A0A061I033_CRIGR Loading...

Stress-activated protein kinase JNK

Responds to activation by environmental stress and pro-inflammatory cytokines by phosphorylating a number of transcription factors, and thus regulates transcriptional activity.

AlphaFold DB (Q9WTU6), UniProt , Accession A0A061I033, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Mapk9, Length 423 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32	Very low	58.1	Low	247 Å²	247	114.3 Å²	114.3	100%	1.217	62%	0.623	S	S	*	*				0	81.5	0	-79.9	171.2	169.7	0	0	108.2
2	S	34.8	Very low	61.2	Low	118 Å²	118	111.1 Å²	111.1	83%	0.825	62%	0.615	S	S	*	*			trans	-178.9	7.7	164.7	52.6	0	0	0	0	114
3	D	34	Very low	63.8	Low	144 Å²	144	106.1 Å²	106.1	77%	0.77	59%	0.589	S	S	*	*			trans	-93.9	114.7	172.6	-77.8	-43.7	0	0	0	110.8
4	S	42.2	Very low	65.9	Low	104 Å²	104	108.1 Å²	108.1	73%	0.727	59%	0.592	S	S	*	*			trans	167.9	-5.9	152.9	42.9	0	0	0	0	116.6
5	K	39	Very low	67.4	Low	208 Å²	208	101.3 Å²	101.3	90%	0.904	56%	0.555	S	S	*	*	S	Bend	trans	-84.7	-11.2	-172.6	-79.9	-169.9	177.6	-179.3	0	117.1
6	S	48.8	Very low	68.2	Low	38 Å²	38	100.1 Å²	100.1	27%	0.266	56%	0.563	S	S	.	*	S	Bend	trans	-103.1	-19.8	-172	58.5	0	0	0	0	115.4	G8 Q9 K96	S6-G8 PolarHBondContact O-N 3.35Å; S6-Q9 PolarHBondContact O-N 2.9Å; S6-Q9 VanDerWaalsContact O-N 3.15Å; S6-K96 WeakPolarHBondContact OG-CE 3.38Å; S6-K96 PolarHBondContact OG-NZ 3.31Å
7	D	54.3	Low	69.1	Low	129 Å²	129	104.5 Å²	104.5	69%	0.69	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-12.7	175.1	-81.4	8.7	0	0	0	112.1	Q9	D7-Q9 VanDerWaalsContact C-N 3.27Å; D7-Q9 PolarHBondContact O-N 3.19Å
8	G	73.2	Confident	70.2	Confident	46 Å²	46	100.1 Å²	100.1	47%	0.474	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.1	-14.8	174.6	0	0	0	0	0	115.3	S6 K24	S6-G8 PolarHBondContact O-N 3.35Å; G8-K24 WeakPolarHBondContact O-CD 2.93Å; G8-K24 WeakPolarHBondContact O-CE 3Å; G8-K24 PolarHBondContact O-NZ 3.32Å
9	Q	89.2	Confident	71.4	Confident	113 Å²	113	97.5 Å²	97.5	53%	0.528	55%	0.549	S	S	.	.	S	Bend	trans	-98.9	-26.3	-172.1	-66.4	-172.8	2.5	0	0	115	S6 D7 K24	S6-Q9 PolarHBondContact O-N 2.9Å; S6-Q9 VanDerWaalsContact O-N 3.15Å; D7-Q9 VanDerWaalsContact C-N 3.27Å; D7-Q9 PolarHBondContact O-N 3.19Å; Q9-K24 WeakPolarHBondContact O-CG 3.22Å; Q9-K24 PolarHBondContact O-N 3.24Å
10	F	95.2	Very high	72.7	Confident	42 Å²	42	92.6 Å²	92.6	18%	0.184	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	162	-177.8	-65.8	-91.6	0	0	0	111.5	T21 V22 L23 F92 T93 P94	F10-T21 HydrophobicContact CB-CG2 3.99Å; F10-V22 CarbonylContact C-O 3.58Å; F10-V22 VanDerWaalsContact CA-O 3.25Å; F10-V22 WeakPolarHBondContact CA-O 3.41Å; F10-V22 VanDerWaalsContact CD1-C 3.5Å; F10-L23 HydrophobicContact CD1-CD2 4.04Å; F10-L23 HydrophobicContact CD1-CG 4.31Å; F10-L23 HydrophobicContact CD2-CD2 4.48Å; F10-L23 HydrophobicContact CE1-CD2 3.48Å; F10-L23 VanDerWaalsContact CE1-CD2 3.48Å; F10-L23 HydrophobicContact CE1-CG 3.76Å; F10-L23 HydrophobicContact CE2-CD2 3.99Å; F10-L23 HydrophobicContact CG-CD2 4.5Å; F10-L23 HydrophobicContact CZ-CD2 3.46Å; F10-L23 VanDerWaalsContact CZ-CD2 3.46Å; F10-L23 HydrophobicContact CZ-CG 4.18Å; F10-F92 AromaticContact CE1-CD2 3.67Å; F10-F92 HydrophobicContact CE1-CD2 3.67Å; F10-F92 HydrophobicContact CE1-CE2 4.01Å; F10-F92 HydrophobicContact CZ-CD2 4.46Å; F10-T93 WeakPolarHBondContact CZ-O 3.29Å; F10-P94 HydrophobicContact CD1-CB 3.91Å; F10-P94 HydrophobicContact CE1-CB 4.07Å; F10-P94 HydrophobicContact CG-CB 4.28Å
11	Y	96.1	Very high	73.8	Confident	68 Å²	68	89.7 Å²	89.7	27%	0.267	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	153.6	166.6	78.6	-72.6	0	0	0	110	V13 T21 V22 K24 Y26 L29	Y11-V13 HydrophobicContact CD2-CG2 3.7Å; Y11-V13 HydrophobicContact CE2-CG2 3.19Å; Y11-T21 CarbonylContact O-C 3.58Å; Y11-T21 WeakPolarHBondContact O-CA 3.37Å; Y11-V22 HydrophobicContact CD1-CG2 4.06Å; Y11-V22 WeakPolarHBondContact CD1-O 2.83Å; Y11-V22 HydrophobicContact CE1-CG2 3.49Å; Y11-V22 VanDerWaalsContact CE1-CG2 3.49Å; Y11-V22 PolarHBondContact N-O 3.22Å; Y11-V22 PolarHBondContact O-N 3.01Å; Y11-K24 HydrophobicContact CD1-CG 4.09Å; Y11-Y26 VanDerWaalsContact CE1-O 3.29Å; Y11-Y26 WeakPolarHBondContact CE1-O 3.07Å; Y11-Y26 PolarHBondContact OH-O 2.88Å; Y11-L29 WeakPolarHBondContact OH-CD1 3.27Å
12	S	95.6	Very high	76.9	Confident	76 Å²	76	78 Å²	78	53%	0.531	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	138	-176.7	-64.5	0	0	0	0	111.7	F20 T21	S12-F20 CarbonylContact C-O 3.54Å; S12-F20 VanDerWaalsContact CA-O 3.26Å; S12-F20 WeakPolarHBondContact CA-O 3.48Å; S12-T21 PolarHBondContact OG-OG1 2.96Å
13	V	94.6	Very high	79.8	Confident	46 Å²	46	73.7 Å²	73.7	28%	0.279	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	138.5	174.8	-177.4	0	0	0	0	108.7	Y11 V15 F20	Y11-V13 HydrophobicContact CD2-CG2 3.7Å; Y11-V13 HydrophobicContact CE2-CG2 3.19Å; V13-V15 HydrophobicContact CG1-CG2 4.29Å; V13-F20 PolarHBondContact N-O 3.45Å; V13-F20 PolarHBondContact O-N 2.73Å
14	Q	93.5	Very high	82.8	Confident	135 Å²	135	72 Å²	72	63%	0.631	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.7	127.4	170.4	-65.5	-60.4	-7.3	0	0	110.1	S18 T19	Q14-S18 PolarHBondContact OE1-O 2.74Å; Q14-T19 VanDerWaalsContact CD-OG1 3.25Å; Q14-T19 PolarHBondContact NE2-OG1 3.31Å; Q14-T19 PolarHBondContact OE1-OG1 3.18Å
15	V	88.6	Confident	85.4	Confident	6 Å²	6	70.2 Å²	70.2	4%	0.036	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	109.6	178.5	-178.5	0	0	0	0	107.9	V13 D17 S18 F20 P31 I39 C41	V13-V15 HydrophobicContact CG1-CG2 4.29Å; V15-D17 PolarHBondContact O-N 3.36Å; V15-S18 CarbonylContact C-O 3.54Å; V15-S18 PolarHBondContact N-O 3.43Å; V15-S18 PolarHBondContact O-N 3.3Å; V15-S18 VanDerWaalsContact O-N 3.09Å; V15-F20 HydrophobicContact CB-CD2 3.72Å; V15-F20 HydrophobicContact CB-CE2 3.99Å; V15-F20 HydrophobicContact CB-CG 4.46Å; V15-F20 HydrophobicContact CG1-CD2 4.47Å; V15-F20 HydrophobicContact CG1-CE2 4.29Å; V15-F20 HydrophobicContact CG2-CB 4.17Å; V15-F20 HydrophobicContact CG2-CD2 3.78Å; V15-F20 HydrophobicContact CG2-CE2 4.38Å; V15-F20 HydrophobicContact CG2-CG 4.01Å; V15-P31 HydrophobicContact CG1-CB 3.7Å; V15-P31 HydrophobicContact CG1-CG 4.09Å; V15-I39 HydrophobicContact CG1-CG2 4.41Å; V15-C41 VanDerWaalsContact CG1-SG 3.54Å
16	A	80.1	Confident	88.1	Confident	82 Å²	82	60.3 Å²	60.3	68%	0.678	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	-128.5	-168.8	0	0	0	0	0	110.1	S18	A16-S18 VanDerWaalsContact C-N 3.29Å; A16-S18 PolarHBondContact O-N 3.44Å
17	D	83.7	Confident	90.4	Very high	174 Å²	174	62.7 Å²	62.7	93%	0.93	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	16.8	-178.9	-56.5	-34.2	0	0	0	113.6	V15	V15-D17 PolarHBondContact O-N 3.36Å
18	S	88.6	Confident	92.3	Very high	26 Å²	26	63.9 Å²	63.9	18%	0.182	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	144.7	-175	-171.5	0	0	0	0	112.8	Q14 V15 A16	Q14-S18 PolarHBondContact OE1-O 2.74Å; V15-S18 CarbonylContact C-O 3.54Å; V15-S18 PolarHBondContact N-O 3.43Å; V15-S18 PolarHBondContact O-N 3.3Å; V15-S18 VanDerWaalsContact O-N 3.09Å; A16-S18 VanDerWaalsContact C-N 3.29Å; A16-S18 PolarHBondContact O-N 3.44Å
19	T	93.7	Very high	93.4	Very high	50 Å²	50	62.9 Å²	62.9	31%	0.307	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	124.2	174	-52.2	0	0	0	0	110.6	Q14 K56 Y105	Q14-T19 VanDerWaalsContact CD-OG1 3.25Å; Q14-T19 PolarHBondContact NE2-OG1 3.31Å; Q14-T19 PolarHBondContact OE1-OG1 3.18Å; T19-K56 PolarHBondContact O-NZ 2.82Å; T19-Y105 PolarHBondContact O-OH 3.05Å
20	F	96.3	Very high	93.7	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	114.1	171.3	-87	-116.6	0	0	0	109.3	S12 V13 V15 V22 L29 I39 C41 K56 Y105	S12-F20 CarbonylContact C-O 3.54Å; S12-F20 VanDerWaalsContact CA-O 3.26Å; S12-F20 WeakPolarHBondContact CA-O 3.48Å; V13-F20 PolarHBondContact N-O 3.45Å; V13-F20 PolarHBondContact O-N 2.73Å; V15-F20 HydrophobicContact CB-CD2 3.72Å; V15-F20 HydrophobicContact CB-CE2 3.99Å; V15-F20 HydrophobicContact CB-CG 4.46Å; V15-F20 HydrophobicContact CG1-CD2 4.47Å; V15-F20 HydrophobicContact CG1-CE2 4.29Å; V15-F20 HydrophobicContact CG2-CB 4.17Å; V15-F20 HydrophobicContact CG2-CD2 3.78Å; V15-F20 HydrophobicContact CG2-CE2 4.38Å; V15-F20 HydrophobicContact CG2-CG 4.01Å; F20-V22 HydrophobicContact CB-CG1 4.2Å; F20-V22 HydrophobicContact CD1-CG1 4.14Å; F20-L29 HydrophobicContact CB-CD2 3.88Å; F20-L29 HydrophobicContact CD1-CD2 3.79Å; F20-L29 HydrophobicContact CG-CD2 4.12Å; F20-I39 HydrophobicContact CE2-CB 3.86Å; F20-I39 HydrophobicContact CE2-CD1 4.44Å; F20-I39 HydrophobicContact CE2-CG2 3.69Å; F20-I39 HydrophobicContact CZ-CB 3.74Å; F20-I39 HydrophobicContact CZ-CG2 3.65Å; F20-C41 HydrophobicContact CE1-CB 4.23Å; F20-C41 VanDerWaalsContact CE1-SG 3.6Å; F20-K56 HydrophobicContact CD1-CB 4.48Å; F20-K56 HydrophobicContact CD2-CD 4.39Å; F20-K56 HydrophobicContact CE1-CB 3.79Å; F20-K56 HydrophobicContact CE2-CB 4.18Å; F20-K56 HydrophobicContact CE2-CD 4.26Å; F20-K56 HydrophobicContact CZ-CB 3.61Å; F20-Y105 WeakPolarHBondContact CA-OH 3.49Å; F20-Y105 HydrophobicContact CD1-CD1 4.35Å; F20-Y105 AromaticContact CD1-CE1 3.71Å; F20-Y105 HydrophobicContact CD1-CE1 3.71Å; F20-Y105 HydrophobicContact CE1-CE1 4.14Å; F20-Y105 HydrophobicContact CG-CE1 4.2Å
21	T	96.5	Very high	93.5	Very high	32 Å²	32	65.9 Å²	65.9	20%	0.196	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	99.1	172.6	-56.2	0	0	0	0	108.5	F10 Y11 S12 P94 Y105	F10-T21 HydrophobicContact CB-CG2 3.99Å; Y11-T21 CarbonylContact O-C 3.58Å; Y11-T21 WeakPolarHBondContact O-CA 3.37Å; S12-T21 PolarHBondContact OG-OG1 2.96Å; T21-P94 HydrophobicContact CG2-CB 3.57Å; T21-P94 HydrophobicContact CG2-CG 4.18Å; T21-Y105 PolarHBondContact N-OH 2.95Å; T21-Y105 WeakPolarHBondContact O-CE2 3.3Å
22	V	96.5	Very high	93.2	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	160	-167.6	-59.6	0	0	0	0	111.9	F10 Y11 F20 L29 V54 F92 Y105	F10-V22 CarbonylContact C-O 3.58Å; F10-V22 VanDerWaalsContact CA-O 3.25Å; F10-V22 WeakPolarHBondContact CA-O 3.41Å; F10-V22 VanDerWaalsContact CD1-C 3.5Å; Y11-V22 HydrophobicContact CD1-CG2 4.06Å; Y11-V22 WeakPolarHBondContact CD1-O 2.83Å; Y11-V22 HydrophobicContact CE1-CG2 3.49Å; Y11-V22 VanDerWaalsContact CE1-CG2 3.49Å; Y11-V22 PolarHBondContact N-O 3.22Å; Y11-V22 PolarHBondContact O-N 3.01Å; F20-V22 HydrophobicContact CB-CG1 4.2Å; F20-V22 HydrophobicContact CD1-CG1 4.14Å; V22-L29 HydrophobicContact CG1-CD2 4.09Å; V22-L29 HydrophobicContact CG2-CD1 4.01Å; V22-L29 HydrophobicContact CG2-CD2 4.04Å; V22-V54 HydrophobicContact CG1-CG1 4.39Å; V22-F92 HydrophobicContact CB-CE2 4.31Å; V22-F92 HydrophobicContact CB-CZ 3.93Å; V22-F92 HydrophobicContact CG1-CE2 4.4Å; V22-F92 HydrophobicContact CG1-CZ 3.97Å; V22-Y105 HydrophobicContact CG1-CD1 4.04Å; V22-Y105 HydrophobicContact CG1-CE1 3.88Å
