F204 Y269 G270 K275 K276 M277 I286 I291 H294 Y296 F297	L119-L273 HydrophobicContact CD2-CD2 3.94Å; F204-L273 HydrophobicContact CE1-CD2 4.4Å; Y269-L273 WeakPolarHBondContact O-CB 3.49Å; Y269-L273 PolarHBondContact O-N 3.2Å; G270-L273 PolarHBondContact O-N 3.4Å; L273-K275 VanDerWaalsContact C-N 3.35Å; L273-K275 PolarHBondContact O-N 2.85Å; L273-K276 WeakPolarHBondContact O-CB 3.22Å; L273-K276 PolarHBondContact O-N 3.24Å; L273-M277 HydrophobicContact CD1-CE 3.92Å; L273-M277 HydrophobicContact CD1-CG 4.4Å; L273-M277 HydrophobicContact CD1-SD 4.5Å; L273-M277 HydrophobicContact CD2-CE 3.87Å; L273-M277 HydrophobicContact CG-CE 3.73Å; L273-M277 HydrophobicContact CG-SD 4.1Å; L273-M277 WeakPolarHBondContact O-CG 3.45Å; L273-M277 PolarHBondContact O-N 3.13Å; L273-I286 HydrophobicContact CD1-CD1 4.09Å; L273-I291 HydrophobicContact CD1-CB 4.35Å; L273-I291 HydrophobicContact CD1-CG1 4.08Å; L273-I291 HydrophobicContact CD1-CG2 4.14Å; L273-I291 HydrophobicContact CD2-CG2 4.26Å; L273-H294 HydrophobicContact CD1-CB 3.95Å; L273-Y296 HydrophobicContact CD2-CD1 3.73Å; L273-Y296 HydrophobicContact CD2-CG 4.09Å; L273-F297 HydrophobicContact CD2-CE2 3.94Å; L273-F297 HydrophobicContact CD2-CZ 4.15Å
274	L	97.2	Very high	94.6	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.1	-39.8	-177.8	-170.9	67.3	0	0	0	111.6	G201 F204 A205 L259 V263 G270 I271 D272 K276 M277 L278	G201-L274 WeakPolarHBondContact O-CD1 3.28Å; F204-L274 HydrophobicContact CB-CD1 4.33Å; F204-L274 HydrophobicContact CD1-CB 4.27Å; F204-L274 HydrophobicContact CD1-CD1 3.81Å; F204-L274 HydrophobicContact CE1-CB 4.27Å; F204-L274 HydrophobicContact CG-CD1 4.43Å; A205-L274 HydrophobicContact CB-CD1 4.37Å; A205-L274 HydrophobicContact CB-CD2 4.07Å; L259-L274 HydrophobicContact CD1-CD2 3.84Å; L259-L274 HydrophobicContact CD1-CG 4.49Å; L259-L274 HydrophobicContact CD2-CB 4.36Å; L259-L274 HydrophobicContact CD2-CD2 3.91Å; L259-L274 HydrophobicContact CD2-CG 3.91Å; L259-L274 HydrophobicContact CG-CD2 3.99Å; V263-L274 HydrophobicContact CB-CD2 4.31Å; V263-L274 HydrophobicContact CG1-CD2 3.83Å; V263-L274 HydrophobicContact CG2-CD2 3.8Å; G270-L274 VanDerWaalsContact O-CB 3.28Å; G270-L274 WeakPolarHBondContact O-CB 3.35Å; G270-L274 PolarHBondContact O-N 3.1Å; I271-L274 PolarHBondContact O-N 2.94Å; D272-L274 PolarHBondContact O-N 2.95Å; L274-K276 PolarHBondContact O-N 3.41Å; L274-M277 HydrophobicContact CD1-SD 4.47Å; L274-M277 PolarHBondContact O-N 3.01Å; L274-M277 VanDerWaalsContact O-N 3.16Å; L274-L278 HydrophobicContact CD1-CD1 3.97Å; L274-L278 HydrophobicContact CD1-CG 4.26Å; L274-L278 HydrophobicContact CD2-CD1 4.5Å; L274-L278 HydrophobicContact CG-CD1 3.92Å; L274-L278 HydrophobicContact CG-CG 4.44Å; L274-L278 WeakPolarHBondContact O-CB 3.48Å; L274-L278 WeakPolarHBondContact O-CG 3.33Å; L274-L278 PolarHBondContact O-N 3.21Å
275	K	97.3	Very high	95.2	Very high	86 Å²	86	46.7 Å²	46.7	37%	0.374	24%	0.24	S	C	.	.	H	α-helix	trans	-59	-35.6	172.3	-77.3	177.8	177	176.7	0	112.6	L259 I271 D272 L273	L259-K275 HydrophobicContact CD2-CG 3.89Å; I271-K275 HydrophobicContact CG2-CD 4.37Å; I271-K275 WeakPolarHBondContact O-CG 3.32Å; I271-K275 PolarHBondContact O-N 3.07Å; D272-K275 PolarHBondContact O-N 2.85Å; L273-K275 VanDerWaalsContact C-N 3.35Å; L273-K275 PolarHBondContact O-N 2.85Å