23	L	96.5	Very high	92.5	Very high	28 Å²	28	64.8 Å²	64.8	15%	0.147	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	139.2	173.6	-68.1	170.7	0	0	0	110.6	F10 R25 Y26 F92	F10-L23 HydrophobicContact CD1-CD2 4.04Å; F10-L23 HydrophobicContact CD1-CG 4.31Å; F10-L23 HydrophobicContact CD2-CD2 4.48Å; F10-L23 HydrophobicContact CE1-CD2 3.48Å; F10-L23 VanDerWaalsContact CE1-CD2 3.48Å; F10-L23 HydrophobicContact CE1-CG 3.76Å; F10-L23 HydrophobicContact CE2-CD2 3.99Å; F10-L23 HydrophobicContact CG-CD2 4.5Å; F10-L23 HydrophobicContact CZ-CD2 3.46Å; F10-L23 VanDerWaalsContact CZ-CD2 3.46Å; F10-L23 HydrophobicContact CZ-CG 4.18Å; L23-R25 HydrophobicContact CB-CG 3.98Å; L23-R25 PolarHBondContact O-N 2.99Å; L23-Y26 HydrophobicContact CB-CD2 3.91Å; L23-Y26 HydrophobicContact CB-CE2 4Å; L23-Y26 HydrophobicContact CD1-CE2 4.03Å; L23-Y26 HydrophobicContact CG-CE2 4.46Å; L23-Y26 PolarHBondContact O-N 3.18Å; L23-F92 HydrophobicContact CD1-CB 4.31Å; L23-F92 HydrophobicContact CD1-CD1 3.99Å; L23-F92 HydrophobicContact CD1-CE1 4.48Å; L23-F92 HydrophobicContact CD1-CG 4.06Å; L23-F92 HydrophobicContact CG-CD1 4.41Å; L23-F92 HydrophobicContact CG-CD2 4.31Å; L23-F92 HydrophobicContact CG-CG 4.24Å
24	K	96.1	Very high	91.8	Very high	109 Å²	109	67.7 Å²	67.7	47%	0.474	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-16.9	179.7	-76.8	179.8	178.8	175.5	0	115.6	G8 Q9 Y11 Y26	G8-K24 WeakPolarHBondContact O-CD 2.93Å; G8-K24 WeakPolarHBondContact O-CE 3Å; G8-K24 PolarHBondContact O-NZ 3.32Å; Q9-K24 WeakPolarHBondContact O-CG 3.22Å; Q9-K24 PolarHBondContact O-N 3.24Å; Y11-K24 HydrophobicContact CD1-CG 4.09Å; K24-Y26 VanDerWaalsContact C-N 3.3Å
25	R	96.6	Very high	90.7	Very high	66 Å²	66	63.6 Å²	63.6	25%	0.249	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-27.4	174	70	-175.4	-71.7	178.8	-10.5	113.2	L23 F44 D45 T46 V47	L23-R25 HydrophobicContact CB-CG 3.98Å; L23-R25 PolarHBondContact O-N 2.99Å; R25-F44 VanDerWaalsContact O-O 3.04Å; R25-D45 IonicContact CZ-OD1 3.02Å; R25-D45 IonicContact CZ-OD2 2.84Å; R25-D45 IonicContact NE-OD1 3.45Å; R25-D45 PolarHBondContact NE-OD1 2.96Å; R25-D45 IonicContact NE-OD2 3.68Å; R25-D45 PolarHBondContact NE-OD2 3.07Å; R25-D45 VanDerWaalsContact NH2-CG 3.3Å; R25-D45 IonicContact NH2-OD1 3.98Å; R25-D45 PolarHBondContact NH2-OD1 3.36Å; R25-D45 VanDerWaalsContact NH2-OD1 3.07Å; R25-D45 IonicContact NH2-OD2 2.7Å; R25-D45 PolarHBondContact NH2-OD2 3.15Å; R25-T46 WeakPolarHBondContact CA-OG1 3.35Å; R25-T46 PolarHBondContact O-N 3.32Å; R25-T46 PolarHBondContact O-OG1 3.44Å; R25-V47 HydrophobicContact CB-CG2 3.97Å
26	Y	97.6	Very high	89.8	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	106.1	178.5	-57.3	-56.3	0	0	0	108.4	Y11 L23 K24 L29 F44 D45 V52 V54 N90 F92 V107	Y11-Y26 VanDerWaalsContact CE1-O 3.29Å; Y11-Y26 WeakPolarHBondContact CE1-O 3.07Å; Y11-Y26 PolarHBondContact OH-O 2.88Å; L23-Y26 HydrophobicContact CB-CD2 3.91Å; L23-Y26 HydrophobicContact CB-CE2 4Å; L23-Y26 HydrophobicContact CD1-CE2 4.03Å; L23-Y26 HydrophobicContact CG-CE2 4.46Å; L23-Y26 PolarHBondContact O-N 3.18Å; K24-Y26 VanDerWaalsContact C-N 3.3Å; Y26-L29 WeakPolarHBondContact O-CD1 3.38Å; Y26-F44 WeakPolarHBondContact CA-O 3.29Å; Y26-D45 HydrophobicContact CD1-CB 4.07Å; Y26-D45 HydrophobicContact CE1-CB 3.96Å; Y26-D45 WeakPolarHBondContact CE1-OD2 3.14Å; Y26-V52 HydrophobicContact CD1-CG2 3.83Å; Y26-V52 HydrophobicContact CE1-CG2 4.04Å; Y26-V54 HydrophobicContact CG-CG2 4.43Å; Y26-N90 VanDerWaalsContact OH-CB 3.3Å; Y26-N90 WeakPolarHBondContact OH-CB 3.42Å; Y26-N90 PolarHBondContact OH-ND2 3.19Å; Y26-F92 AromaticContact CD2-CE1 3.92Å; Y26-F92 HydrophobicContact CD2-CE1 3.92Å; Y26-F92 HydrophobicContact CD2-CZ 4.22Å; Y26-F92 HydrophobicContact CE2-CD1 4.09Å; Y26-F92 AromaticContact CE2-CE1 3.47Å; Y26-F92 HydrophobicContact CE2-CE1 3.47Å; Y26-F92 VanDerWaalsContact CE2-CE1 3.47Å; Y26-F92 HydrophobicContact CE2-CZ 4.21Å; Y26-V107 HydrophobicContact CE1-CG1 3.8Å; Y26-V107 HydrophobicContact CE1-CG2 4.3Å; Y26-V107 HydrophobicContact CE2-CG2 3.88Å
27	Q	96.5	Very high	89.5	Confident	89 Å²	89	65.7 Å²	65.7	42%	0.416	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	167.5	-176.3	-61.9	-173.9	-3.9	0	0	110.9	L29 A43 F44 T46	Q27-L29 VanDerWaalsContact C-N 3.35Å; Q27-L29 PolarHBondContact O-N 3.19Å; Q27-A43 CarbonylContact O-C 3.52Å; Q27-A43 WeakPolarHBondContact O-CA 3.5Å; Q27-A43 WeakPolarHBondContact O-CB 3.37Å; Q27-F44 PolarHBondContact N-O 3Å; Q27-F44 PolarHBondContact O-N 3.24Å; Q27-T46 HydrophobicContact CB-CG2 4.5Å; Q27-T46 VanDerWaalsContact CD-CG2 3.44Å; Q27-T46 HydrophobicContact CG-CG2 3.89Å
28	Q	94.8	Very high	89.5	Confident	153 Å²	153	57.5 Å²	57.5	72%	0.715	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	56.6	44	173.4	-54.8	178.2	-6.8	0	0	113.5	K30	Q28-K30 PolarHBondContact O-N 2.88Å
29	L	95.9	Very high	89.5	Confident	26 Å²	26	57.6 Å²	57.6	14%	0.136	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	123.5	179.2	-89.4	71.3	0	0	0	110.9	Y11 F20 V22 Y26 Q27 C41 A42 A43	Y11-L29 WeakPolarHBondContact OH-CD1 3.27Å; F20-L29 HydrophobicContact CB-CD2 3.88Å; F20-L29 HydrophobicContact CD1-CD2 3.79Å; F20-L29 HydrophobicContact CG-CD2 4.12Å; V22-L29 HydrophobicContact CG1-CD2 4.09Å; V22-L29 HydrophobicContact CG2-CD1 4.01Å; V22-L29 HydrophobicContact CG2-CD2 4.04Å; Y26-L29 WeakPolarHBondContact O-CD1 3.38Å; Q27-L29 VanDerWaalsContact C-N 3.35Å; Q27-L29 PolarHBondContact O-N 3.19Å; L29-C41 HydrophobicContact CB-CB 4.45Å; L29-C41 HydrophobicContact CD2-CB 4.41Å; L29-C41 HydrophobicContact CG-CB 4.24Å; L29-A42 CarbonylContact C-O 3.59Å; L29-A42 VanDerWaalsContact CA-O 3.3Å; L29-A42 WeakPolarHBondContact CA-O 3.47Å; L29-A43 HydrophobicContact CD1-CB 3.87Å; L29-A43 HydrophobicContact CG-CB 4.22Å
30	K	94	Very high	89.4	Confident	140 Å²	140	56.8 Å²	56.8	61%	0.609	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128	125.1	175.2	-176.9	-178.1	177.4	-175.3	0	109.6	Q28 I32 C41 A42	Q28-K30 PolarHBondContact O-N 2.88Å; K30-I32 PolarHBondContact O-N 2.88Å; K30-C41 CarbonylContact O-C 3.5Å; K30-C41 WeakPolarHBondContact O-CA 2.84Å; K30-A42 PolarHBondContact N-O 3.36Å; K30-A42 PolarHBondContact O-N 3.03Å
31	P	92.3	Very high	89.4	Confident	77 Å²	77	56.8 Å²	56.8	50%	0.5	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	131.7	176.5	24.6	-31.4	0	0	0	110.7	V15	V15-P31 HydrophobicContact CG1-CB 3.7Å; V15-P31 HydrophobicContact CG1-CG 4.09Å
32	I	89	Confident	89.3	Confident	89 Å²	89	56 Å²	56	46%	0.456	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	-17.9	177.3	60.9	173.3	0	0	0	113.2	K30 V40 A42 A53 L110	K30-I32 PolarHBondContact O-N 2.88Å; I32-V40 HydrophobicContact CD1-CG1 3.84Å; I32-V40 HydrophobicContact CG1-CB 4.1Å; I32-V40 HydrophobicContact CG1-CG1 3.83Å; I32-V40 WeakPolarHBondContact CG1-O 3.41Å; I32-V40 PolarHBondContact N-O 3.32Å; I32-A42 HydrophobicContact CD1-CB 4.34Å; I32-A42 HydrophobicContact CG2-CB 3.73Å; I32-A53 HydrophobicContact CD1-CB 4.49Å; I32-L110 HydrophobicContact CD1-CD1 3.62Å
33	G	81.6	Confident	89.4	Confident	32 Å²	32	56.1 Å²	56.1	33%	0.33	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.4	151.8	177.9	0	0	0	0	0	112.6	V40	G33-V40 PolarHBondContact N-O 3.05Å; G33-V40 PolarHBondContact O-N 3.11Å
34	S	78.6	Confident	89.5	Confident	107 Å²	107	58 Å²	58	75%	0.748	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.9	144.9	170.4	63.6	0	0	0	0	109
35	G	71.7	Confident	89.5	Confident	50 Å²	50	52.8 Å²	52.8	52%	0.515	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	-179.8	179.6	0	0	0	0	0	112	Q37 G38	G35-Q37 PolarHBondContact O-N 2.86Å; G35-G38 PolarHBondContact N-O 2.9Å; G35-G38 PolarHBondContact O-N 3.25Å; G35-G38 VanDerWaalsContact O-N 3.13Å
36	A	70	Confident	89.5	Confident	93 Å²	93	52.5 Å²	52.5	77%	0.769	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-19.5	-176.8	0	0	0	0	0	114.2
37	Q	72.6	Confident	89.4	Confident	38 Å²	38	57.2 Å²	57.2	18%	0.178	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-14.6	-176.9	-60.9	178.2	0.5	0	0	113.7	G35 L57 S58 D169	G35-Q37 PolarHBondContact O-N 2.86Å; Q37-L57 WeakPolarHBondContact O-CA 3.37Å; Q37-S58 PolarHBondContact O-N 3.39Å; Q37-D169 PolarHBondContact NE2-OD1 3.47Å; Q37-D169 PolarHBondContact NE2-OD2 3.18Å; Q37-D169 VanDerWaalsContact OE1-CG 3.31Å; Q37-D169 PolarHBondContact OE1-OD1 2.84Å; Q37-D169 VanDerWaalsContact OE1-OD1 3.11Å; Q37-D169 PolarHBondContact OE1-OD2 3.37Å
38	G	83.6	Confident	89.3	Confident	3 Å²	3	56.8 Å²	56.8	3%	0.031	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.3	173.8	-168.2	0	0	0	0	0	114.9	G35 K56 S58	G35-G38 PolarHBondContact N-O 2.9Å; G35-G38 PolarHBondContact O-N 3.25Å; G35-G38 VanDerWaalsContact O-N 3.13Å; G38-K56 CarbonylContact C-O 3.58Å; G38-K56 WeakPolarHBondContact CA-O 3.31Å; G38-S58 VanDerWaalsContact CA-OG 3.25Å; G38-S58 WeakPolarHBondContact CA-OG 3.23Å; G38-S58 PolarHBondContact N-OG 2.85Å
39	I	89.2	Confident	89.4	Confident	28 Å²	28	51.7 Å²	51.7	14%	0.144	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	137.4	169.6	-59.8	166.9	0	0	0	107.4	V15 F20 K55 K56	V15-I39 HydrophobicContact CG1-CG2 4.41Å; F20-I39 HydrophobicContact CE2-CB 3.86Å; F20-I39 HydrophobicContact CE2-CD1 4.44Å; F20-I39 HydrophobicContact CE2-CG2 3.69Å; F20-I39 HydrophobicContact CZ-CB 3.74Å; F20-I39 HydrophobicContact CZ-CG2 3.65Å; I39-K55 CarbonylContact O-C 3.56Å; I39-K55 WeakPolarHBondContact O-CA 3.22Å; I39-K56 PolarHBondContact N-O 3.41Å; I39-K56 VanDerWaalsContact N-O 3.14Å; I39-K56 PolarHBondContact O-N 3.39Å
40	V	92.1	Very high	89.4	Confident	32 Å²	32	54.2 Å²	54.2	19%	0.194	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	129.3	-179.6	-169	0	0	0	0	109.5	I32 G33 A53 V54 K55	I32-V40 HydrophobicContact CD1-CG1 3.84Å; I32-V40 HydrophobicContact CG1-CB 4.1Å; I32-V40 HydrophobicContact CG1-CG1 3.83Å; I32-V40 WeakPolarHBondContact CG1-O 3.41Å; I32-V40 PolarHBondContact N-O 3.32Å; G33-V40 PolarHBondContact N-O 3.05Å; G33-V40 PolarHBondContact O-N 3.11Å; V40-A53 HydrophobicContact CG1-CB 4.15Å; V40-V54 WeakPolarHBondContact CA-O 3.39Å; V40-K55 HydrophobicContact CG2-CB 4.1Å; V40-K55 HydrophobicContact CG2-CD 4.5Å; V40-K55 HydrophobicContact CG2-CG 4.02Å
41	C	94.9	Very high	89.5	Confident	0 Å²	0	52 Å²	52	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	139.9	173.5	-66.5	0	0	0	0	110.7	V15 F20 L29 K30 A53 V54	V15-C41 VanDerWaalsContact CG1-SG 3.54Å; F20-C41 HydrophobicContact CE1-CB 4.23Å; F20-C41 VanDerWaalsContact CE1-SG 3.6Å; L29-C41 HydrophobicContact CB-CB 4.45Å; L29-C41 HydrophobicContact CD2-CB 4.41Å; L29-C41 HydrophobicContact CG-CB 4.24Å; K30-C41 CarbonylContact O-C 3.5Å; K30-C41 WeakPolarHBondContact O-CA 2.84Å; C41-A53 CarbonylContact O-C 3.2Å; C41-A53 WeakPolarHBondContact O-CA 3.32Å; C41-V54 PolarHBondContact N-O 3.09Å; C41-V54 PolarHBondContact O-N 2.75Å
42	A	95.9	Very high	89.8	Confident	16 Å²	16	48.3 Å²	48.3	13%	0.132	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	143.5	156.6	0	0	0	0	0	109	L29 K30 I32 V52 L110	L29-A42 CarbonylContact C-O 3.59Å; L29-A42 VanDerWaalsContact CA-O 3.3Å; L29-A42 WeakPolarHBondContact CA-O 3.47Å; K30-A42 PolarHBondContact N-O 3.36Å; K30-A42 PolarHBondContact O-N 3.03Å; I32-A42 HydrophobicContact CD1-CB 4.34Å; I32-A42 HydrophobicContact CG2-CB 3.73Å; A42-V52 CarbonylContact C-O 3.58Å; A42-V52 WeakPolarHBondContact CA-O 3.37Å; A42-L110 HydrophobicContact CB-CD1 4Å; A42-L110 HydrophobicContact CB-CD2 3.91Å
43	A	97.7	Very high	90.1	Very high	3 Å²	3	44.5 Å²	44.5	3%	0.025	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	157.5	173	0	0	0	0	0	110	Q27 L29 N51 V52 V54	Q27-A43 CarbonylContact O-C 3.52Å; Q27-A43 WeakPolarHBondContact O-CA 3.5Å; Q27-A43 WeakPolarHBondContact O-CB 3.37Å; L29-A43 HydrophobicContact CD1-CB 3.87Å; L29-A43 HydrophobicContact CG-CB 4.22Å; A43-N51 CarbonylContact O-C 3.53Å; A43-N51 WeakPolarHBondContact O-CA 3.36Å; A43-V52 HydrophobicContact CB-CG2 4.18Å; A43-V52 PolarHBondContact N-O 2.85Å; A43-V52 WeakPolarHBondContact O-CG2 3.48Å; A43-V52 PolarHBondContact O-N 3.49Å; A43-V54 HydrophobicContact CB-CG2 4Å
44	F	98	Very high	90.8	Very high	66 Å²	66	43 Å²	43	29%	0.289	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	122.5	169.6	-176.9	-106.9	0	0	0	109.5	R25 Y26 Q27 T46	R25-F44 VanDerWaalsContact O-O 3.04Å; Y26-F44 WeakPolarHBondContact CA-O 3.29Å; Q27-F44 PolarHBondContact N-O 3Å; Q27-F44 PolarHBondContact O-N 3.24Å; F44-T46 HydrophobicContact CD1-CG2 3.89Å; F44-T46 HydrophobicContact CE1-CG2 4.08Å; F44-T46 PolarHBondContact O-N 3.35Å
45	D	97.7	Very high	91.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	105.1	174.1	-174.3	-16.1	0	0	0	110	R25 Y26 V47 L48 G49 I50 V52	R25-D45 IonicContact CZ-OD1 3.02Å; R25-D45 IonicContact CZ-OD2 2.84Å; R25-D45 IonicContact NE-OD1 3.45Å; R25-D45 PolarHBondContact NE-OD1 2.96Å; R25-D45 IonicContact NE-OD2 3.68Å; R25-D45 PolarHBondContact NE-OD2 3.07Å; R25-D45 VanDerWaalsContact NH2-CG 3.3Å; R25-D45 IonicContact NH2-OD1 3.98Å; R25-D45 PolarHBondContact NH2-OD1 3.36Å; R25-D45 VanDerWaalsContact NH2-OD1 3.07Å; R25-D45 IonicContact NH2-OD2 2.7Å; R25-D45 PolarHBondContact NH2-OD2 3.15Å; Y26-D45 HydrophobicContact CD1-CB 4.07Å; Y26-D45 HydrophobicContact CE1-CB 3.96Å; Y26-D45 WeakPolarHBondContact CE1-OD2 3.14Å; D45-V47 PolarHBondContact O-N 3.01Å; D45-V47 PolarHBondContact OD1-N 3.36Å; D45-L48 HydrophobicContact CB-CB 4.3Å; D45-L48 PolarHBondContact O-N 2.77Å; D45-L48 PolarHBondContact OD1-N 2.89Å; D45-L48 WeakPolarHBondContact OD2-CD1 3.26Å; D45-L48 WeakPolarHBondContact OD2-CG 3.35Å; D45-G49 WeakPolarHBondContact O-CA 3.25Å; D45-G49 PolarHBondContact O-N 2.89Å; D45-I50 PolarHBondContact N-O 3.5Å; D45-V52 HydrophobicContact CB-CG1 3.91Å; D45-V52 HydrophobicContact CB-CG2 4.17Å
46	T	96.6	Very high	92.6	Very high	61 Å²	61	37.4 Å²	37.4	37%	0.374	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-16.5	-176.3	59	0	0	0	0	114.5	R25 Q27 F44	R25-T46 WeakPolarHBondContact CA-OG1 3.35Å; R25-T46 PolarHBondContact O-N 3.32Å; R25-T46 PolarHBondContact O-OG1 3.44Å; Q27-T46 HydrophobicContact CB-CG2 4.5Å; Q27-T46 VanDerWaalsContact CD-CG2 3.44Å; Q27-T46 HydrophobicContact CG-CG2 3.89Å; F44-T46 HydrophobicContact CD1-CG2 3.89Å; F44-T46 HydrophobicContact CE1-CG2 4.08Å; F44-T46 PolarHBondContact O-N 3.35Å
47	V	95.1	Very high	93.6	Very high	99 Å²	99	33.3 Å²	33.3	60%	0.6	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87	-38.8	178	173.4	0	0	0	0	110.9	R25 D45	R25-V47 HydrophobicContact CB-CG2 3.97Å; D45-V47 PolarHBondContact O-N 3.01Å; D45-V47 PolarHBondContact OD1-N 3.36Å
48	L	94.3	Very high	94.1	Very high	79 Å²	79	34.1 Å²	34.1	41%	0.414	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-18.7	178.2	-64.9	179.8	0	0	0	113	D45 I50	D45-L48 HydrophobicContact CB-CB 4.3Å; D45-L48 PolarHBondContact O-N 2.77Å; D45-L48 PolarHBondContact OD1-N 2.89Å; D45-L48 WeakPolarHBondContact OD2-CD1 3.26Å; D45-L48 WeakPolarHBondContact OD2-CG 3.35Å; L48-I50 VanDerWaalsContact C-N 3.27Å; L48-I50 HydrophobicContact CB-CD1 4.14Å; L48-I50 HydrophobicContact CB-CG1 3.74Å; L48-I50 HydrophobicContact CD1-CD1 4.08Å; L48-I50 HydrophobicContact CD1-CG1 4.39Å; L48-I50 PolarHBondContact O-N 2.8Å
49	G	96.2	Very high	94.2	Very high	47 Å²	47	42.9 Å²	42.9	49%	0.485	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.1	22.4	-176.8	0	0	0	0	0	113.7	D45	D45-G49 WeakPolarHBondContact O-CA 3.25Å; D45-G49 PolarHBondContact O-N 2.89Å
50	I	96.4	Very high	94.3	Very high	78 Å²	78	41.8 Å²	41.8	40%	0.4	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	158.5	-176.6	65.7	176.6	0	0	0	111.3	D45 L48 V52 L89	D45-I50 PolarHBondContact N-O 3.5Å; L48-I50 VanDerWaalsContact C-N 3.27Å; L48-I50 HydrophobicContact CB-CD1 4.14Å; L48-I50 HydrophobicContact CB-CG1 3.74Å; L48-I50 HydrophobicContact CD1-CD1 4.08Å; L48-I50 HydrophobicContact CD1-CG1 4.39Å; L48-I50 PolarHBondContact O-N 2.8Å; I50-V52 HydrophobicContact CD1-CG1 4.38Å; I50-V52 HydrophobicContact CG1-CG1 4.09Å; I50-L89 HydrophobicContact CD1-CD1 4.32Å
51	N	96.8	Very high	94.3	Very high	94 Å²	94	41.7 Å²	41.7	50%	0.503	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	141.3	168.2	-66.2	-43.3	0	0	0	110.7	A43 L110	A43-N51 CarbonylContact O-C 3.53Å; A43-N51 WeakPolarHBondContact O-CA 3.36Å; N51-L110 HydrophobicContact CB-CB 4.17Å; N51-L110 HydrophobicContact CB-CD2 3.62Å
52	V	97.5	Very high	94	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	157.4	-177.7	-62	0	0	0	0	110.8	Y26 A42 A43 D45 I50 V54 L89 V107 M108	Y26-V52 HydrophobicContact CD1-CG2 3.83Å; Y26-V52 HydrophobicContact CE1-CG2 4.04Å; A42-V52 CarbonylContact C-O 3.58Å; A42-V52 WeakPolarHBondContact CA-O 3.37Å; A43-V52 HydrophobicContact CB-CG2 4.18Å; A43-V52 PolarHBondContact N-O 2.85Å; A43-V52 WeakPolarHBondContact O-CG2 3.48Å; A43-V52 PolarHBondContact O-N 3.49Å; D45-V52 HydrophobicContact CB-CG1 3.91Å; D45-V52 HydrophobicContact CB-CG2 4.17Å; I50-V52 HydrophobicContact CD1-CG1 4.38Å; I50-V52 HydrophobicContact CG1-CG1 4.09Å; V52-V54 HydrophobicContact CG2-CG2 4.2Å; V52-L89 HydrophobicContact CG1-CD1 3.75Å; V52-V107 HydrophobicContact CB-CG1 3.8Å; V52-V107 HydrophobicContact CG1-CG1 4.22Å; V52-V107 HydrophobicContact CG2-CG1 3.84Å; V52-M108 CarbonylContact C-O 3.51Å; V52-M108 WeakPolarHBondContact CA-O 3.48Å; V52-M108 WeakPolarHBondContact CB-O 3.4Å
53	A	96.1	Very high	93.7	Very high	9 Å²	9	48.6 Å²	48.6	7%	0.074	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	124.2	169.5	0	0	0	0	0	109.6	I32 V40 C41 V107 M108 L110	I32-A53 HydrophobicContact CD1-CB 4.49Å; V40-A53 HydrophobicContact CG1-CB 4.15Å; C41-A53 CarbonylContact O-C 3.2Å; C41-A53 WeakPolarHBondContact O-CA 3.32Å; A53-V107 CarbonylContact O-C 3.55Å; A53-V107 WeakPolarHBondContact O-CA 3.41Å; A53-M108 PolarHBondContact N-O 2.93Å; A53-M108 PolarHBondContact O-N 2.85Å; A53-L110 HydrophobicContact CB-CD1 4.03Å
54	V	95.9	Very high	93.2	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	107.8	178.3	-175.7	0	0	0	0	108.9	V22 Y26 V40 C41 A43 V52 Y105 L106 V107	V22-V54 HydrophobicContact CG1-CG1 4.39Å; Y26-V54 HydrophobicContact CG-CG2 4.43Å; V40-V54 WeakPolarHBondContact CA-O 3.39Å; C41-V54 PolarHBondContact N-O 3.09Å; C41-V54 PolarHBondContact O-N 2.75Å; A43-V54 HydrophobicContact CB-CG2 4Å; V52-V54 HydrophobicContact CG2-CG2 4.2Å; V54-Y105 HydrophobicContact CG1-CD1 3.96Å; V54-L106 CarbonylContact C-O 3.1Å; V54-L106 WeakPolarHBondContact CA-O 3.03Å; V54-V107 HydrophobicContact CG2-CG1 4.45Å; V54-V107 HydrophobicContact CG2-CG2 4.33Å
55	K	93.8	Very high	92.6	Very high	17 Å²	17	54.1 Å²	54.1	7%	0.074	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	117.6	176.3	-179.5	178.4	-178	-175.1	0	109.9	I39 V40 L57 E73 Y105 L106 M108	I39-K55 CarbonylContact O-C 3.56Å; I39-K55 WeakPolarHBondContact O-CA 3.22Å; V40-K55 HydrophobicContact CG2-CB 4.1Å; V40-K55 HydrophobicContact CG2-CD 4.5Å; V40-K55 HydrophobicContact CG2-CG 4.02Å; K55-L57 HydrophobicContact CD-CD2 4.22Å; K55-L57 HydrophobicContact CG-CD2 4.29Å; K55-E73 IonicContact NZ-OE1 3.61Å; K55-E73 PolarHBondContact NZ-OE1 2.99Å; K55-E73 IonicContact NZ-OE2 3.61Å; K55-E73 PolarHBondContact NZ-OE2 2.96Å; K55-Y105 CarbonylContact O-C 3.43Å; K55-Y105 WeakPolarHBondContact O-CA 3.41Å; K55-L106 HydrophobicContact CB-CB 4.39Å; K55-L106 PolarHBondContact N-O 2.81Å; K55-L106 PolarHBondContact O-N 3.13Å; K55-M108 HydrophobicContact CB-CE 3.88Å; K55-M108 HydrophobicContact CD-CE 4.37Å
56	K	94.4	Very high	92	Very high	22 Å²	22	56.5 Å²	56.5	10%	0.096	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	119.7	167.7	-175.2	-176.6	-174.3	179	0	108.9	T19 F20 G38 I39 S58 D103 Y105	T19-K56 PolarHBondContact O-NZ 2.82Å; F20-K56 HydrophobicContact CD1-CB 4.48Å; F20-K56 HydrophobicContact CD2-CD 4.39Å; F20-K56 HydrophobicContact CE1-CB 3.79Å; F20-K56 HydrophobicContact CE2-CB 4.18Å; F20-K56 HydrophobicContact CE2-CD 4.26Å; F20-K56 HydrophobicContact CZ-CB 3.61Å; G38-K56 CarbonylContact C-O 3.58Å; G38-K56 WeakPolarHBondContact CA-O 3.31Å; I39-K56 PolarHBondContact N-O 3.41Å; I39-K56 VanDerWaalsContact N-O 3.14Å; I39-K56 PolarHBondContact O-N 3.39Å; K56-S58 PolarHBondContact O-N 2.87Å; K56-D103 VanDerWaalsContact CE-CG 3.49Å; K56-D103 WeakPolarHBondContact CE-OD1 3.48Å; K56-D103 IonicContact NZ-OD1 3.68Å; K56-D103 PolarHBondContact NZ-OD1 2.85Å; K56-D103 VanDerWaalsContact NZ-OD1 3.07Å; K56-D103 IonicContact NZ-OD2 2.88Å; K56-Y105 HydrophobicContact CB-CD1 3.93Å; K56-Y105 HydrophobicContact CB-CE1 3.64Å; K56-Y105 HydrophobicContact CD-CE1 3.89Å; K56-Y105 WeakPolarHBondContact CD-OH 3.36Å; K56-Y105 VanDerWaalsContact CE-OH 3.29Å; K56-Y105 WeakPolarHBondContact CE-OH 3.16Å; K56-Y105 HydrophobicContact CG-CD1 4.2Å; K56-Y105 HydrophobicContact CG-CE1 3.63Å
57	L	91.3	Very high	91.7	Very high	8 Å²	8	53.6 Å²	53.6	4%	0.042	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	129.9	176.7	-61.2	-170.9	0	0	0	111	Q37 K55 R59 P60 A70 V104 L106	Q37-L57 WeakPolarHBondContact O-CA 3.37Å; K55-L57 HydrophobicContact CD-CD2 4.22Å; K55-L57 HydrophobicContact CG-CD2 4.29Å; L57-R59 PolarHBondContact O-N 3.41Å; L57-P60 HydrophobicContact CB-CB 4.47Å; L57-P60 HydrophobicContact CB-CG 4.36Å; L57-A70 HydrophobicContact CD1-CB 3.86Å; L57-V104 HydrophobicContact CB-CB 4.4Å; L57-V104 HydrophobicContact CD1-CB 3.95Å; L57-V104 HydrophobicContact CD1-CG1 4.01Å; L57-V104 HydrophobicContact CG-CB 4.2Å; L57-V104 HydrophobicContact CG-CG1 4.43Å; L57-V104 PolarHBondContact N-O 2.91Å; L57-L106 HydrophobicContact CD1-CD1 4.47Å; L57-L106 HydrophobicContact CD2-CD1 3.93Å; L57-L106 HydrophobicContact CG-CD1 4.4Å
58	S	83.4	Confident	91.3	Very high	55 Å²	55	51.5 Å²	51.5	39%	0.385	27%	0.266	S	S	.	.	S	Bend	trans	-82.3	108.5	179.7	-72.9	0	0	0	0	111.1	Q37 G38 K56	Q37-S58 PolarHBondContact O-N 3.39Å; G38-S58 VanDerWaalsContact CA-OG 3.25Å; G38-S58 WeakPolarHBondContact CA-OG 3.23Å; G38-S58 PolarHBondContact N-OG 2.85Å; K56-S58 PolarHBondContact O-N 2.87Å