276	K	98.2	Very high	95.8	Very high	69 Å²	69	47 Å²	47	30%	0.3	24%	0.241	S	C	.	.	H	α-helix	trans	-75.8	-33.3	176.1	-65.6	-175	-179.5	81.2	0	112.8	D272 L273 L274 I286 H294	D272-K276 WeakPolarHBondContact O-CG 3.21Å; D272-K276 PolarHBondContact O-N 3.38Å; D272-K276 IonicContact OD1-NZ 3.03Å; D272-K276 PolarHBondContact OD1-NZ 2.88Å; D272-K276 IonicContact OD2-NZ 2.92Å; D272-K276 PolarHBondContact OD2-NZ 3.36Å; L273-K276 WeakPolarHBondContact O-CB 3.22Å; L273-K276 PolarHBondContact O-N 3.24Å; L274-K276 PolarHBondContact O-N 3.41Å; K276-I286 HydrophobicContact CB-CB 3.91Å; K276-I286 HydrophobicContact CB-CD1 4.29Å; K276-I286 HydrophobicContact CB-CG2 3.94Å; K276-I286 HydrophobicContact CD-CD1 4Å; K276-I286 PolarHBondContact O-N 3.24Å; K276-I286 VanDerWaalsContact O-N 3.11Å; K276-H294 PolarHBondContact NZ-NE2 3.24Å; K276-H294 VanDerWaalsContact NZ-NE2 3.15Å
277	M	98.5	Very high	96.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-69.4	-33.8	173.6	-70	169.6	166.1	0	0	112.5	L119 I197 I200 F204 L273 L274 R285 I286 I291	L119-M277 HydrophobicContact CD1-CE 4.06Å; L119-M277 HydrophobicContact CD2-CE 4.3Å; I197-M277 HydrophobicContact CG2-CB 4.09Å; I197-M277 HydrophobicContact CG2-CG 4.05Å; I200-M277 HydrophobicContact CG2-CE 4.21Å; F204-M277 HydrophobicContact CD1-SD 4.11Å; L273-M277 HydrophobicContact CD1-CE 3.92Å; L273-M277 HydrophobicContact CD1-CG 4.4Å; L273-M277 HydrophobicContact CD1-SD 4.5Å; L273-M277 HydrophobicContact CD2-CE 3.87Å; L273-M277 HydrophobicContact CG-CE 3.73Å; L273-M277 HydrophobicContact CG-SD 4.1Å; L273-M277 WeakPolarHBondContact O-CG 3.45Å; L273-M277 PolarHBondContact O-N 3.13Å; L274-M277 HydrophobicContact CD1-SD 4.47Å; L274-M277 PolarHBondContact O-N 3.01Å; L274-M277 VanDerWaalsContact O-N 3.16Å; M277-R285 WeakPolarHBondContact O-CD 3.41Å; M277-R285 WeakPolarHBondContact O-CG 3.31Å; M277-I286 HydrophobicContact CB-CG2 4.47Å; M277-I286 HydrophobicContact CG-CG2 3.89Å; M277-I291 HydrophobicContact CE-CB 4.31Å; M277-I291 HydrophobicContact CE-CD1 3.55Å; M277-I291 HydrophobicContact CE-CG1 3.79Å; M277-I291 HydrophobicContact CE-CG2 3.54Å; M277-I291 HydrophobicContact CG-CD1 4.11Å; M277-I291 HydrophobicContact CG-CG1 4.38Å
278	L	98.2	Very high	96.5	Very high	7 Å²	7	48 Å²	48	4%	0.037	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102	29.4	-176	-59.9	179	0	0	0	113.2	W198 L213 F214 L230 L259 L274	W198-L278 HydrophobicContact CD2-CD2 3.82Å; W198-L278 HydrophobicContact CE3-CB 4.41Å; W198-L278 HydrophobicContact CE3-CD2 3.87Å; W198-L278 HydrophobicContact CG-CD2 4.34Å; W198-L278 HydrophobicContact CH2-CD2 4.37Å; W198-L278 HydrophobicContact CZ2-CD2 4.3Å; W198-L278 HydrophobicContact CZ3-CB 4.1Å; W198-L278 HydrophobicContact CZ3-CD2 4.16Å; W198-L278 WeakPolarHBondContact CZ3-O 3.28Å; L213-L278 HydrophobicContact CD2-CD1 3.59Å; F214-L278 HydrophobicContact CE2-CD1 4.43Å; F214-L278 HydrophobicContact CE2-CD2 4.39Å; F214-L278 HydrophobicContact CZ-CD1 4.29Å; L230-L278 HydrophobicContact CD1-CB 4.17Å; L259-L278 HydrophobicContact CD1-CD1 3.97Å; L259-L278 HydrophobicContact CD2-CD1 4.08Å; L274-L278 HydrophobicContact CD1-CD1 3.97Å; L274-L278 HydrophobicContact CD1-CG 4.26Å; L274-L278 HydrophobicContact CD2-CD1 4.5Å; L274-L278 HydrophobicContact CG-CD1 3.92Å; L274-L278 HydrophobicContact CG-CG 4.44Å; L274-L278 WeakPolarHBondContact O-CB 3.48Å; L274-L278 WeakPolarHBondContact O-CG 3.33Å; L274-L278 PolarHBondContact O-N 3.21Å
279	K	97.6	Very high	96.6	Very high	100 Å²	100	48.4 Å²	48.4	44%	0.435	25%	0.245	S	C	.	.			trans	-65.5	135.6	169	-77.3	-70.2	-173.4	174.1	0	110.2	R285	K279-R285 HydrophobicContact CB-CB 4.26Å; K279-R285 HydrophobicContact CB-CG 4.45Å; K279-R285 PolarHBondContact O-NE 3.38Å; K279-R285 PolarHBondContact O-NH2 3.49Å
280	Y	97.1	Very high	96.7	Very high	11 Å²	11	43.1 Å²	43.1	4%	0.043	23%	0.231	C	C	.	.	S	Bend	trans	-60.5	-59.3	176.6	-82.6	-64.2	0	0	0	111.6	P182 I226 F227 L230 G231 P233 E237 P282 R285	P182-Y280 HydrophobicContact CB-CD1 4.14Å; P182-Y280 HydrophobicContact CB-CE1 4.28Å; P182-Y280 HydrophobicContact CG-CD1 3.88Å; P182-Y280 HydrophobicContact CG-CE1 4.33Å; I226-Y280 HydrophobicContact CG2-CE1 3.79Å; F227-Y280 HydrophobicContact CD1-CE1 4.22Å; F227-Y280 WeakPolarHBondContact CD1-OH 3.38Å; F227-Y280 HydrophobicContact CE1-CE1 4.14Å; L230-Y280 HydrophobicContact CB-CE2 3.89Å; L230-Y280 WeakPolarHBondContact CB-OH 3.42Å; G231-Y280 VanDerWaalsContact O-CE2 3.3Å; G231-Y280 WeakPolarHBondContact O-CE2 3.28Å; G231-Y280 VanDerWaalsContact O-CZ 3.29Å; G231-Y280 PolarHBondContact O-OH 3.2Å; P233-Y280 HydrophobicContact CB-CD1 4.08Å; P233-Y280 HydrophobicContact CB-CD2 3.85Å; P233-Y280 HydrophobicContact CB-CE1 4.26Å; P233-Y280 HydrophobicContact CB-CE2 4.01Å; P233-Y280 HydrophobicContact CB-CG 3.88Å; P233-Y280 HydrophobicContact CG-CD1 4.21Å; P233-Y280 HydrophobicContact CG-CE1 4.07Å; P233-Y280 HydrophobicContact CG-CE2 4.49Å; E237-Y280 HydrophobicContact CB-CD2 4.1Å; Y280-P282 WeakPolarHBondContact O-CD 3.29Å; Y280-P282 VanDerWaalsContact O-N 3.16Å; Y280-R285 PolarHBondContact O-NH2 3.02Å
281	D	95.3	Very high	96.8	Very high	28 Å²	28	43.1 Å²	43.1	15%	0.15	23%	0.231	C	C	.	.	S	Bend	trans	-62	114.9	177	-170.2	-26.2	0	0	0	110.4	W238 A283 L284 R285	W238-D281 HydrophobicContact CB-CB 4.16Å; W238-D281 HydrophobicContact CG-CB 4.1Å; D281-A283 PolarHBondContact O-N 2.87Å; D281-A283 VanDerWaalsContact O-N 3.14Å; D281-A283 VanDerWaalsContact OD1-CB 3.28Å; D281-A283 WeakPolarHBondContact OD1-CB 3.41Å; D281-A283 PolarHBondContact OD1-N 3.18Å; D281-L284 HydrophobicContact CB-CB 4.15Å; D281-L284 HydrophobicContact CB-CD1 4.02Å; D281-L284 HydrophobicContact CB-CG 3.97Å; D281-L284 PolarHBondContact O-N 3.43Å; D281-R285 PolarHBondContact O-N 3.08Å
282	P	93.7	Very high	96.7	Very high	21 Å²	21	44.5 Å²	44.5	14%	0.136	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-23.3	179.8	-22.3	34.5	0	0	0	113.3	E183 W238 Y280	E183-P282 HydrophobicContact CB-CG 4.01Å; E183-P282 HydrophobicContact CG-CG 3.9Å; W238-P282 HydrophobicContact CZ2-CG 4.44Å; Y280-P282 WeakPolarHBondContact O-CD 3.29Å; Y280-P282 VanDerWaalsContact O-N 3.16Å
283	A	92.9	Very high	96.6	Very high	86 Å²	86	47.9 Å²	47.9	71%	0.711	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-24.5	176.9	0	0	0	0	0	113	D281	D281-A283 PolarHBondContact O-N 2.87Å; D281-A283 VanDerWaalsContact O-N 3.14Å; D281-A283 VanDerWaalsContact OD1-CB 3.28Å; D281-A283 WeakPolarHBondContact OD1-CB 3.41Å; D281-A283 PolarHBondContact OD1-N 3.18Å
284	L	95.9	Very high	96.5	Very high	114 Å²	114	48.5 Å²	48.5	60%	0.597	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-8	177.4	-58.6	-177.9	0	0	0	112.9	D281	D281-L284 HydrophobicContact CB-CB 4.15Å; D281-L284 HydrophobicContact CB-CD1 4.02Å; D281-L284 HydrophobicContact CB-CG 3.97Å; D281-L284 PolarHBondContact O-N 3.43Å
285	R	97.4	Very high	96.5	Very high	11 Å²	11	51.4 Å²	51.4	4%	0.042	28%	0.275	C	S	.	.	S	Bend	trans	-67.9	134.9	176.6	-157.6	175.3	-66.6	150.8	6.3	110.1	E183 G194 I197 M277 K279 Y280 D281	E183-R285 IonicContact OE1-CZ 3.92Å; E183-R285 IonicContact OE1-NH1 2.95Å; E183-R285 PolarHBondContact OE1-NH1 3.23Å; E183-R285 IonicContact OE1-NH2 3.57Å; E183-R285 IonicContact OE2-CZ 2.71Å; E183-R285 IonicContact OE2-NH1 2.87Å; E183-R285 PolarHBondContact OE2-NH1 3.35Å; E183-R285 IonicContact OE2-NH2 3.62Å; E183-R285 PolarHBondContact OE2-NH2 2.88Å; G194-R285 WeakPolarHBondContact O-CD 3.4Å; G194-R285 PolarHBondContact O-NH1 3.24Å; I197-R285 HydrophobicContact CB-CG 4.32Å; I197-R285 HydrophobicContact CG2-CG 3.96Å; M277-R285 WeakPolarHBondContact O-CD 3.41Å; M277-R285 WeakPolarHBondContact O-CG 3.31Å; K279-R285 HydrophobicContact CB-CB 4.26Å; K279-R285 HydrophobicContact CB-CG 4.45Å; K279-R285 PolarHBondContact O-NE 3.38Å; K279-R285 PolarHBondContact O-NH2 3.49Å; Y280-R285 PolarHBondContact O-NH2 3.02Å; D281-R285 PolarHBondContact O-N 3.08Å