59	R	85.8	Confident	90.8	Very high	187 Å²	187	50.5 Å²	50.5	71%	0.706	26%	0.257	S	S	*	.			trans	46.6	56.1	173.4	-54.6	-179.1	-173.7	169.2	2	113.2	L57 F61 Q62	L57-R59 PolarHBondContact O-N 3.41Å; R59-F61 PolarHBondContact O-N 3.35Å; R59-Q62 HydrophobicContact CB-CB 4.09Å; R59-Q62 WeakPolarHBondContact O-CB 3.48Å; R59-Q62 PolarHBondContact O-N 3.11Å
60	P	90	Very high	90.5	Very high	4 Å²	4	48.6 Å²	48.6	3%	0.026	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-27.1	-175.4	23.5	-33.7	0	0	0	113.1	L57 H66 A67 A70	L57-P60 HydrophobicContact CB-CB 4.47Å; L57-P60 HydrophobicContact CB-CG 4.36Å; P60-H66 CarbonylContact O-C 3.58Å; P60-H66 WeakPolarHBondContact O-CB 3.5Å; P60-A67 WeakPolarHBondContact O-CA 3.31Å; P60-A67 WeakPolarHBondContact O-CB 3.46Å; P60-A67 PolarHBondContact O-N 2.89Å; P60-A70 HydrophobicContact CB-CB 3.64Å
61	F	92.3	Very high	90.1	Very high	31 Å²	31	45.7 Å²	45.7	14%	0.136	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	12.3	-178	-43.8	-61.1	0	0	0	114.4	R59 N63 F101 V104 I349 K353 I356	R59-F61 PolarHBondContact O-N 3.35Å; F61-N63 VanDerWaalsContact C-N 3.29Å; F61-N63 PolarHBondContact O-N 3.19Å; F61-F101 HydrophobicContact CE1-CE1 4.05Å; F61-F101 AromaticContact CE2-CD1 3.92Å; F61-F101 HydrophobicContact CE2-CD1 3.92Å; F61-F101 AromaticContact CE2-CE1 3.86Å; F61-F101 HydrophobicContact CE2-CE1 3.86Å; F61-F101 HydrophobicContact CE2-CG 4.39Å; F61-F101 HydrophobicContact CE2-CZ 4.25Å; F61-F101 AromaticContact CZ-CD1 3.7Å; F61-F101 HydrophobicContact CZ-CD1 3.7Å; F61-F101 AromaticContact CZ-CE1 3.21Å; F61-F101 HydrophobicContact CZ-CE1 3.21Å; F61-F101 HydrophobicContact CZ-CE2 4.47Å; F61-F101 AromaticContact CZ-CZ 3.68Å; F61-F101 HydrophobicContact CZ-CZ 3.68Å; F61-V104 HydrophobicContact CZ-CG2 4.48Å; F61-I349 HydrophobicContact CB-CG2 4.07Å; F61-I349 VanDerWaalsContact O-CG2 3.27Å; F61-I349 WeakPolarHBondContact O-CG2 3.19Å; F61-K353 HydrophobicContact CD1-CB 3.8Å; F61-K353 HydrophobicContact CD1-CG 3.98Å; F61-K353 HydrophobicContact CD2-CD 4.45Å; F61-K353 HydrophobicContact CD2-CG 4.33Å; F61-K353 HydrophobicContact CE1-CB 3.96Å; F61-K353 HydrophobicContact CE1-CG 3.93Å; F61-K353 HydrophobicContact CE2-CG 4.28Å; F61-K353 HydrophobicContact CG-CB 4.36Å; F61-K353 HydrophobicContact CG-CD 4.42Å; F61-K353 HydrophobicContact CG-CG 4.2Å; F61-K353 HydrophobicContact CZ-CG 4.12Å; F61-I356 HydrophobicContact CD1-CD1 4.38Å; F61-I356 HydrophobicContact CE1-CB 4.24Å; F61-I356 HydrophobicContact CE1-CD1 3.59Å; F61-I356 HydrophobicContact CE1-CG1 4.46Å; F61-I356 HydrophobicContact CE1-CG2 4.46Å; F61-I356 HydrophobicContact CZ-CD1 4.43Å; F61-I356 HydrophobicContact CZ-CG2 4.38Å
62	Q	88.8	Confident	89.6	Confident	113 Å²	113	42.2 Å²	42.2	53%	0.528	20%	0.2	S	C	.	.	S	Bend	trans	-62.3	-35.5	-176.7	179.7	176	-3.2	0	0	113.1	R59	R59-Q62 HydrophobicContact CB-CB 4.09Å; R59-Q62 WeakPolarHBondContact O-CB 3.48Å; R59-Q62 PolarHBondContact O-N 3.11Å
63	N	88.9	Confident	89.1	Confident	47 Å²	47	42.5 Å²	42.5	25%	0.251	20%	0.202	S	C	.	.	S	Bend	trans	-156.8	170.3	174.2	60.5	49.5	0	0	0	109.9	F61 T65 H66 A67	F61-N63 VanDerWaalsContact C-N 3.29Å; F61-N63 PolarHBondContact O-N 3.19Å; N63-T65 VanDerWaalsContact C-N 3.25Å; N63-T65 PolarHBondContact O-N 3.49Å; N63-T65 WeakPolarHBondContact OD1-CB 3.06Å; N63-T65 PolarHBondContact OD1-N 3.35Å; N63-T65 VanDerWaalsContact OD1-N 3.11Å; N63-H66 PolarHBondContact ND2-CE1 2.91Å; N63-H66 PolarHBondContact ND2-ND1 3.5Å; N63-H66 VanDerWaalsContact ND2-ND1 3.11Å; N63-H66 PolarHBondContact O-N 2.9Å; N63-H66 PolarHBondContact OD1-N 3.33Å; N63-H66 PolarHBondContact OD1-ND1 3.34Å; N63-A67 PolarHBondContact O-N 3.36Å
64	Q	88.7	Confident	88.8	Confident	100 Å²	100	42.3 Å²	42.3	47%	0.467	20%	0.199	S	C	.	.	H	α-helix	trans	-57.9	-36	-178.2	-65.5	178.6	9.1	0	0	112.9	A67 K68 I349	Q64-A67 PolarHBondContact O-N 2.84Å; Q64-K68 VanDerWaalsContact O-CB 3.23Å; Q64-K68 WeakPolarHBondContact O-CB 3.48Å; Q64-K68 PolarHBondContact O-N 3.27Å; Q64-I349 HydrophobicContact CG-CG1 3.8Å
65	T	84.1	Confident	88.3	Confident	86 Å²	86	43.1 Å²	43.1	53%	0.528	20%	0.204	S	C	.	.	H	α-helix	trans	-65.8	-43.4	178.9	-54.8	0	0	0	0	112	N63 R69	N63-T65 VanDerWaalsContact C-N 3.25Å; N63-T65 PolarHBondContact O-N 3.49Å; N63-T65 WeakPolarHBondContact OD1-CB 3.06Å; N63-T65 PolarHBondContact OD1-N 3.35Å; N63-T65 VanDerWaalsContact OD1-N 3.11Å; T65-R69 VanDerWaalsContact O-CB 3.31Å; T65-R69 WeakPolarHBondContact O-CB 3.26Å; T65-R69 PolarHBondContact O-N 3.08Å; T65-R69 VanDerWaalsContact O-N 3.08Å
66	H	85.9	Confident	87.9	Confident	49 Å²	49	42.8 Å²	42.8	23%	0.227	20%	0.203	C	C	.	.	H	α-helix	trans	-66.1	-42	175.1	-67.9	134.2	0	0	0	111.3	P60 N63 R69 A70	P60-H66 CarbonylContact O-C 3.58Å; P60-H66 WeakPolarHBondContact O-CB 3.5Å; N63-H66 PolarHBondContact ND2-CE1 2.91Å; N63-H66 PolarHBondContact ND2-ND1 3.5Å; N63-H66 VanDerWaalsContact ND2-ND1 3.11Å; N63-H66 PolarHBondContact O-N 2.9Å; N63-H66 PolarHBondContact OD1-N 3.33Å; N63-H66 PolarHBondContact OD1-ND1 3.34Å; H66-R69 PolarHBondContact O-N 2.88Å; H66-A70 WeakPolarHBondContact O-CB 3.31Å; H66-A70 PolarHBondContact O-N 3.11Å
67	A	89.6	Confident	87.7	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-67.8	-46.8	-176.8	0	0	0	0	0	111	P60 N63 Q64 R69 A70 Y71 W352 I356	P60-A67 WeakPolarHBondContact O-CA 3.31Å; P60-A67 WeakPolarHBondContact O-CB 3.46Å; P60-A67 PolarHBondContact O-N 2.89Å; N63-A67 PolarHBondContact O-N 3.36Å; Q64-A67 PolarHBondContact O-N 2.84Å; A67-R69 VanDerWaalsContact C-N 3.3Å; A67-R69 PolarHBondContact O-N 3.39Å; A67-A70 PolarHBondContact O-N 3.35Å; A67-Y71 PolarHBondContact O-N 3.23Å; A67-W352 HydrophobicContact CB-CB 3.55Å; A67-W352 HydrophobicContact CB-CG 3.8Å; A67-I356 WeakPolarHBondContact O-CD1 3.35Å
68	K	86.9	Confident	87.5	Confident	55 Å²	55	44 Å²	44	24%	0.239	21%	0.208	C	C	.	.	H	α-helix	trans	-59.2	-39.9	173.7	-172.7	166.2	-173.3	159.2	0	112.2	Q64 R72 E343 R345 W352	Q64-K68 VanDerWaalsContact O-CB 3.23Å; Q64-K68 WeakPolarHBondContact O-CB 3.48Å; Q64-K68 PolarHBondContact O-N 3.27Å; K68-R72 WeakPolarHBondContact O-CB 3.43Å; K68-R72 PolarHBondContact O-N 2.93Å; K68-E343 WeakPolarHBondContact CE-O 3.21Å; K68-E343 PolarHBondContact NZ-O 3.3Å; K68-R345 PolarHBondContact NZ-O 2.9Å; K68-W352 HydrophobicContact CB-CD2 4.5Å; K68-W352 HydrophobicContact CB-CH2 4.44Å; K68-W352 HydrophobicContact CB-CZ2 3.86Å; K68-W352 HydrophobicContact CD-CH2 4.44Å; K68-W352 HydrophobicContact CD-CZ2 3.82Å; K68-W352 HydrophobicContact CG-CH2 4.01Å; K68-W352 HydrophobicContact CG-CZ2 3.68Å
69	R	84.7	Confident	87.5	Confident	59 Å²	59	43.1 Å²	43.1	22%	0.223	20%	0.202	C	C	.	.	H	α-helix	trans	-63.5	-47.7	175.7	177.7	176.8	-61.4	153.2	4.3	111.8	T65 H66 A67 R72 E73 G171	T65-R69 VanDerWaalsContact O-CB 3.31Å; T65-R69 WeakPolarHBondContact O-CB 3.26Å; T65-R69 PolarHBondContact O-N 3.08Å; T65-R69 VanDerWaalsContact O-N 3.08Å; H66-R69 PolarHBondContact O-N 2.88Å; A67-R69 VanDerWaalsContact C-N 3.3Å; A67-R69 PolarHBondContact O-N 3.39Å; R69-R72 PolarHBondContact O-N 3.02Å; R69-E73 WeakPolarHBondContact O-CB 3.2Å; R69-E73 PolarHBondContact O-N 2.93Å; R69-G171 WeakPolarHBondContact CG-O 3.4Å
70	A	88.5	Confident	87.5	Confident	7 Å²	7	34.5 Å²	34.5	6%	0.058	17%	0.17	C	C	.	.	H	α-helix	trans	-63.5	-44.9	-179.4	0	0	0	0	0	111.8	L57 P60 H66 A67 E73 L74 I356	L57-A70 HydrophobicContact CD1-CB 3.86Å; P60-A70 HydrophobicContact CB-CB 3.64Å; H66-A70 WeakPolarHBondContact O-CB 3.31Å; H66-A70 PolarHBondContact O-N 3.11Å; A67-A70 PolarHBondContact O-N 3.35Å; A70-E73 PolarHBondContact O-N 3.28Å; A70-L74 WeakPolarHBondContact O-CB 3.4Å; A70-L74 PolarHBondContact O-N 2.95Å; A70-I356 HydrophobicContact CB-CD1 3.97Å
71	Y	89.5	Confident	87.4	Confident	17 Å²	17	38.8 Å²	38.8	7%	0.067	19%	0.193	C	C	.	.	H	α-helix	trans	-60	-48.1	175.7	-177.7	-97.3	0	0	0	111.3	A67 E73 L74 V75 L342 W352 L355 I356 E359	A67-Y71 PolarHBondContact O-N 3.23Å; Y71-E73 PolarHBondContact O-N 3.19Å; Y71-L74 PolarHBondContact O-N 3.31Å; Y71-V75 HydrophobicContact CD1-CG2 4.04Å; Y71-V75 HydrophobicContact CD2-CG2 4.45Å; Y71-V75 HydrophobicContact CE1-CG2 3.49Å; Y71-V75 VanDerWaalsContact CE1-CG2 3.49Å; Y71-V75 HydrophobicContact CE2-CG2 3.98Å; Y71-V75 HydrophobicContact CG-CG2 4.49Å; Y71-V75 VanDerWaalsContact CZ-CG2 3.48Å; Y71-V75 WeakPolarHBondContact O-CG2 3.25Å; Y71-V75 PolarHBondContact O-N 2.91Å; Y71-L342 HydrophobicContact CD1-CD2 4.11Å; Y71-L342 HydrophobicContact CE1-CD1 4.16Å; Y71-L342 HydrophobicContact CE1-CD2 3.29Å; Y71-L342 HydrophobicContact CE1-CG 4.33Å; Y71-W352 HydrophobicContact CD1-CE3 4.19Å; Y71-W352 HydrophobicContact CD1-CH2 4.46Å; Y71-W352 AromaticContact CD1-CZ3 3.52Å; Y71-W352 HydrophobicContact CD1-CZ3 3.52Å; Y71-W352 HydrophobicContact CE1-CZ3 4.18Å; Y71-W352 AromaticContact CG-CE3 3.91Å; Y71-W352 HydrophobicContact CG-CE3 3.91Å; Y71-W352 AromaticContact CG-CZ3 3.73Å; Y71-W352 HydrophobicContact CG-CZ3 3.73Å; Y71-L355 HydrophobicContact CD2-CB 3.89Å; Y71-L355 HydrophobicContact CE2-CB 3.68Å; Y71-I356 HydrophobicContact CD2-CG1 3.7Å; Y71-I356 HydrophobicContact CG-CG1 4.16Å; Y71-E359 HydrophobicContact CE2-CG 3.7Å
72	R	85.8	Confident	87.4	Confident	21 Å²	21	37.8 Å²	37.8	8%	0.079	19%	0.188	C	C	.	.	H	α-helix	trans	-59	-48.2	178.2	-175.1	-159.9	-178.4	89.3	23	111.9	K68 R69 L74 V75 L76 F170 A173 R174 E343	K68-R72 WeakPolarHBondContact O-CB 3.43Å; K68-R72 PolarHBondContact O-N 2.93Å; R69-R72 PolarHBondContact O-N 3.02Å; R72-L74 VanDerWaalsContact C-N 3.28Å; R72-L74 PolarHBondContact O-N 3.45Å; R72-V75 PolarHBondContact O-N 3.14Å; R72-L76 HydrophobicContact CG-CD1 3.82Å; R72-L76 HydrophobicContact CG-CG 4.23Å; R72-L76 WeakPolarHBondContact O-CB 2.97Å; R72-L76 VanDerWaalsContact O-CG 3.25Å; R72-L76 WeakPolarHBondContact O-CG 3.29Å; R72-L76 PolarHBondContact O-N 2.95Å; R72-F170 PolarHBondContact NE-O 3.17Å; R72-A173 PolarHBondContact NE-O 3.3Å; R72-A173 PolarHBondContact NH1-O 3.49Å; R72-A173 PolarHBondContact NH2-O 3.49Å; R72-A173 VanDerWaalsContact NH2-O 3.11Å; R72-R174 VanDerWaalsContact NH2-N 3.12Å; R72-E343 IonicContact CZ-OE1 3.73Å; R72-E343 IonicContact CZ-OE2 3.32Å; R72-E343 IonicContact NH1-OE1 3.07Å; R72-E343 PolarHBondContact NH1-OE1 2.96Å; R72-E343 IonicContact NH1-OE2 2.94Å; R72-E343 PolarHBondContact NH1-OE2 3.32Å; R72-E343 IonicContact NH2-OE1 2.77Å; R72-E343 PolarHBondContact NH2-OE1 3.48Å
73	E	86.8	Confident	87.7	Confident	6 Å²	6	36 Å²	36	3%	0.028	18%	0.179	C	C	.	.	H	α-helix	trans	-57.3	-45.5	178.7	-175.7	174.4	-177.9	0	0	110.6	K55 R69 A70 Y71 L77 L106	K55-E73 IonicContact NZ-OE1 3.61Å; K55-E73 PolarHBondContact NZ-OE1 2.99Å; K55-E73 IonicContact NZ-OE2 3.61Å; K55-E73 PolarHBondContact NZ-OE2 2.96Å; R69-E73 WeakPolarHBondContact O-CB 3.2Å; R69-E73 PolarHBondContact O-N 2.93Å; A70-E73 PolarHBondContact O-N 3.28Å; Y71-E73 PolarHBondContact O-N 3.19Å; E73-L77 HydrophobicContact CG-CD1 3.83Å; E73-L77 HydrophobicContact CG-CG 4.45Å; E73-L77 VanDerWaalsContact O-CB 3.25Å; E73-L77 WeakPolarHBondContact O-CB 3.46Å; E73-L77 WeakPolarHBondContact O-CG 3.46Å; E73-L77 PolarHBondContact O-N 3.02Å; E73-L106 HydrophobicContact CG-CD1 4.35Å