286	I	98.3	Very high	96.3	Very high	27 Å²	27	47.8 Å²	47.8	14%	0.138	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-57.8	141.8	-178.9	-167.8	171.3	0	0	0	110.9	I197 L273 K276 M277 G290 I291	I197-I286 WeakPolarHBondContact CG1-O 3.37Å; I197-I286 HydrophobicContact CG2-CG2 4.1Å; I197-I286 WeakPolarHBondContact CG2-O 3.5Å; L273-I286 HydrophobicContact CD1-CD1 4.09Å; K276-I286 HydrophobicContact CB-CB 3.91Å; K276-I286 HydrophobicContact CB-CD1 4.29Å; K276-I286 HydrophobicContact CB-CG2 3.94Å; K276-I286 HydrophobicContact CD-CD1 4Å; K276-I286 PolarHBondContact O-N 3.24Å; K276-I286 VanDerWaalsContact O-N 3.11Å; M277-I286 HydrophobicContact CB-CG2 4.47Å; M277-I286 HydrophobicContact CG-CG2 3.89Å; I286-G290 VanDerWaalsContact CD1-C 3.5Å; I286-I291 HydrophobicContact CB-CG1 4.46Å; I286-I291 HydrophobicContact CD1-CG1 4.05Å; I286-I291 HydrophobicContact CG1-CG1 4.13Å; I286-I291 HydrophobicContact CG2-CD1 4.04Å; I286-I291 HydrophobicContact CG2-CG1 3.59Å
287	T	98.2	Very high	96	Very high	89 Å²	89	45 Å²	45	55%	0.546	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-79.2	160.1	175.8	63.1	0	0	0	0	111.1	K289 G290 I291	T287-K289 PolarHBondContact O-N 3.33Å; T287-G290 CarbonylContact O-C 3.59Å; T287-G290 WeakPolarHBondContact O-CA 3.3Å; T287-G290 PolarHBondContact O-N 2.81Å; T287-G290 PolarHBondContact OG1-N 3.38Å; T287-G290 VanDerWaalsContact OG1-N 3.1Å; T287-I291 WeakPolarHBondContact O-CG1 3.27Å; T287-I291 PolarHBondContact O-N 3.48Å
288	S	96.9	Very high	95.6	Very high	6 Å²	6	55.1 Å²	55.1	4%	0.042	29%	0.286	C	S	.	.	H	α-helix	trans	-54.1	-40	172.6	48.2	0	0	0	0	112.7	T123 C127 H130 I291 K292	T123-S288 WeakPolarHBondContact CG2-O 3.32Å; C127-S288 WeakPolarHBondContact CA-OG 3.47Å; H130-S288 PolarHBondContact ND1-OG 2.91Å; H130-S288 VanDerWaalsContact ND1-OG 3.13Å; S288-I291 PolarHBondContact O-N 2.85Å; S288-K292 PolarHBondContact O-N 3.32Å
289	K	96.4	Very high	94.9	Very high	144 Å²	144	58.7 Å²	58.7	63%	0.626	32%	0.324	S	S	*	.	H	α-helix	trans	-62.8	-42.2	171.4	-171.8	176.4	-178.7	179.9	0	112.5	T287 I291 K292 L293	T287-K289 PolarHBondContact O-N 3.33Å; K289-I291 VanDerWaalsContact C-N 3.35Å; K289-K292 PolarHBondContact O-N 2.96Å; K289-L293 HydrophobicContact CG-CD1 4.43Å; K289-L293 WeakPolarHBondContact O-CG 3.32Å; K289-L293 PolarHBondContact O-N 3.14Å
290	G	97.3	Very high	94.3	Very high	22 Å²	22	55.4 Å²	55.4	23%	0.227	31%	0.311	C	S	.	.	H	α-helix	trans	-62.2	-40.5	176.8	0	0	0	0	0	112.7	I286 T287 L293 H294	I286-G290 VanDerWaalsContact CD1-C 3.5Å; T287-G290 CarbonylContact O-C 3.59Å; T287-G290 WeakPolarHBondContact O-CA 3.3Å; T287-G290 PolarHBondContact O-N 2.81Å; T287-G290 PolarHBondContact OG1-N 3.38Å; T287-G290 VanDerWaalsContact OG1-N 3.1Å; G290-L293 PolarHBondContact O-N 3.47Å; G290-H294 PolarHBondContact O-N 2.87Å