74	L	89.2	Confident	88.1	Confident	4 Å²	4	34 Å²	34	2%	0.021	17%	0.168	C	C	.	.	H	α-helix	trans	-61.8	-49.8	177.9	179.2	57.5	0	0	0	112.8	A70 Y71 R72 L76 L77 K78 L88 V91 L106 I356 E359 V360	A70-L74 WeakPolarHBondContact O-CB 3.4Å; A70-L74 PolarHBondContact O-N 2.95Å; Y71-L74 PolarHBondContact O-N 3.31Å; R72-L74 VanDerWaalsContact C-N 3.28Å; R72-L74 PolarHBondContact O-N 3.45Å; L74-L76 PolarHBondContact O-N 2.95Å; L74-L77 PolarHBondContact O-N 3.33Å; L74-K78 WeakPolarHBondContact O-CB 3.4Å; L74-K78 PolarHBondContact O-N 3.03Å; L74-L88 HydrophobicContact CD1-CD2 4.17Å; L74-V91 HydrophobicContact CD1-CB 4.2Å; L74-V91 HydrophobicContact CD1-CG1 4.1Å; L74-V91 HydrophobicContact CD1-CG2 3.93Å; L74-L106 HydrophobicContact CD1-CD2 3.97Å; L74-I356 HydrophobicContact CD2-CG2 4.31Å; L74-E359 HydrophobicContact CD2-CB 3.55Å; L74-E359 HydrophobicContact CD2-CG 4.49Å; L74-E359 HydrophobicContact CG-CB 4.28Å; L74-V360 HydrophobicContact CD2-CG2 4.01Å
75	V	86.7	Confident	88.4	Confident	18 Å²	18	29.2 Å²	29.2	11%	0.109	15%	0.145	C	C	.	.	H	α-helix	trans	-62.8	-44.8	-179.7	171.2	0	0	0	0	111.1	Y71 R72 K78 C79	Y71-V75 HydrophobicContact CD1-CG2 4.04Å; Y71-V75 HydrophobicContact CD2-CG2 4.45Å; Y71-V75 HydrophobicContact CE1-CG2 3.49Å; Y71-V75 VanDerWaalsContact CE1-CG2 3.49Å; Y71-V75 HydrophobicContact CE2-CG2 3.98Å; Y71-V75 HydrophobicContact CG-CG2 4.49Å; Y71-V75 VanDerWaalsContact CZ-CG2 3.48Å; Y71-V75 WeakPolarHBondContact O-CG2 3.25Å; Y71-V75 PolarHBondContact O-N 2.91Å; R72-V75 PolarHBondContact O-N 3.14Å; V75-K78 PolarHBondContact O-N 2.71Å; V75-C79 PolarHBondContact O-N 3.01Å; V75-C79 PolarHBondContact O-SG 3.39Å; V75-C79 VanDerWaalsContact O-SG 3.36Å
76	L	85.7	Confident	88.9	Confident	9 Å²	9	25.3 Å²	25.3	5%	0.047	12%	0.122	C	C	.	.	H	α-helix	trans	-65.1	-43.5	179.7	-68.7	-176.5	0	0	0	111.7	R72 L74 K78 C79 V80 I147 F170 A173 I337	R72-L76 HydrophobicContact CG-CD1 3.82Å; R72-L76 HydrophobicContact CG-CG 4.23Å; R72-L76 WeakPolarHBondContact O-CB 2.97Å; R72-L76 VanDerWaalsContact O-CG 3.25Å; R72-L76 WeakPolarHBondContact O-CG 3.29Å; R72-L76 PolarHBondContact O-N 2.95Å; L74-L76 PolarHBondContact O-N 2.95Å; L76-K78 PolarHBondContact O-N 3.23Å; L76-C79 PolarHBondContact O-N 3.33Å; L76-V80 VanDerWaalsContact O-CB 3.31Å; L76-V80 WeakPolarHBondContact O-CB 3.47Å; L76-V80 WeakPolarHBondContact O-CG2 3.44Å; L76-V80 PolarHBondContact O-N 2.84Å; L76-I147 HydrophobicContact CD1-CD1 4.42Å; L76-I147 HydrophobicContact CD1-CG2 4.38Å; L76-I147 HydrophobicContact CD2-CD1 3.5Å; L76-I147 VanDerWaalsContact CD2-CD1 3.5Å; L76-I147 HydrophobicContact CD2-CG1 4.01Å; L76-I147 HydrophobicContact CG-CD1 4.48Å; L76-F170 HydrophobicContact CB-CB 4.13Å; L76-F170 HydrophobicContact CB-CD2 4.26Å; L76-F170 HydrophobicContact CB-CG 4.35Å; L76-F170 HydrophobicContact CD1-CB 3.5Å; L76-F170 VanDerWaalsContact CD1-CB 3.5Å; L76-F170 HydrophobicContact CD1-CG 4.29Å; L76-F170 HydrophobicContact CG-CB 4.46Å; L76-A173 HydrophobicContact CD1-CB 4.22Å; L76-I337 HydrophobicContact CD2-CD1 4.24Å
77	L	88.7	Confident	89.2	Confident	7 Å²	7	24.4 Å²	24.4	4%	0.037	12%	0.121	C	C	.	.	H	α-helix	trans	-63.3	-28.5	176.4	-78.8	174.1	0	0	0	113.5	E73 L74 I86 L88 L106 F170	E73-L77 HydrophobicContact CG-CD1 3.83Å; E73-L77 HydrophobicContact CG-CG 4.45Å; E73-L77 VanDerWaalsContact O-CB 3.25Å; E73-L77 WeakPolarHBondContact O-CB 3.46Å; E73-L77 WeakPolarHBondContact O-CG 3.46Å; E73-L77 PolarHBondContact O-N 3.02Å; L74-L77 PolarHBondContact O-N 3.33Å; L77-I86 HydrophobicContact CD2-CG2 3.67Å; L77-L88 HydrophobicContact CB-CB 4.13Å; L77-L88 HydrophobicContact CB-CD2 4.34Å; L77-L88 HydrophobicContact CD1-CD1 4.48Å; L77-L106 HydrophobicContact CD1-CD1 3.9Å; L77-F170 HydrophobicContact CD2-CD2 4.18Å; L77-F170 HydrophobicContact CD2-CE2 3.95Å; L77-F170 HydrophobicContact CG-CD2 4.38Å
78	K	86.6	Confident	89.4	Confident	50 Å²	50	25.2 Å²	25.2	22%	0.217	13%	0.125	C	C	.	.	H	α-helix	trans	-77.9	-36.5	175.9	174.6	170.3	177.5	-177.8	0	112.6	L74 V75 L76 E359 W363	L74-K78 WeakPolarHBondContact O-CB 3.4Å; L74-K78 PolarHBondContact O-N 3.03Å; V75-K78 PolarHBondContact O-N 2.71Å; L76-K78 PolarHBondContact O-N 3.23Å; K78-E359 IonicContact NZ-OE2 2.86Å; K78-E359 PolarHBondContact NZ-OE2 3.19Å; K78-W363 HydrophobicContact CB-CZ3 4.28Å; K78-W363 HydrophobicContact CD-CE3 4.13Å; K78-W363 HydrophobicContact CD-CZ3 4.39Å; K78-W363 HydrophobicContact CG-CE3 4.2Å; K78-W363 HydrophobicContact CG-CZ3 3.94Å
79	C	83.7	Confident	89.7	Confident	36 Å²	36	25.4 Å²	25.4	24%	0.243	13%	0.128	C	C	.	.	H	α-helix	trans	-85.5	-39.2	-175.8	-68.7	0	0	0	0	112.7	V75 L76 N81 P335	V75-C79 PolarHBondContact O-N 3.01Å; V75-C79 PolarHBondContact O-SG 3.39Å; V75-C79 VanDerWaalsContact O-SG 3.36Å; L76-C79 PolarHBondContact O-N 3.33Å; C79-N81 PolarHBondContact O-N 3.44Å; C79-P335 HydrophobicContact CB-CB 4.3Å; C79-P335 WeakPolarHBondContact O-CB 3.5Å
80	V	85.8	Confident	90.2	Very high	6 Å²	6	23.2 Å²	23.2	4%	0.036	12%	0.121	C	C	.	.			trans	-79.6	123.6	-170.2	-179.3	0	0	0	0	110.9	L76 I85 L142 I147 P335	L76-V80 VanDerWaalsContact O-CB 3.31Å; L76-V80 WeakPolarHBondContact O-CB 3.47Å; L76-V80 WeakPolarHBondContact O-CG2 3.44Å; L76-V80 PolarHBondContact O-N 2.84Å; V80-I85 HydrophobicContact CB-CG2 4.32Å; V80-I85 HydrophobicContact CG1-CB 4.05Å; V80-I85 HydrophobicContact CG1-CD1 3.36Å; V80-I85 HydrophobicContact CG1-CG1 4.28Å; V80-I85 HydrophobicContact CG1-CG2 3.52Å; V80-L142 HydrophobicContact CG1-CD2 4.39Å; V80-L142 HydrophobicContact CG2-CD2 4.33Å; V80-I147 HydrophobicContact CG2-CD1 3.95Å; V80-P335 HydrophobicContact CG2-CG 4.04Å
81	N	88.2	Confident	90.5	Very high	94 Å²	94	22.9 Å²	22.9	50%	0.503	12%	0.118	S	C	.	.			trans	-131.1	95.9	178.6	-178.5	32.1	0	0	0	110.5	C79 H141 P375	C79-N81 PolarHBondContact O-N 3.44Å; N81-H141 PolarHBondContact O-CE1 3.08Å; N81-H141 PolarHBondContact O-NE2 3.39Å; N81-P375 WeakPolarHBondContact ND2-CG 3.36Å
82	H	93.6	Very high	90.8	Very high	9 Å²	9	22.1 Å²	22.1	4%	0.042	12%	0.115	C	C	.	.			trans	-149.9	142.1	178.3	-175.1	-101.5	0	0	0	110.3	N84 I85 H141 E329	H82-N84 PolarHBondContact CE1-OD1 3.39Å; H82-N84 VanDerWaalsContact CE1-OD1 3.28Å; H82-N84 PolarHBondContact ND1-N 3.2Å; H82-N84 PolarHBondContact O-N 2.68Å; H82-N84 VanDerWaalsContact O-N 3.13Å; H82-I85 HydrophobicContact CB-CB 4.22Å; H82-I85 HydrophobicContact CB-CD1 3.99Å; H82-I85 HydrophobicContact CB-CG1 4.24Å; H82-I85 PolarHBondContact O-N 3.28Å; H82-H141 HydrophobicContact CB-CB 4.25Å; H82-H141 AromaticContact CD2-CG 3.87Å; H82-H141 AromaticContact CD2-ND1 3.74Å; H82-H141 AromaticContact CG-CG 3.77Å; H82-E329 PolarHBondContact NE2-O 3.37Å; H82-E329 VanDerWaalsContact NE2-O 3.1Å
83	K	95.1	Very high	91.3	Very high	77 Å²	77	21.3 Å²	21.3	34%	0.335	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-26.7	-176.3	66.1	170.5	-167.4	151.1	0	113.9	K166 E329	K83-K166 WeakPolarHBondContact O-CE 3.39Å; K83-K166 VanDerWaalsContact O-CG 3.23Å; K83-K166 WeakPolarHBondContact O-CG 3.37Å; K83-K166 PolarHBondContact O-NZ 3.36Å; K83-E329 HydrophobicContact CD-CG 4.42Å; K83-E329 WeakPolarHBondContact CE-OE1 3.5Å; K83-E329 VanDerWaalsContact CE-OE2 3.27Å; K83-E329 WeakPolarHBondContact CE-OE2 3.39Å; K83-E329 IonicContact NZ-OE1 3.33Å; K83-E329 PolarHBondContact NZ-OE1 3.12Å; K83-E329 IonicContact NZ-OE2 2.92Å; K83-E329 PolarHBondContact NZ-OE2 3.22Å
84	N	96.9	Very high	91.7	Very high	3 Å²	3	22.1 Å²	22.1	2%	0.016	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	14.5	176.6	-55.1	117.4	0	0	0	114.2	H82 Q134 L165 K166 I167	H82-N84 PolarHBondContact CE1-OD1 3.39Å; H82-N84 VanDerWaalsContact CE1-OD1 3.28Å; H82-N84 PolarHBondContact ND1-N 3.2Å; H82-N84 PolarHBondContact O-N 2.68Å; H82-N84 VanDerWaalsContact O-N 3.13Å; N84-Q134 VanDerWaalsContact CB-O 3.27Å; N84-Q134 WeakPolarHBondContact CB-O 3.36Å; N84-Q134 WeakPolarHBondContact ND2-CB 3.23Å; N84-Q134 WeakPolarHBondContact ND2-CG 3.44Å; N84-Q134 PolarHBondContact ND2-OE1 2.9Å; N84-Q134 VanDerWaalsContact ND2-OE1 3.14Å; N84-L165 VanDerWaalsContact CA-O 3.29Å; N84-L165 WeakPolarHBondContact CA-O 3.29Å; N84-L165 PolarHBondContact ND2-O 3.09Å; N84-K166 WeakPolarHBondContact O-CA 3.4Å; N84-I167 PolarHBondContact O-N 3.35Å
85	I	94.6	Very high	91.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.125	C	C	.	.	B	Isolated β-bridge	trans	-123.1	142.2	172.3	-67.3	171.3	0	0	0	107.4	V80 H82 S87 H141 L142 K166 F170	V80-I85 HydrophobicContact CB-CG2 4.32Å; V80-I85 HydrophobicContact CG1-CB 4.05Å; V80-I85 HydrophobicContact CG1-CD1 3.36Å; V80-I85 HydrophobicContact CG1-CG1 4.28Å; V80-I85 HydrophobicContact CG1-CG2 3.52Å; H82-I85 HydrophobicContact CB-CB 4.22Å; H82-I85 HydrophobicContact CB-CD1 3.99Å; H82-I85 HydrophobicContact CB-CG1 4.24Å; H82-I85 PolarHBondContact O-N 3.28Å; I85-S87 PolarHBondContact O-N 3.25Å; I85-H141 HydrophobicContact CD1-CB 4.26Å; I85-L142 HydrophobicContact CD1-CD1 4.42Å; I85-L142 HydrophobicContact CD1-CD2 3.72Å; I85-L142 HydrophobicContact CD1-CG 3.7Å; I85-K166 PolarHBondContact O-NZ 3.01Å; I85-K166 VanDerWaalsContact O-NZ 3.14Å; I85-F170 HydrophobicContact CG2-CE1 4.49Å; I85-F170 HydrophobicContact CG2-CE2 3.84Å; I85-F170 HydrophobicContact CG2-CZ 3.42Å; I85-F170 VanDerWaalsContact CG2-CZ 3.42Å
86	I	94.2	Very high	92	Very high	5 Å²	5	27.5 Å²	27.5	3%	0.026	14%	0.141	C	C	.	.	P	Polyproline II helix	trans	-64.7	130.4	178.3	-165.5	74.2	0	0	0	110.9	L77 M108 E109 M111 K166 I167 L168 F170	L77-I86 HydrophobicContact CD2-CG2 3.67Å; I86-M108 HydrophobicContact CD1-CB 4.27Å; I86-M108 HydrophobicContact CG1-CB 3.87Å; I86-M108 HydrophobicContact CG1-CG 4.08Å; I86-M108 HydrophobicContact CG1-SD 3.87Å; I86-M108 HydrophobicContact CG2-SD 4.33Å; I86-E109 HydrophobicContact CD1-CG 3.38Å; I86-E109 HydrophobicContact CG1-CG 4.44Å; I86-M111 HydrophobicContact CD1-CG 4.44Å; I86-K166 HydrophobicContact CD1-CD 4.37Å; I86-I167 WeakPolarHBondContact CG2-O 3.32Å; I86-I167 PolarHBondContact N-O 2.94Å; I86-L168 HydrophobicContact CB-CD2 3.65Å; I86-L168 HydrophobicContact CD1-CD2 3.88Å; I86-L168 HydrophobicContact CG1-CD2 3.68Å; I86-L168 HydrophobicContact CG2-CD2 3.8Å; I86-F170 HydrophobicContact CG2-CE2 4.39Å
87	S	92.1	Very high	92.4	Very high	30 Å²	30	29.5 Å²	29.5	21%	0.21	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-92.9	138.6	179.3	-61.4	0	0	0	0	111.7	I85 M108 E109	I85-S87 PolarHBondContact O-N 3.25Å; S87-M108 WeakPolarHBondContact O-CA 3.46Å; S87-E109 PolarHBondContact N-OE1 3.46Å