291	I	97	Very high	93.6	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-59.2	-50.4	176.1	-64.9	165.3	0	0	0	110	T123 I197 L273 M277 I286 T287 S288 K289 L293 H294 F297	T123-I291 HydrophobicContact CG2-CB 3.59Å; T123-I291 HydrophobicContact CG2-CD1 4.17Å; T123-I291 HydrophobicContact CG2-CG1 4.49Å; T123-I291 HydrophobicContact CG2-CG2 3.44Å; T123-I291 VanDerWaalsContact CG2-CG2 3.44Å; I197-I291 HydrophobicContact CD1-CD1 3.84Å; I197-I291 HydrophobicContact CG2-CD1 3.92Å; L273-I291 HydrophobicContact CD1-CB 4.35Å; L273-I291 HydrophobicContact CD1-CG1 4.08Å; L273-I291 HydrophobicContact CD1-CG2 4.14Å; L273-I291 HydrophobicContact CD2-CG2 4.26Å; M277-I291 HydrophobicContact CE-CB 4.31Å; M277-I291 HydrophobicContact CE-CD1 3.55Å; M277-I291 HydrophobicContact CE-CG1 3.79Å; M277-I291 HydrophobicContact CE-CG2 3.54Å; M277-I291 HydrophobicContact CG-CD1 4.11Å; M277-I291 HydrophobicContact CG-CG1 4.38Å; I286-I291 HydrophobicContact CB-CG1 4.46Å; I286-I291 HydrophobicContact CD1-CG1 4.05Å; I286-I291 HydrophobicContact CG1-CG1 4.13Å; I286-I291 HydrophobicContact CG2-CD1 4.04Å; I286-I291 HydrophobicContact CG2-CG1 3.59Å; T287-I291 WeakPolarHBondContact O-CG1 3.27Å; T287-I291 PolarHBondContact O-N 3.48Å; S288-I291 PolarHBondContact O-N 2.85Å; K289-I291 VanDerWaalsContact C-N 3.35Å; I291-L293 PolarHBondContact O-N 3.4Å; I291-L293 VanDerWaalsContact O-N 3.07Å; I291-H294 WeakPolarHBondContact O-CB 3.27Å; I291-H294 PolarHBondContact O-N 2.77Å; I291-F297 HydrophobicContact CG2-CE2 3.68Å; I291-F297 HydrophobicContact CG2-CZ 4.11Å; I291-F297 WeakPolarHBondContact O-CD2 3.25Å; I291-F297 WeakPolarHBondContact O-CE2 3.06Å
292	K	93.1	Very high	93	Very high	50 Å²	50	60.9 Å²	60.9	22%	0.217	34%	0.338	C	S	.	.	H	α-helix	trans	-59.6	-23.3	-179.8	-69.6	177.5	62.4	-176.4	0	114.5	Y120 T123 D124 C127 S288 K289	Y120-K292 HydrophobicContact CE2-CB 4.34Å; Y120-K292 HydrophobicContact CE2-CG 4.29Å; T123-K292 HydrophobicContact CG2-CG 3.77Å; D124-K292 WeakPolarHBondContact OD1-CE 3.36Å; D124-K292 IonicContact OD1-NZ 2.59Å; D124-K292 PolarHBondContact OD1-NZ 3.21Å; C127-K292 HydrophobicContact CB-CD 4.09Å; S288-K292 PolarHBondContact O-N 3.32Å; K289-K292 PolarHBondContact O-N 2.96Å
293	L	94.2	Very high	92.2	Very high	135 Å²	135	63.1 Å²	63.1	71%	0.707	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-0.8	178.1	-63.8	175.2	0	0	0	112.7	K289 G290 I291	K289-L293 HydrophobicContact CG-CD1 4.43Å; K289-L293 WeakPolarHBondContact O-CG 3.32Å; K289-L293 PolarHBondContact O-N 3.14Å; G290-L293 PolarHBondContact O-N 3.47Å; I291-L293 PolarHBondContact O-N 3.4Å; I291-L293 VanDerWaalsContact O-N 3.07Å
294	H	96.9	Very high	91.5	Very high	13 Å²	13	62 Å²	62	6%	0.06	34%	0.341	C	S	.	.	S	Bend	trans	-66.3	142.6	-176.8	-159.9	-96.7	0	0	0	111.4	Y269 D272 L273 K276 G290 I291 Y296 F297	Y269-H294 PolarHBondContact O-CE1 3.05Å; Y269-H294 VanDerWaalsContact O-CE1 3.22Å; D272-H294 IonicContact OD2-CE1 3.72Å; D272-H294 PolarHBondContact OD2-CE1 2.97Å; D272-H294 IonicContact OD2-NE2 2.75Å; D272-H294 PolarHBondContact OD2-NE2 3.39Å; L273-H294 HydrophobicContact CD1-CB 3.95Å; K276-H294 PolarHBondContact NZ-NE2 3.24Å; K276-H294 VanDerWaalsContact NZ-NE2 3.15Å; G290-H294 PolarHBondContact O-N 2.87Å; I291-H294 WeakPolarHBondContact O-CB 3.27Å; I291-H294 PolarHBondContact O-N 2.77Å; H294-Y296 WeakPolarHBondContact ND1-CB 3.32Å; H294-Y296 PolarHBondContact ND1-N 2.91Å; H294-Y296 PolarHBondContact O-N 3.4Å; H294-F297 HydrophobicContact CB-CD2 4.39Å; H294-F297 PolarHBondContact O-N 3.27Å
295	P	95.5	Very high	90.8	Very high	61 Å²	61	56.7 Å²	56.7	40%	0.396	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-54	-20.8	175.3	-29.4	36.3	0	0	0	115	Y269 F297 R298	Y269-P295 HydrophobicContact CD1-CB 3.73Å; Y269-P295 HydrophobicContact CE1-CB 3.89Å; P295-F297 PolarHBondContact O-N 3.09Å; P295-R298 WeakPolarHBondContact O-CB 3.5Å; P295-R298 PolarHBondContact O-N 3.15Å