88	L	93.1	Very high	92.6	Very high	16 Å²	16	31.2 Å²	31.2	8%	0.084	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	119	169.1	-169.6	67.2	0	0	0	109.7	L74 L77 N90 V91 L106 W363	L74-L88 HydrophobicContact CD1-CD2 4.17Å; L77-L88 HydrophobicContact CB-CB 4.13Å; L77-L88 HydrophobicContact CB-CD2 4.34Å; L77-L88 HydrophobicContact CD1-CD1 4.48Å; L88-N90 WeakPolarHBondContact CD1-O 3.19Å; L88-V91 HydrophobicContact CD2-CB 4.36Å; L88-V91 HydrophobicContact CD2-CG1 4.28Å; L88-L106 HydrophobicContact CD1-CB 4.11Å; L88-L106 HydrophobicContact CD1-CD2 4.17Å; L88-W363 HydrophobicContact CB-CH2 4.37Å; L88-W363 HydrophobicContact CD2-CE3 4.26Å; L88-W363 HydrophobicContact CD2-CH2 4.02Å; L88-W363 HydrophobicContact CD2-CZ2 4.34Å; L88-W363 HydrophobicContact CD2-CZ3 3.98Å; L88-W363 HydrophobicContact CG-CH2 4.22Å; L88-W363 HydrophobicContact CG-CZ2 4.33Å
89	L	93.5	Very high	92.9	Very high	59 Å²	59	35.7 Å²	35.7	31%	0.309	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	-36.5	176	-59.8	-178.9	0	0	0	111.8	I50 V52 V107 E109	I50-L89 HydrophobicContact CD1-CD1 4.32Å; V52-L89 HydrophobicContact CG1-CD1 3.75Å; L89-V107 HydrophobicContact CB-CG1 4.4Å; L89-V107 PolarHBondContact N-O 3.05Å; L89-E109 HydrophobicContact CD1-CB 4.47Å
90	N	95.1	Very high	93.4	Very high	13 Å²	13	39.2 Å²	39.2	7%	0.07	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	156.5	177	-162.1	18	0	0	0	111.2	Y26 L88 V107 W363	Y26-N90 VanDerWaalsContact OH-CB 3.3Å; Y26-N90 WeakPolarHBondContact OH-CB 3.42Å; Y26-N90 PolarHBondContact OH-ND2 3.19Å; L88-N90 WeakPolarHBondContact CD1-O 3.19Å; N90-V107 HydrophobicContact CB-CB 3.84Å; N90-V107 HydrophobicContact CB-CG2 4Å; N90-V107 PolarHBondContact N-O 3.4Å; N90-V107 VanDerWaalsContact N-O 3.17Å; N90-V107 WeakPolarHBondContact O-CB 3.48Å; N90-V107 PolarHBondContact O-N 3.29Å; N90-W363 PolarHBondContact OD1-NE1 3.05Å; N90-W363 VanDerWaalsContact OD1-NE1 3.16Å
91	V	95.6	Very high	93.8	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	140.8	165.9	54.9	0	0	0	0	108.6	L74 L88 V104 Y105 L106 V360 W363	L74-V91 HydrophobicContact CD1-CB 4.2Å; L74-V91 HydrophobicContact CD1-CG1 4.1Å; L74-V91 HydrophobicContact CD1-CG2 3.93Å; L88-V91 HydrophobicContact CD2-CB 4.36Å; L88-V91 HydrophobicContact CD2-CG1 4.28Å; V91-V104 HydrophobicContact CG2-CG1 4.06Å; V91-Y105 VanDerWaalsContact CA-O 3.29Å; V91-Y105 WeakPolarHBondContact CA-O 3.29Å; V91-Y105 WeakPolarHBondContact CG2-O 3.44Å; V91-L106 HydrophobicContact CB-CD2 4.16Å; V91-L106 HydrophobicContact CG2-CD2 3.75Å; V91-V360 HydrophobicContact CG2-CB 4.47Å; V91-V360 HydrophobicContact CG2-CG1 4.21Å; V91-V360 HydrophobicContact CG2-CG2 3.84Å; V91-W363 HydrophobicContact CG1-CB 3.46Å; V91-W363 VanDerWaalsContact CG1-CB 3.46Å; V91-W363 VanDerWaalsContact CG1-CD1 3.46Å; V91-W363 HydrophobicContact CG1-CD2 3.74Å; V91-W363 HydrophobicContact CG1-CE3 4.43Å; V91-W363 HydrophobicContact CG1-CG 3.25Å
92	F	95.8	Very high	94	Very high	1 Å²	1	40.4 Å²	40.4	0%	0.004	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	165.3	179.9	65.3	-92.8	0	0	0	112.2	F10 V22 L23 Y26 Y105 V107 E364	F10-F92 AromaticContact CE1-CD2 3.67Å; F10-F92 HydrophobicContact CE1-CD2 3.67Å; F10-F92 HydrophobicContact CE1-CE2 4.01Å; F10-F92 HydrophobicContact CZ-CD2 4.46Å; V22-F92 HydrophobicContact CB-CE2 4.31Å; V22-F92 HydrophobicContact CB-CZ 3.93Å; V22-F92 HydrophobicContact CG1-CE2 4.4Å; V22-F92 HydrophobicContact CG1-CZ 3.97Å; L23-F92 HydrophobicContact CD1-CB 4.31Å; L23-F92 HydrophobicContact CD1-CD1 3.99Å; L23-F92 HydrophobicContact CD1-CE1 4.48Å; L23-F92 HydrophobicContact CD1-CG 4.06Å; L23-F92 HydrophobicContact CG-CD1 4.41Å; L23-F92 HydrophobicContact CG-CD2 4.31Å; L23-F92 HydrophobicContact CG-CG 4.24Å; Y26-F92 AromaticContact CD2-CE1 3.92Å; Y26-F92 HydrophobicContact CD2-CE1 3.92Å; Y26-F92 HydrophobicContact CD2-CZ 4.22Å; Y26-F92 HydrophobicContact CE2-CD1 4.09Å; Y26-F92 AromaticContact CE2-CE1 3.47Å; Y26-F92 HydrophobicContact CE2-CE1 3.47Å; Y26-F92 VanDerWaalsContact CE2-CE1 3.47Å; Y26-F92 HydrophobicContact CE2-CZ 4.21Å; F92-Y105 AromaticContact CD2-CD2 3.99Å; F92-Y105 HydrophobicContact CD2-CD2 3.99Å; F92-Y105 HydrophobicContact CD2-CG 4.18Å; F92-Y105 HydrophobicContact CE1-CG 4.38Å; F92-Y105 VanDerWaalsContact CE2-CB 3.49Å; F92-Y105 HydrophobicContact CE2-CD1 4.25Å; F92-Y105 AromaticContact CE2-CD2 3.52Å; F92-Y105 HydrophobicContact CE2-CD2 3.52Å; F92-Y105 HydrophobicContact CE2-CE2 4.31Å; F92-Y105 AromaticContact CE2-CG 3.48Å; F92-Y105 HydrophobicContact CE2-CG 3.48Å; F92-Y105 VanDerWaalsContact CE2-CG 3.48Å; F92-Y105 HydrophobicContact CZ-CD1 4.1Å; F92-Y105 HydrophobicContact CZ-CD2 4.15Å; F92-Y105 AromaticContact CZ-CG 3.61Å; F92-Y105 HydrophobicContact CZ-CG 3.61Å; F92-Y105 PolarHBondContact N-O 3.31Å; F92-Y105 VanDerWaalsContact N-O 3.08Å; F92-Y105 PolarHBondContact O-N 3.39Å; F92-V107 HydrophobicContact CD1-CG2 4.13Å; F92-V107 HydrophobicContact CE1-CG2 3.65Å; F92-E364 WeakPolarHBondContact CA-OE1 3.41Å; F92-E364 WeakPolarHBondContact CB-OE1 3.48Å
93	T	96.1	Very high	94	Very high	4 Å²	4	41.5 Å²	41.5	3%	0.025	21%	0.205	C	C	.	.			trans	-132.2	141.3	167.6	-179.9	0	0	0	0	110	F10 Q95 F101 D103 Y357 V360 M361 E364	F10-T93 WeakPolarHBondContact CZ-O 3.29Å; T93-Q95 PolarHBondContact O-N 2.95Å; T93-Q95 PolarHBondContact OG1-N 3.02Å; T93-Q95 PolarHBondContact OG1-OE1 3Å; T93-F101 HydrophobicContact CG2-CD2 4.04Å; T93-F101 HydrophobicContact CG2-CE2 3.99Å; T93-F101 WeakPolarHBondContact OG1-CD2 3.41Å; T93-D103 WeakPolarHBondContact CB-O 3.18Å; T93-D103 PolarHBondContact OG1-O 2.96Å; T93-Y357 HydrophobicContact CG2-CE2 4.37Å; T93-V360 HydrophobicContact CG2-CG1 3.97Å; T93-M361 HydrophobicContact CG2-CE 3.47Å; T93-M361 VanDerWaalsContact CG2-CE 3.47Å; T93-E364 PolarHBondContact N-OE1 3.45Å
94	P	94.6	Very high	94	Very high	23 Å²	23	37.9 Å²	37.9	15%	0.149	19%	0.189	C	C	.	.	S	Bend	trans	-75.7	-14.4	175	31.3	-35.3	0	0	0	112.9	F10 T21 D103 Y105	F10-P94 HydrophobicContact CD1-CB 3.91Å; F10-P94 HydrophobicContact CE1-CB 4.07Å; F10-P94 HydrophobicContact CG-CB 4.28Å; T21-P94 HydrophobicContact CG2-CB 3.57Å; T21-P94 HydrophobicContact CG2-CG 4.18Å; P94-D103 HydrophobicContact CG-CB 4.41Å; P94-Y105 HydrophobicContact CG-CE2 4.03Å
95	Q	94.3	Very high	94	Very high	37 Å²	37	37.7 Å²	37.7	17%	0.173	19%	0.189	C	C	.	.			trans	-87.3	141.8	-177.6	-65.3	99.4	16.1	0	0	112	T93 E100 D103	T93-Q95 PolarHBondContact O-N 2.95Å; T93-Q95 PolarHBondContact OG1-N 3.02Å; T93-Q95 PolarHBondContact OG1-OE1 3Å; Q95-E100 HydrophobicContact CB-CB 4.01Å; Q95-E100 HydrophobicContact CG-CB 4.19Å; Q95-E100 WeakPolarHBondContact CG-O 3.45Å; Q95-D103 PolarHBondContact NE2-OD2 2.91Å
96	K	88.7	Confident	94	Very high	99 Å²	99	37.7 Å²	37.7	43%	0.43	19%	0.189	S	C	.	.			trans	-93.9	-24.9	-169.6	-60.1	176.3	-152	174.7	0	114.1	S6 Y357	S6-K96 WeakPolarHBondContact OG-CE 3.38Å; S6-K96 PolarHBondContact OG-NZ 3.31Å; K96-Y357 PolarHBondContact O-OH 3.24Å
97	T	93.7	Very high	94.1	Very high	51 Å²	51	37.5 Å²	37.5	31%	0.313	19%	0.187	S	C	.	.	S	Bend	trans	-122.9	157.4	-176.5	83	0	0	0	0	110.2	E99 E100 F101	T97-E99 WeakPolarHBondContact CB-OE2 3.42Å; T97-E99 PolarHBondContact O-N 3.08Å; T97-E99 PolarHBondContact OG1-N 3.16Å; T97-E99 PolarHBondContact OG1-OE2 2.79Å; T97-E100 PolarHBondContact O-N 3.24Å; T97-E100 PolarHBondContact OG1-N 3.28Å; T97-F101 PolarHBondContact O-N 3.38Å
98	L	93.8	Very high	94.2	Very high	43 Å²	43	36.8 Å²	36.8	23%	0.225	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-35.6	176.4	176.6	65.8	0	0	0	111.4	E100 F101 K353 E354 Y357	L98-E100 VanDerWaalsContact C-N 3.34Å; L98-E100 PolarHBondContact O-N 2.94Å; L98-F101 WeakPolarHBondContact O-CB 3.4Å; L98-F101 PolarHBondContact O-N 3.45Å; L98-K353 HydrophobicContact CD1-CG 4.12Å; L98-K353 WeakPolarHBondContact O-CE 3.49Å; L98-K353 PolarHBondContact O-NZ 2.82Å; L98-E354 HydrophobicContact CD1-CG 4.06Å; L98-E354 HydrophobicContact CD2-CG 3.49Å; L98-E354 VanDerWaalsContact CD2-CG 3.49Å; L98-E354 HydrophobicContact CG-CG 4.38Å; L98-Y357 HydrophobicContact CB-CD1 4.22Å; L98-Y357 HydrophobicContact CB-CE1 4.27Å; L98-Y357 HydrophobicContact CD1-CD1 4.05Å; L98-Y357 HydrophobicContact CD1-CG 3.92Å
99	E	93.2	Very high	94.2	Very high	144 Å²	144	37.7 Å²	37.7	67%	0.673	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-43.4	-179.7	-59.2	73.5	-157.2	0	0	110.9	T97 K353	T97-E99 WeakPolarHBondContact CB-OE2 3.42Å; T97-E99 PolarHBondContact O-N 3.08Å; T97-E99 PolarHBondContact OG1-N 3.16Å; T97-E99 PolarHBondContact OG1-OE2 2.79Å; E99-K353 PolarHBondContact O-NZ 2.74Å
100	E	93.2	Very high	94.3	Very high	110 Å²	110	36.7 Å²	36.7	51%	0.514	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-19.9	179.6	-66.4	178.9	169.7	0	0	113.6	Q95 T97 L98 Q102	Q95-E100 HydrophobicContact CB-CB 4.01Å; Q95-E100 HydrophobicContact CG-CB 4.19Å; Q95-E100 WeakPolarHBondContact CG-O 3.45Å; T97-E100 PolarHBondContact O-N 3.24Å; T97-E100 PolarHBondContact OG1-N 3.28Å; L98-E100 VanDerWaalsContact C-N 3.34Å; L98-E100 PolarHBondContact O-N 2.94Å; E100-Q102 WeakPolarHBondContact O-CG 3.4Å; E100-Q102 PolarHBondContact O-N 2.99Å
101	F	94.8	Very high	94.2	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.181	C	C	.	.			trans	-56.7	118.7	-172.2	178.8	-133.6	0	0	0	112.7	F61 T93 T97 L98 V104 K353 I356 Y357 V360	F61-F101 HydrophobicContact CE1-CE1 4.05Å; F61-F101 AromaticContact CE2-CD1 3.92Å; F61-F101 HydrophobicContact CE2-CD1 3.92Å; F61-F101 AromaticContact CE2-CE1 3.86Å; F61-F101 HydrophobicContact CE2-CE1 3.86Å; F61-F101 HydrophobicContact CE2-CG 4.39Å; F61-F101 HydrophobicContact CE2-CZ 4.25Å; F61-F101 AromaticContact CZ-CD1 3.7Å; F61-F101 HydrophobicContact CZ-CD1 3.7Å; F61-F101 AromaticContact CZ-CE1 3.21Å; F61-F101 HydrophobicContact CZ-CE1 3.21Å; F61-F101 HydrophobicContact CZ-CE2 4.47Å; F61-F101 AromaticContact CZ-CZ 3.68Å; F61-F101 HydrophobicContact CZ-CZ 3.68Å; T93-F101 HydrophobicContact CG2-CD2 4.04Å; T93-F101 HydrophobicContact CG2-CE2 3.99Å; T93-F101 WeakPolarHBondContact OG1-CD2 3.41Å; T97-F101 PolarHBondContact O-N 3.38Å; L98-F101 WeakPolarHBondContact O-CB 3.4Å; L98-F101 PolarHBondContact O-N 3.45Å; F101-V104 HydrophobicContact CE2-CG2 3.62Å; F101-V104 HydrophobicContact CZ-CG2 3.4Å; F101-V104 VanDerWaalsContact CZ-CG2 3.4Å; F101-K353 HydrophobicContact CD1-CG 3.76Å; F101-K353 HydrophobicContact CE1-CG 4.35Å; F101-K353 WeakPolarHBondContact O-CE 3.4Å; F101-K353 PolarHBondContact O-NZ 3.05Å; F101-I356 HydrophobicContact CE1-CB 4.24Å; F101-I356 HydrophobicContact CE1-CG2 4.01Å; F101-I356 HydrophobicContact CZ-CG2 3.81Å; F101-Y357 HydrophobicContact CB-CD2 3.9Å; F101-Y357 HydrophobicContact CB-CE2 4.28Å; F101-Y357 AromaticContact CD1-CD2 3.68Å; F101-Y357 HydrophobicContact CD1-CD2 3.68Å; F101-Y357 HydrophobicContact CD1-CG 4.06Å; F101-Y357 AromaticContact CD2-CD2 3.86Å; F101-Y357 HydrophobicContact CD2-CD2 3.86Å; F101-Y357 HydrophobicContact CD2-CE2 4.44Å; F101-Y357 HydrophobicContact CE1-CD2 4.04Å; F101-Y357 HydrophobicContact CE1-CG 4.32Å; F101-Y357 HydrophobicContact CE2-CD2 4.24Å; F101-Y357 AromaticContact CG-CD2 3.55Å; F101-Y357 HydrophobicContact CG-CD2 3.55Å; F101-Y357 HydrophobicContact CG-CE2 4.29Å; F101-Y357 HydrophobicContact CG-CG 4.37Å; F101-Y357 HydrophobicContact CZ-CD2 4.3Å; F101-V360 HydrophobicContact CZ-CG2 4.43Å