296	Y	94.2	Very high	89.8	Confident	9 Å²	9	57.5 Å²	57.5	4%	0.035	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-56.2	-32.6	174.7	-175.3	-113.5	0	0	0	113	K115 L119 F204 I266 D267 L273 H294	K115-Y296 HydrophobicContact CB-CE1 3.87Å; K115-Y296 HydrophobicContact CD-CE1 4.22Å; K115-Y296 HydrophobicContact CD-CE2 4.43Å; K115-Y296 VanDerWaalsContact CD-O 3.24Å; K115-Y296 WeakPolarHBondContact CD-O 3.37Å; K115-Y296 VanDerWaalsContact CE-CD2 3.46Å; K115-Y296 WeakPolarHBondContact CE-O 3.38Å; K115-Y296 HydrophobicContact CG-CD1 4.07Å; K115-Y296 HydrophobicContact CG-CE1 3.61Å; K115-Y296 PolarHBondContact NZ-O 3.42Å; L119-Y296 HydrophobicContact CD2-CD1 4.23Å; L119-Y296 HydrophobicContact CD2-CE1 3.89Å; F204-Y296 HydrophobicContact CE1-CE1 4.48Å; F204-Y296 HydrophobicContact CE2-CE1 4.15Å; F204-Y296 AromaticContact CZ-CE1 3.71Å; F204-Y296 HydrophobicContact CZ-CE1 3.71Å; F204-Y296 HydrophobicContact CZ-CE2 4.25Å; F204-Y296 AromaticContact CZ-CZ 3.55Å; F204-Y296 WeakPolarHBondContact CZ-OH 3.28Å; I266-Y296 HydrophobicContact CG2-CE2 4.01Å; D267-Y296 WeakPolarHBondContact OD1-CD2 3.08Å; D267-Y296 WeakPolarHBondContact OD1-CE2 3.41Å; L273-Y296 HydrophobicContact CD2-CD1 3.73Å; L273-Y296 HydrophobicContact CD2-CG 4.09Å; H294-Y296 WeakPolarHBondContact ND1-CB 3.32Å; H294-Y296 PolarHBondContact ND1-N 2.91Å; H294-Y296 PolarHBondContact O-N 3.4Å
297	F	92.5	Very high	88.5	Confident	12 Å²	12	58.2 Å²	58.2	5%	0.053	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-93.6	9.4	177.8	-57	-69.8	0	0	0	113.5	K115 L119 Y120 L273 I291 H294 P295 G299 L300	K115-F297 HydrophobicContact CG-CD1 4.19Å; K115-F297 HydrophobicContact CG-CE1 4.47Å; K115-F297 WeakPolarHBondContact O-CE1 3.35Å; L119-F297 HydrophobicContact CB-CE1 4.36Å; L119-F297 HydrophobicContact CB-CZ 4.4Å; L119-F297 HydrophobicContact CD2-CE1 4.23Å; L119-F297 HydrophobicContact CD2-CZ 3.76Å; L119-F297 HydrophobicContact CG-CE1 4.33Å; L119-F297 HydrophobicContact CG-CZ 3.88Å; Y120-F297 AromaticContact CD2-CD1 3.95Å; Y120-F297 HydrophobicContact CD2-CD1 3.95Å; Y120-F297 HydrophobicContact CD2-CD2 4.45Å; Y120-F297 HydrophobicContact CD2-CE1 4.22Å; Y120-F297 HydrophobicContact CD2-CG 4.06Å; Y120-F297 HydrophobicContact CG-CD1 4.5Å; L273-F297 HydrophobicContact CD2-CE2 3.94Å; L273-F297 HydrophobicContact CD2-CZ 4.15Å; I291-F297 HydrophobicContact CG2-CE2 3.68Å; I291-F297 HydrophobicContact CG2-CZ 4.11Å; I291-F297 WeakPolarHBondContact O-CD2 3.25Å; I291-F297 WeakPolarHBondContact O-CE2 3.06Å; H294-F297 HydrophobicContact CB-CD2 4.39Å; H294-F297 PolarHBondContact O-N 3.27Å; P295-F297 PolarHBondContact O-N 3.09Å; F297-G299 PolarHBondContact O-N 3.04Å; F297-L300 HydrophobicContact CB-CD2 4.41Å; F297-L300 HydrophobicContact CD1-CD2 4.05Å; F297-L300 WeakPolarHBondContact O-CB 3.41Å; F297-L300 PolarHBondContact O-N 3.35Å
298	R	88.2	Confident	87.4	Confident	212 Å²	212	54.6 Å²	54.6	80%	0.8	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	133.6	176.2	-159.9	179.9	-148.6	167.8	5.5	109.3	P295 L300	P295-R298 WeakPolarHBondContact O-CB 3.5Å; P295-R298 PolarHBondContact O-N 3.15Å; R298-L300 VanDerWaalsContact C-N 3.29Å
299	G	84.3	Confident	85.6	Confident	82 Å²	82	57.9 Å²	57.9	85%	0.845	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	-4.2	-175.6	0	0	0	0	0	114.7	F297 D301	F297-G299 PolarHBondContact O-N 3.04Å; G299-D301 PolarHBondContact O-N 2.83Å