102	Q	92.9	Very high	94	Very high	125 Å²	125	41.8 Å²	41.8	58%	0.584	21%	0.206	S	C	*	.			trans	-141.1	-34.1	-179.5	-72	-172.8	15.2	0	0	112.9	E100	E100-Q102 WeakPolarHBondContact O-CG 3.4Å; E100-Q102 PolarHBondContact O-N 2.99Å
103	D	93.8	Very high	93.7	Very high	31 Å²	31	42.8 Å²	42.8	17%	0.166	22%	0.215	C	C	.	.			trans	-108.5	133.3	-174.6	-60.9	-60.4	0	0	0	111.2	K56 T93 P94 Q95 Y105	K56-D103 VanDerWaalsContact CE-CG 3.49Å; K56-D103 WeakPolarHBondContact CE-OD1 3.48Å; K56-D103 IonicContact NZ-OD1 3.68Å; K56-D103 PolarHBondContact NZ-OD1 2.85Å; K56-D103 VanDerWaalsContact NZ-OD1 3.07Å; K56-D103 IonicContact NZ-OD2 2.88Å; T93-D103 WeakPolarHBondContact CB-O 3.18Å; T93-D103 PolarHBondContact OG1-O 2.96Å; P94-D103 HydrophobicContact CG-CB 4.41Å; Q95-D103 PolarHBondContact NE2-OD2 2.91Å; D103-Y105 HydrophobicContact CB-CD2 4.4Å; D103-Y105 HydrophobicContact CB-CE2 3.71Å
104	V	95.1	Very high	93.5	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.006	23%	0.227	C	C	.	.			trans	-120.3	128.6	171.8	-179.2	0	0	0	0	108.2	L57 F61 V91 F101 L106 I356 V360	L57-V104 HydrophobicContact CB-CB 4.4Å; L57-V104 HydrophobicContact CD1-CB 3.95Å; L57-V104 HydrophobicContact CD1-CG1 4.01Å; L57-V104 HydrophobicContact CG-CB 4.2Å; L57-V104 HydrophobicContact CG-CG1 4.43Å; L57-V104 PolarHBondContact N-O 2.91Å; F61-V104 HydrophobicContact CZ-CG2 4.48Å; V91-V104 HydrophobicContact CG2-CG1 4.06Å; F101-V104 HydrophobicContact CE2-CG2 3.62Å; F101-V104 HydrophobicContact CZ-CG2 3.4Å; F101-V104 VanDerWaalsContact CZ-CG2 3.4Å; V104-L106 HydrophobicContact CG1-CD2 4.16Å; V104-I356 HydrophobicContact CG2-CG2 4Å; V104-V360 HydrophobicContact CG1-CG2 4.25Å
105	Y	95.7	Very high	93.5	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	123.5	176.4	-67.3	-93.7	0	0	0	109.8	T19 F20 T21 V22 V54 K55 K56 V91 F92 P94 D103	T19-Y105 PolarHBondContact O-OH 3.05Å; F20-Y105 WeakPolarHBondContact CA-OH 3.49Å; F20-Y105 HydrophobicContact CD1-CD1 4.35Å; F20-Y105 AromaticContact CD1-CE1 3.71Å; F20-Y105 HydrophobicContact CD1-CE1 3.71Å; F20-Y105 HydrophobicContact CE1-CE1 4.14Å; F20-Y105 HydrophobicContact CG-CE1 4.2Å; T21-Y105 PolarHBondContact N-OH 2.95Å; T21-Y105 WeakPolarHBondContact O-CE2 3.3Å; V22-Y105 HydrophobicContact CG1-CD1 4.04Å; V22-Y105 HydrophobicContact CG1-CE1 3.88Å; V54-Y105 HydrophobicContact CG1-CD1 3.96Å; K55-Y105 CarbonylContact O-C 3.43Å; K55-Y105 WeakPolarHBondContact O-CA 3.41Å; K56-Y105 HydrophobicContact CB-CD1 3.93Å; K56-Y105 HydrophobicContact CB-CE1 3.64Å; K56-Y105 HydrophobicContact CD-CE1 3.89Å; K56-Y105 WeakPolarHBondContact CD-OH 3.36Å; K56-Y105 VanDerWaalsContact CE-OH 3.29Å; K56-Y105 WeakPolarHBondContact CE-OH 3.16Å; K56-Y105 HydrophobicContact CG-CD1 4.2Å; K56-Y105 HydrophobicContact CG-CE1 3.63Å; V91-Y105 VanDerWaalsContact CA-O 3.29Å; V91-Y105 WeakPolarHBondContact CA-O 3.29Å; V91-Y105 WeakPolarHBondContact CG2-O 3.44Å; F92-Y105 AromaticContact CD2-CD2 3.99Å; F92-Y105 HydrophobicContact CD2-CD2 3.99Å; F92-Y105 HydrophobicContact CD2-CG 4.18Å; F92-Y105 HydrophobicContact CE1-CG 4.38Å; F92-Y105 VanDerWaalsContact CE2-CB 3.49Å; F92-Y105 HydrophobicContact CE2-CD1 4.25Å; F92-Y105 AromaticContact CE2-CD2 3.52Å; F92-Y105 HydrophobicContact CE2-CD2 3.52Å; F92-Y105 HydrophobicContact CE2-CE2 4.31Å; F92-Y105 AromaticContact CE2-CG 3.48Å; F92-Y105 HydrophobicContact CE2-CG 3.48Å; F92-Y105 VanDerWaalsContact CE2-CG 3.48Å; F92-Y105 HydrophobicContact CZ-CD1 4.1Å; F92-Y105 HydrophobicContact CZ-CD2 4.15Å; F92-Y105 AromaticContact CZ-CG 3.61Å; F92-Y105 HydrophobicContact CZ-CG 3.61Å; F92-Y105 PolarHBondContact N-O 3.31Å; F92-Y105 VanDerWaalsContact N-O 3.08Å; F92-Y105 PolarHBondContact O-N 3.39Å; P94-Y105 HydrophobicContact CG-CE2 4.03Å; D103-Y105 HydrophobicContact CB-CD2 4.4Å; D103-Y105 HydrophobicContact CB-CE2 3.71Å
106	L	94.8	Very high	93.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	127	174	-53.9	176.7	0	0	0	108.6	V54 K55 L57 E73 L74 L77 L88 V91 V104	V54-L106 CarbonylContact C-O 3.1Å; V54-L106 WeakPolarHBondContact CA-O 3.03Å; K55-L106 HydrophobicContact CB-CB 4.39Å; K55-L106 PolarHBondContact N-O 2.81Å; K55-L106 PolarHBondContact O-N 3.13Å; L57-L106 HydrophobicContact CD1-CD1 4.47Å; L57-L106 HydrophobicContact CD2-CD1 3.93Å; L57-L106 HydrophobicContact CG-CD1 4.4Å; E73-L106 HydrophobicContact CG-CD1 4.35Å; L74-L106 HydrophobicContact CD1-CD2 3.97Å; L77-L106 HydrophobicContact CD1-CD1 3.9Å; L88-L106 HydrophobicContact CD1-CB 4.11Å; L88-L106 HydrophobicContact CD1-CD2 4.17Å; V91-L106 HydrophobicContact CB-CD2 4.16Å; V91-L106 HydrophobicContact CG2-CD2 3.75Å; V104-L106 HydrophobicContact CG1-CD2 4.16Å
107	V	96.1	Very high	93.3	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	123.3	178.1	-172.9	0	0	0	0	108.4	Y26 V52 A53 V54 L89 N90 F92	Y26-V107 HydrophobicContact CE1-CG1 3.8Å; Y26-V107 HydrophobicContact CE1-CG2 4.3Å; Y26-V107 HydrophobicContact CE2-CG2 3.88Å; V52-V107 HydrophobicContact CB-CG1 3.8Å; V52-V107 HydrophobicContact CG1-CG1 4.22Å; V52-V107 HydrophobicContact CG2-CG1 3.84Å; A53-V107 CarbonylContact O-C 3.55Å; A53-V107 WeakPolarHBondContact O-CA 3.41Å; V54-V107 HydrophobicContact CG2-CG1 4.45Å; V54-V107 HydrophobicContact CG2-CG2 4.33Å; L89-V107 HydrophobicContact CB-CG1 4.4Å; L89-V107 PolarHBondContact N-O 3.05Å; N90-V107 HydrophobicContact CB-CB 3.84Å; N90-V107 HydrophobicContact CB-CG2 4Å; N90-V107 PolarHBondContact N-O 3.4Å; N90-V107 VanDerWaalsContact N-O 3.17Å; N90-V107 WeakPolarHBondContact O-CB 3.48Å; N90-V107 PolarHBondContact O-N 3.29Å; F92-V107 HydrophobicContact CD1-CG2 4.13Å; F92-V107 HydrophobicContact CE1-CG2 3.65Å
108	M	94.9	Very high	93.1	Very high	15 Å²	15	43.4 Å²	43.4	7%	0.074	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	168	-176.7	-62.3	167.6	-67.1	0	0	109.2	V52 A53 K55 I86 S87	V52-M108 CarbonylContact C-O 3.51Å; V52-M108 WeakPolarHBondContact CA-O 3.48Å; V52-M108 WeakPolarHBondContact CB-O 3.4Å; A53-M108 PolarHBondContact N-O 2.93Å; A53-M108 PolarHBondContact O-N 2.85Å; K55-M108 HydrophobicContact CB-CE 3.88Å; K55-M108 HydrophobicContact CD-CE 4.37Å; I86-M108 HydrophobicContact CD1-CB 4.27Å; I86-M108 HydrophobicContact CG1-CB 3.87Å; I86-M108 HydrophobicContact CG1-CG 4.08Å; I86-M108 HydrophobicContact CG1-SD 3.87Å; I86-M108 HydrophobicContact CG2-SD 4.33Å; S87-M108 WeakPolarHBondContact O-CA 3.46Å
109	E	93.2	Very high	92.9	Very high	35 Å²	35	41.4 Å²	41.4	16%	0.164	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	142.1	167.9	62.8	-165.4	123.9	0	0	111.4	I86 S87 L89 M111 K166	I86-E109 HydrophobicContact CD1-CG 3.38Å; I86-E109 HydrophobicContact CG1-CG 4.44Å; S87-E109 PolarHBondContact N-OE1 3.46Å; L89-E109 HydrophobicContact CD1-CB 4.47Å; E109-M111 HydrophobicContact CG-SD 4.35Å; E109-K166 HydrophobicContact CG-CD 4.28Å; E109-K166 WeakPolarHBondContact OE1-CD 3.32Å; E109-K166 WeakPolarHBondContact OE1-CE 3.14Å; E109-K166 IonicContact OE1-NZ 3.18Å; E109-K166 PolarHBondContact OE1-NZ 2.85Å; E109-K166 WeakPolarHBondContact OE2-CD 3.47Å; E109-K166 WeakPolarHBondContact OE2-CE 3.48Å; E109-K166 IonicContact OE2-NZ 3.78Å; E109-K166 PolarHBondContact OE2-NZ 3.36Å
110	L	94.5	Very high	92.4	Very high	38 Å²	38	40.8 Å²	40.8	20%	0.199	21%	0.207	C	C	.	.			trans	-82.3	135.2	172.9	-172.3	65.4	0	0	0	109.9	I32 A42 N51 A53	I32-L110 HydrophobicContact CD1-CD1 3.62Å; A42-L110 HydrophobicContact CB-CD1 4Å; A42-L110 HydrophobicContact CB-CD2 3.91Å; N51-L110 HydrophobicContact CB-CB 4.17Å; N51-L110 HydrophobicContact CB-CD2 3.62Å; A53-L110 HydrophobicContact CB-CD1 4.03Å
111	M	94.3	Very high	92.2	Very high	21 Å²	21	40 Å²	40	10%	0.103	21%	0.205	C	C	.	.			trans	-114.9	157.9	175.1	-58.9	-67.6	-75	0	0	109.2	I86 E109 V158 K160 K166	I86-M111 HydrophobicContact CD1-CG 4.44Å; E109-M111 HydrophobicContact CG-SD 4.35Å; M111-V158 HydrophobicContact CB-CB 3.7Å; M111-V158 HydrophobicContact CB-CG1 4.43Å; M111-V158 HydrophobicContact CB-CG2 3.96Å; M111-V158 HydrophobicContact CE-CG2 4.28Å; M111-V158 HydrophobicContact CG-CB 3.91Å; M111-V158 HydrophobicContact CG-CG2 3.56Å; M111-K160 HydrophobicContact CE-CD 4.41Å; M111-K160 HydrophobicContact CE-CG 3.81Å; M111-K160 HydrophobicContact SD-CD 4.1Å; M111-K160 HydrophobicContact SD-CG 3.82Å; M111-K166 HydrophobicContact CE-CB 4.23Å; M111-K166 HydrophobicContact CE-CD 4.02Å; M111-K166 HydrophobicContact CE-CG 4.26Å; M111-K166 HydrophobicContact SD-CD 3.97Å
112	D	90.9	Very high	91.8	Very high	99 Å²	99	48.6 Å²	48.6	53%	0.529	25%	0.245	S	C	.	.	S	Bend	trans	-79.4	-38.2	-170.1	-63	-27.3	0	0	0	112	V159 K160 S161	D112-V159 PolarHBondContact N-O 3.19Å; D112-K160 WeakPolarHBondContact OD2-CA 3.33Å; D112-S161 WeakPolarHBondContact OD2-CB 3.4Å; D112-S161 PolarHBondContact OD2-N 3.38Å; D112-S161 PolarHBondContact OD2-OG 2.79Å
113	A	90.2	Very high	91.7	Very high	23 Å²	23	43.4 Å²	43.4	19%	0.19	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	163	-173.6	0	0	0	0	0	111.7	Q117 V158 V159	A113-Q117 VanDerWaalsContact CA-OE1 3.27Å; A113-Q117 HydrophobicContact CB-CB 4.42Å; A113-V158 CarbonylContact O-C 3.58Å; A113-V158 VanDerWaalsContact O-CA 3.27Å; A113-V158 WeakPolarHBondContact O-CA 3.42Å; A113-V158 WeakPolarHBondContact O-CB 3.42Å; A113-V159 HydrophobicContact CB-CG2 4.01Å; A113-V159 PolarHBondContact N-O 3.5Å; A113-V159 VanDerWaalsContact N-O 3.12Å; A113-V159 PolarHBondContact O-N 2.89Å
114	N	91.5	Very high	91.6	Very high	53 Å²	53	45 Å²	45	28%	0.283	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	165.2	160.9	65.3	48.2	0	0	0	110.6	C116 Q117 I157 V158	N114-C116 PolarHBondContact O-N 2.93Å; N114-C116 VanDerWaalsContact O-N 3.17Å; N114-C116 WeakPolarHBondContact OD1-CB 3.33Å; N114-C116 PolarHBondContact OD1-N 2.89Å; N114-C116 VanDerWaalsContact OD1-N 3.1Å; N114-Q117 PolarHBondContact O-N 3.2Å; N114-Q117 VanDerWaalsContact O-N 3.13Å; N114-I157 CarbonylContact C-O 3.6Å; N114-I157 VanDerWaalsContact CA-O 3.28Å; N114-I157 WeakPolarHBondContact CA-O 3.26Å; N114-V158 HydrophobicContact CB-CG1 4.23Å
115	L	93	Very high	91.6	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-66.8	-18.5	-174.7	-158	69.1	0	0	0	113	Q117 V118 I119 L131 M135 P154 I157 V159 I214 M218	L115-Q117 PolarHBondContact O-N 2.94Å; L115-V118 HydrophobicContact CD1-CB 4.05Å; L115-V118 HydrophobicContact CD1-CG1 4.23Å; L115-V118 HydrophobicContact CD1-CG2 4.3Å; L115-V118 PolarHBondContact O-N 3.19Å; L115-I119 HydrophobicContact CG-CD1 4.45Å; L115-I119 HydrophobicContact CG-CG1 4.47Å; L115-I119 WeakPolarHBondContact O-CB 3.29Å; L115-I119 VanDerWaalsContact O-CG1 3.28Å; L115-I119 WeakPolarHBondContact O-CG1 3.46Å; L115-I119 PolarHBondContact O-N 2.9Å; L115-L131 HydrophobicContact CD1-CD1 4.26Å; L115-M135 HydrophobicContact CD2-CE 4.49Å; L115-M135 HydrophobicContact CD2-SD 4.23Å; L115-P154 HydrophobicContact CB-CB 3.99Å; L115-P154 WeakPolarHBondContact CB-O 3.17Å; L115-P154 PolarHBondContact N-O 2.86Å; L115-I157 HydrophobicContact CB-CB 4.05Å; L115-I157 HydrophobicContact CB-CG2 4.15Å; L115-I157 HydrophobicContact CD1-CG2 4.42Å; L115-I157 HydrophobicContact CD2-CB 4.11Å; L115-I157 HydrophobicContact CD2-CD1 3.91Å; L115-I157 HydrophobicContact CD2-CG2 3.95Å; L115-I157 HydrophobicContact CG-CG2 4.44Å; L115-I157 PolarHBondContact N-O 3.01Å; L115-V159 HydrophobicContact CD1-CG1 4.04Å; L115-I214 HydrophobicContact CD2-CG2 3.47Å; L115-I214 VanDerWaalsContact CD2-CG2 3.47Å; L115-M218 HydrophobicContact CD1-CE 3.62Å; L115-M218 HydrophobicContact CD2-CE 3.6Å; L115-M218 HydrophobicContact CG-CE 3.77Å