300	L	85.2	Confident	83.6	Confident	31 Å²	31	59.1 Å²	59.1	16%	0.162	34%	0.342	C	S	.	.			trans	-67.7	114.3	172.3	175.8	56.2	0	0	0	110.6	A116 Y120 F297 R298 K302	A116-L300 HydrophobicContact CB-CD1 3.17Å; A116-L300 HydrophobicContact CB-CG 4.46Å; Y120-L300 HydrophobicContact CD1-CD2 4.32Å; Y120-L300 HydrophobicContact CD2-CD2 3.82Å; Y120-L300 HydrophobicContact CE2-CD2 4.48Å; Y120-L300 HydrophobicContact CG-CD2 3.73Å; F297-L300 HydrophobicContact CB-CD2 4.41Å; F297-L300 HydrophobicContact CD1-CD2 4.05Å; F297-L300 WeakPolarHBondContact O-CB 3.41Å; F297-L300 PolarHBondContact O-N 3.35Å; R298-L300 VanDerWaalsContact C-N 3.29Å; L300-K302 HydrophobicContact CD2-CG 4.44Å; L300-K302 HydrophobicContact CG-CG 4.19Å; L300-K302 PolarHBondContact O-N 3.18Å; L300-K302 VanDerWaalsContact O-N 3.1Å
301	D	83.3	Confident	81.4	Confident	90 Å²	90	64.5 Å²	64.5	48%	0.481	36%	0.355	S	S	.	.			trans	-75.1	95.5	168.4	178.4	14.9	0	0	0	110.6	G299 S303 S304	G299-D301 PolarHBondContact O-N 2.83Å; D301-S303 VanDerWaalsContact CG-OG 3.31Å; D301-S303 PolarHBondContact O-N 3.32Å; D301-S303 WeakPolarHBondContact OD1-CB 3.48Å; D301-S303 PolarHBondContact OD1-N 3.06Å; D301-S303 PolarHBondContact OD1-OG 3.44Å; D301-S303 PolarHBondContact OD2-OG 3.47Å; D301-S304 PolarHBondContact O-N 3.33Å; D301-S304 PolarHBondContact O-OG 3.3Å
302	K	80.8	Confident	78.7	Confident	64 Å²	64	69.8 Å²	69.8	28%	0.278	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-68.8	-19.3	-179.6	-60.7	171.7	-177.4	-170	0	113.1	Y120 L300 S304 L305 Y308 M312	Y120-K302 HydrophobicContact CE1-CD 4.41Å; Y120-K302 HydrophobicContact CE1-CG 4.37Å; Y120-K302 HydrophobicContact CE2-CD 4.35Å; Y120-K302 WeakPolarHBondContact OH-CD 3.17Å; Y120-K302 VanDerWaalsContact OH-CE 3.32Å; Y120-K302 WeakPolarHBondContact OH-CE 3.31Å; Y120-K302 PolarHBondContact OH-NZ 3.24Å; Y120-K302 VanDerWaalsContact OH-NZ 3.12Å; L300-K302 HydrophobicContact CD2-CG 4.44Å; L300-K302 HydrophobicContact CG-CG 4.19Å; L300-K302 PolarHBondContact O-N 3.18Å; L300-K302 VanDerWaalsContact O-N 3.1Å; K302-S304 PolarHBondContact O-N 2.88Å; K302-L305 HydrophobicContact CB-CD1 4.45Å; K302-L305 WeakPolarHBondContact O-CB 3.34Å; K302-L305 PolarHBondContact O-N 3.49Å; K302-Y308 WeakPolarHBondContact O-CB 3.25Å; K302-M312 HydrophobicContact CB-CE 3.45Å; K302-M312 VanDerWaalsContact CB-CE 3.45Å; K302-M312 HydrophobicContact CD-CE 4.2Å; K302-M312 HydrophobicContact CG-CE 4.47Å
303	S	78.7	Confident	75.7	Confident	68 Å²	68	81.2 Å²	81.2	48%	0.476	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-72.6	-22.9	179.4	74.8	0	0	0	0	112.3	D301 L305	D301-S303 VanDerWaalsContact CG-OG 3.31Å; D301-S303 PolarHBondContact O-N 3.32Å; D301-S303 WeakPolarHBondContact OD1-CB 3.48Å; D301-S303 PolarHBondContact OD1-N 3.06Å; D301-S303 PolarHBondContact OD1-OG 3.44Å; D301-S303 PolarHBondContact OD2-OG 3.47Å; S303-L305 VanDerWaalsContact C-N 3.3Å
304	S	78	Confident	74.8	Confident	62 Å²	62	78.6 Å²	78.6	43%	0.434	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-78.6	-9.1	174	72.5	0	0	0	0	114.3	D301 K302	D301-S304 PolarHBondContact O-N 3.33Å; D301-S304 PolarHBondContact O-OG 3.3Å; K302-S304 PolarHBondContact O-N 2.88Å
305	L	80.4	Confident	73.6	Confident	3 Å²	3	82 Å²	82	2%	0.016	43%	0.427	C	S	.	.	S	Bend	trans	-75.3	134.3	-178.9	-65	176.5	0	0	0	111.2	A116 Y117 Y120 K302 S303 G307 Y308	A116-L305 WeakPolarHBondContact O-CD2 3.36Å; Y117-L305 HydrophobicContact CD1-CD2 4.21Å; Y117-L305 HydrophobicContact CE1-CD2 4.4Å; Y120-L305 HydrophobicContact CD1-CD1 3.53Å; Y120-L305 HydrophobicContact CE1-CD1 3.91Å; Y120-L305 HydrophobicContact CG-CD1 4.45Å; K302-L305 HydrophobicContact CB-CD1 4.45Å; K302-L305 WeakPolarHBondContact O-CB 3.34Å; K302-L305 PolarHBondContact O-N 3.49Å; S303-L305 VanDerWaalsContact C-N 3.3Å; L305-G307 PolarHBondContact O-N 2.97Å; L305-Y308 HydrophobicContact CB-CD2 3.47Å; L305-Y308 VanDerWaalsContact CB-CD2 3.47Å; L305-Y308 HydrophobicContact CB-CE2 4.08Å; L305-Y308 HydrophobicContact CB-CG 4.03Å; L305-Y308 HydrophobicContact CD1-CD2 4.3Å; L305-Y308 HydrophobicContact CD1-CE2 4.29Å; L305-Y308 PolarHBondContact O-N 3.5Å; L305-Y308 VanDerWaalsContact O-N 3.15Å
306	P	76.6	Confident	72.4	Confident	27 Å²	27	83.2 Å²	83.2	18%	0.175	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	127.9	176.3	-25.1	33.4	0	0	0	112	K149 T151 Y308	K149-P306 VanDerWaalsContact O-CG 3.28Å; K149-P306 WeakPolarHBondContact O-CG 3.31Å; T151-P306 WeakPolarHBondContact OG1-CB 3.23Å; P306-Y308 VanDerWaalsContact C-N 3.35Å; P306-Y308 WeakPolarHBondContact O-CD2 3.26Å; P306-Y308 PolarHBondContact O-N 2.65Å
307	G	71.9	Confident	71.1	Confident	43 Å²	43	87.5 Å²	87.5	44%	0.443	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	0.2	178.4	0	0	0	0	0	116.2	L305	L305-G307 PolarHBondContact O-N 2.97Å
308	Y	74.8	Confident	69.8	Low	12 Å²	12	92.3 Å²	92.3	5%	0.047	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-19.9	179.4	-77	-95.6	0	0	0	114.8	P70 N71 Y120 Q121 D124 K302 L305 P306 E310 R311 M312	P70-Y308 HydrophobicContact CG-CE2 4.42Å; N71-Y308 PolarHBondContact OD1-OH 3.25Å; Y120-Y308 HydrophobicContact CE1-CE1 4.22Å; Q121-Y308 HydrophobicContact CG-CE2 4.15Å; D124-Y308 WeakPolarHBondContact CB-OH 3.04Å; D124-Y308 WeakPolarHBondContact OD2-CE1 3.29Å; D124-Y308 PolarHBondContact OD2-OH 2.8Å; K302-Y308 WeakPolarHBondContact O-CB 3.25Å; L305-Y308 HydrophobicContact CB-CD2 3.47Å; L305-Y308 VanDerWaalsContact CB-CD2 3.47Å; L305-Y308 HydrophobicContact CB-CE2 4.08Å; L305-Y308 HydrophobicContact CB-CG 4.03Å; L305-Y308 HydrophobicContact CD1-CD2 4.3Å; L305-Y308 HydrophobicContact CD1-CE2 4.29Å; L305-Y308 PolarHBondContact O-N 3.5Å; L305-Y308 VanDerWaalsContact O-N 3.15Å; P306-Y308 VanDerWaalsContact C-N 3.35Å; P306-Y308 WeakPolarHBondContact O-CD2 3.26Å; P306-Y308 PolarHBondContact O-N 2.65Å; Y308-E310 VanDerWaalsContact C-N 3.26Å; Y308-E310 PolarHBondContact O-N 2.95Å; Y308-R311 PolarHBondContact O-N 3.22Å; Y308-M312 HydrophobicContact CD1-CE 4.5Å
309	S	59.3	Low	68.6	Low	75 Å²	75	84.3 Å²	84.3	52%	0.524	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-29.4	-177.8	52	0	0	0	0	113.6
310	E	52.6	Low	67.5	Low	171 Å²	171	84.4 Å²	84.4	80%	0.799	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-19.7	179.4	-72.8	-178.7	168.6	0	0	114	Y308	Y308-E310 VanDerWaalsContact C-N 3.26Å; Y308-E310 PolarHBondContact O-N 2.95Å
311	R	51.2	Low	66.1	Low	134 Å²	134	88.5 Å²	88.5	51%	0.506	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-8	-174.2	-79.1	-175.6	174.4	-150.7	-5.5	115	G68 Y308 R313	G68-R311 PolarHBondContact O-NH2 3.25Å; Y308-R311 PolarHBondContact O-N 3.22Å; R311-R313 VanDerWaalsContact C-N 3.34Å
312	M	41.1	Very low	64.7	Low	111 Å²	111	88.4 Å²	88.4	55%	0.547	45%	0.445	S	S	.	.			trans	-94.6	11.8	175.1	-62.5	-155.6	-171.7	0	0	113.4	K302 Y308	K302-M312 HydrophobicContact CB-CE 3.45Å; K302-M312 VanDerWaalsContact CB-CE 3.45Å; K302-M312 HydrophobicContact CD-CE 4.2Å; K302-M312 HydrophobicContact CG-CE 4.47Å; Y308-M312 HydrophobicContact CD1-CE 4.5Å
313	R	30.7	Very low	63.2	Low	291 Å²	291	90.6 Å²	90.6	100%	1.098	46%	0.46	S	S	*	.			trans	-106.7	0	171.4	-69.6	-173.3	-177.9	-175.9	1.3	110.8	R311	R311-R313 VanDerWaalsContact C-N 3.34Å

Retrieved 313 of 313 residues in 181 ms (Link to these results)

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