116	C	90.4	Very high	91.6	Very high	48 Å²	48	51.3 Å²	51.3	32%	0.324	26%	0.259	S	S	.	.	H	α-helix	trans	-59.3	-37.9	173.5	-52.8	0	0	0	0	111.3	N114 H120 P154 S155	N114-C116 PolarHBondContact O-N 2.93Å; N114-C116 VanDerWaalsContact O-N 3.17Å; N114-C116 WeakPolarHBondContact OD1-CB 3.33Å; N114-C116 PolarHBondContact OD1-N 2.89Å; N114-C116 VanDerWaalsContact OD1-N 3.1Å; C116-H120 PolarHBondContact O-CD2 2.88Å; C116-P154 HydrophobicContact CB-CB 4.49Å; C116-S155 PolarHBondContact SG-N 3.08Å
117	Q	88.7	Confident	91.6	Very high	113 Å²	113	56.9 Å²	56.9	53%	0.528	28%	0.28	S	S	.	.	H	α-helix	trans	-72.2	-37.8	178.9	-65.8	170.4	-52.6	0	0	111.2	A113 N114 L115 H120	A113-Q117 VanDerWaalsContact CA-OE1 3.27Å; A113-Q117 HydrophobicContact CB-CB 4.42Å; N114-Q117 PolarHBondContact O-N 3.2Å; N114-Q117 VanDerWaalsContact O-N 3.13Å; L115-Q117 PolarHBondContact O-N 2.94Å; Q117-H120 PolarHBondContact O-N 2.85Å
118	V	90.1	Very high	91.6	Very high	13 Å²	13	57 Å²	57	8%	0.079	28%	0.281	C	S	.	.	H	α-helix	trans	-69.1	-36.9	-179.7	-175.9	0	0	0	0	111.9	L115 H120 M121 L123 L131 V159	L115-V118 HydrophobicContact CD1-CB 4.05Å; L115-V118 HydrophobicContact CD1-CG1 4.23Å; L115-V118 HydrophobicContact CD1-CG2 4.3Å; L115-V118 PolarHBondContact O-N 3.19Å; V118-H120 PolarHBondContact O-N 2.91Å; V118-H120 VanDerWaalsContact O-N 3.16Å; V118-M121 WeakPolarHBondContact O-CB 3.24Å; V118-M121 PolarHBondContact O-N 3.34Å; V118-L123 HydrophobicContact CG1-CD1 4Å; V118-L123 HydrophobicContact CG1-CD2 3.96Å; V118-L123 HydrophobicContact CG1-CG 4.48Å; V118-L131 HydrophobicContact CG1-CD1 3.98Å; V118-V159 HydrophobicContact CG2-CG1 4.43Å; V118-V159 HydrophobicContact CG2-CG2 3.39Å
119	I	89	Confident	91.7	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-27	179.4	-84	168	0	0	0	112.9	L115 P154 E217 M218 H221	L115-I119 HydrophobicContact CG-CD1 4.45Å; L115-I119 HydrophobicContact CG-CG1 4.47Å; L115-I119 WeakPolarHBondContact O-CB 3.29Å; L115-I119 VanDerWaalsContact O-CG1 3.28Å; L115-I119 WeakPolarHBondContact O-CG1 3.46Å; L115-I119 PolarHBondContact O-N 2.9Å; I119-P154 HydrophobicContact CD1-CB 3.63Å; I119-P154 HydrophobicContact CD1-CG 3.4Å; I119-E217 HydrophobicContact CD1-CB 4.44Å; I119-E217 HydrophobicContact CD1-CG 4.03Å; I119-E217 HydrophobicContact CG2-CG 3.64Å; I119-M218 HydrophobicContact CG1-CG 3.84Å; I119-H221 PolarHBondContact O-ND1 3.13Å
120	H	84.1	Confident	91.9	Very high	131 Å²	131	57.5 Å²	57.5	61%	0.606	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	0.1	178.6	-62.8	-56.3	0	0	0	113.5	C116 Q117 V118	C116-H120 PolarHBondContact O-CD2 2.88Å; Q117-H120 PolarHBondContact O-N 2.85Å; V118-H120 PolarHBondContact O-N 2.91Å; V118-H120 VanDerWaalsContact O-N 3.16Å
121	M	88.8	Confident	92.1	Very high	95 Å²	95	55.8 Å²	55.8	47%	0.468	27%	0.272	S	S	.	.	S	Bend	trans	-91.3	151.7	174.1	-57.9	176.4	66.1	0	0	110.1	V118 L123 H221	V118-M121 WeakPolarHBondContact O-CB 3.24Å; V118-M121 PolarHBondContact O-N 3.34Å; M121-L123 PolarHBondContact O-N 2.78Å; M121-H221 PolarHBondContact O-CE1 3.12Å
122	E	85	Confident	92.2	Very high	179 Å²	179	54.8 Å²	54.8	84%	0.836	27%	0.267	S	S	*	.			trans	-72	115	168.2	-66.9	-178.6	169.1	0	0	109
123	L	90.8	Very high	92.6	Very high	17 Å²	17	50.1 Å²	50.1	9%	0.089	24%	0.242	C	C	.	.			trans	-109	124.5	178.6	-61.9	175.4	0	0	0	109.3	V118 M121 R127 M128 L131 M218 P281	V118-L123 HydrophobicContact CG1-CD1 4Å; V118-L123 HydrophobicContact CG1-CD2 3.96Å; V118-L123 HydrophobicContact CG1-CG 4.48Å; M121-L123 PolarHBondContact O-N 2.78Å; L123-R127 HydrophobicContact CD2-CB 4.38Å; L123-M128 HydrophobicContact CB-CB 4.44Å; L123-M128 HydrophobicContact CB-CE 4.41Å; L123-L131 HydrophobicContact CD1-CD1 4.27Å; L123-M218 HydrophobicContact CD1-CG 4.43Å; L123-P281 WeakPolarHBondContact O-CG 3.32Å
124	D	93.3	Very high	93	Very high	63 Å²	63	49.1 Å²	49.1	34%	0.337	23%	0.234	S	C	.	.			trans	-65.3	168.5	166.3	61.6	44.5	0	0	0	111.7	E126 R127 M128	D124-E126 PolarHBondContact O-N 3.21Å; D124-E126 WeakPolarHBondContact OD1-CA 3.21Å; D124-E126 WeakPolarHBondContact OD1-CB 3.25Å; D124-E126 PolarHBondContact OD1-N 2.88Å; D124-R127 WeakPolarHBondContact OD1-CB 3.42Å; D124-R127 WeakPolarHBondContact OD1-CG 3.35Å; D124-R127 PolarHBondContact OD1-N 3.22Å; D124-R127 IonicContact OD2-NE 3.15Å; D124-M128 WeakPolarHBondContact O-CB 3.36Å; D124-M128 PolarHBondContact O-N 3.31Å
125	H	95.1	Very high	93.3	Very high	7 Å²	7	46.7 Å²	46.7	3%	0.032	22%	0.221	C	C	.	.	H	α-helix	trans	-61.9	-30.9	178.9	-79	-60.6	0	0	0	113.4	S129 P281 D287 K290 T291 Y320	H125-S129 WeakPolarHBondContact O-CB 3.47Å; H125-S129 PolarHBondContact O-N 3.23Å; H125-S129 PolarHBondContact O-OG 2.94Å; H125-P281 PolarHBondContact CD2-O 2.9Å; H125-P281 PolarHBondContact NE2-O 3.33Å; H125-P281 VanDerWaalsContact NE2-O 3.12Å; H125-D287 IonicContact CD2-OD1 2.69Å; H125-D287 PolarHBondContact NE2-O 2.89Å; H125-K290 HydrophobicContact CB-CB 4.06Å; H125-K290 HydrophobicContact CB-CG 4.34Å; H125-T291 PolarHBondContact NE2-N 2.91Å; H125-T291 PolarHBondContact NE2-OG1 2.81Å; H125-T291 VanDerWaalsContact NE2-OG1 3.15Å; H125-Y320 HydrophobicContact CB-CE2 4.34Å; H125-Y320 AromaticContact ND1-CE2 3.48Å; H125-Y320 WeakPolarHBondContact ND1-CE2 3.44Å; H125-Y320 AromaticContact ND1-CZ 3.6Å; H125-Y320 PolarHBondContact ND1-OH 3.42Å
126	E	94.6	Very high	93.6	Very high	127 Å²	127	46.7 Å²	46.7	59%	0.593	22%	0.221	S	C	*	.	H	α-helix	trans	-67.7	-54.2	-179.1	159.8	157.6	-156	0	0	110.5	D124 M128 S129 Y130 W324	D124-E126 PolarHBondContact O-N 3.21Å; D124-E126 WeakPolarHBondContact OD1-CA 3.21Å; D124-E126 WeakPolarHBondContact OD1-CB 3.25Å; D124-E126 PolarHBondContact OD1-N 2.88Å; E126-M128 PolarHBondContact O-N 3.17Å; E126-S129 PolarHBondContact O-N 3.23Å; E126-S129 PolarHBondContact O-OG 3.02Å; E126-S129 VanDerWaalsContact O-OG 3.06Å; E126-Y130 VanDerWaalsContact O-CB 3.26Å; E126-Y130 WeakPolarHBondContact O-CB 3.25Å; E126-Y130 PolarHBondContact O-N 3.09Å; E126-W324 HydrophobicContact CB-CZ2 4.32Å; E126-W324 HydrophobicContact CG-CH2 3.83Å; E126-W324 HydrophobicContact CG-CZ2 3.73Å; E126-W324 WeakPolarHBondContact OE1-CH2 3.19Å
127	R	94.8	Very high	93.9	Very high	117 Å²	117	44.4 Å²	44.4	44%	0.442	21%	0.205	S	C	.	.	H	α-helix	trans	-60.3	-46.3	176	-68.2	174.9	-179.9	171.2	2.5	111.7	L123 D124 Y130 L131	L123-R127 HydrophobicContact CD2-CB 4.38Å; D124-R127 WeakPolarHBondContact OD1-CB 3.42Å; D124-R127 WeakPolarHBondContact OD1-CG 3.35Å; D124-R127 PolarHBondContact OD1-N 3.22Å; D124-R127 IonicContact OD2-NE 3.15Å; R127-Y130 PolarHBondContact O-N 3.15Å; R127-L131 VanDerWaalsContact O-CG 3.32Å; R127-L131 WeakPolarHBondContact O-CG 3.03Å; R127-L131 PolarHBondContact O-N 2.72Å
128	M	95.8	Very high	94.3	Very high	4 Å²	4	39 Å²	39	2%	0.02	18%	0.18	C	C	.	.	H	α-helix	trans	-62.5	-48	-179.6	-172.4	-170.4	-56.1	0	0	111.8	L123 D124 E126 Y130 L131 L132 M218 V219 Y320	L123-M128 HydrophobicContact CB-CB 4.44Å; L123-M128 HydrophobicContact CB-CE 4.41Å; D124-M128 WeakPolarHBondContact O-CB 3.36Å; D124-M128 PolarHBondContact O-N 3.31Å; E126-M128 PolarHBondContact O-N 3.17Å; M128-Y130 VanDerWaalsContact C-N 3.31Å; M128-Y130 PolarHBondContact O-N 3.13Å; M128-L131 PolarHBondContact O-N 2.68Å; M128-L132 HydrophobicContact CG-CD1 4.18Å; M128-L132 WeakPolarHBondContact O-CD1 3.39Å; M128-L132 VanDerWaalsContact O-CG 3.3Å; M128-L132 WeakPolarHBondContact O-CG 3.31Å; M128-L132 PolarHBondContact O-N 2.87Å; M128-M218 HydrophobicContact CG-SD 4.19Å; M128-V219 HydrophobicContact CE-CG1 3.66Å; M128-V219 HydrophobicContact SD-CG1 3.7Å; M128-Y320 PolarHBondContact SD-OH 3.12Å; M128-Y320 VanDerWaalsContact SD-OH 3.42Å
129	S	97.3	Very high	94.5	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.014	18%	0.176	C	C	.	.	H	α-helix	trans	-66.5	-33	177.8	59.9	0	0	0	0	112.5	H125 E126 L132 Y133 Y320 W324	H125-S129 WeakPolarHBondContact O-CB 3.47Å; H125-S129 PolarHBondContact O-N 3.23Å; H125-S129 PolarHBondContact O-OG 2.94Å; E126-S129 PolarHBondContact O-N 3.23Å; E126-S129 PolarHBondContact O-OG 3.02Å; E126-S129 VanDerWaalsContact O-OG 3.06Å; S129-L132 PolarHBondContact O-N 3.11Å; S129-Y133 VanDerWaalsContact O-CB 3.31Å; S129-Y133 WeakPolarHBondContact O-CB 3.46Å; S129-Y133 PolarHBondContact O-N 3.47Å; S129-Y320 VanDerWaalsContact CB-O 3.3Å; S129-Y320 WeakPolarHBondContact CB-O 3.47Å; S129-W324 PolarHBondContact OG-NE1 3.46Å
130	Y	97.8	Very high	94.8	Very high	57 Å²	57	40.4 Å²	40.4	22%	0.224	19%	0.185	C	C	.	.	H	α-helix	trans	-69.9	-40.7	176.2	-173.2	-123.7	0	0	0	112.7	E126 R127 M128 Y133 Q134 C163 W324	E126-Y130 VanDerWaalsContact O-CB 3.26Å; E126-Y130 WeakPolarHBondContact O-CB 3.25Å; E126-Y130 PolarHBondContact O-N 3.09Å; R127-Y130 PolarHBondContact O-N 3.15Å; M128-Y130 VanDerWaalsContact C-N 3.31Å; M128-Y130 PolarHBondContact O-N 3.13Å; Y130-Y133 HydrophobicContact CD2-CD1 4.13Å; Y130-Y133 HydrophobicContact CE2-CD1 4.18Å; Y130-Y133 PolarHBondContact O-N 3.14Å; Y130-Q134 HydrophobicContact CE2-CG 4.31Å; Y130-Q134 WeakPolarHBondContact O-CG 3.3Å; Y130-Q134 PolarHBondContact O-N 2.94Å; Y130-Q134 PolarHBondContact O-NE2 2.87Å; Y130-C163 HydrophobicContact CD1-CB 4.15Å; Y130-C163 HydrophobicContact CE1-CB 4.41Å; Y130-W324 HydrophobicContact CD2-CB 4.46Å; Y130-W324 AromaticContact CD2-CD2 3.69Å; Y130-W324 HydrophobicContact CD2-CD2 3.69Å; Y130-W324 AromaticContact CD2-CE3 3.78Å; Y130-W324 HydrophobicContact CD2-CE3 3.78Å; Y130-W324 AromaticContact CD2-CG 3.98Å; Y130-W324 HydrophobicContact CD2-CG 3.98Å; Y130-W324 HydrophobicContact CD2-CZ3 4.34Å; Y130-W324 HydrophobicContact CE2-CE3 4.27Å; Y130-W324 HydrophobicContact CG-CD2 4.4Å
131	L	97.6	Very high	95.3	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.016	16%	0.158	C	C	.	.	H	α-helix	trans	-62.5	-43.4	172.4	-68.3	174.8	0	0	0	111.1	L115 V118 L123 R127 M128 Q134 M135 V159 L165 M218	L115-L131 HydrophobicContact CD1-CD1 4.26Å; V118-L131 HydrophobicContact CG1-CD1 3.98Å; L123-L131 HydrophobicContact CD1-CD1 4.27Å; R127-L131 VanDerWaalsContact O-CG 3.32Å; R127-L131 WeakPolarHBondContact O-CG 3.03Å; R127-L131 PolarHBondContact O-N 2.72Å; M128-L131 PolarHBondContact O-N 2.68Å; L131-Q134 PolarHBondContact O-N 3.01Å; L131-M135 HydrophobicContact CB-CE 4.44Å; L131-M135 WeakPolarHBondContact O-CG 3.39Å; L131-M135 PolarHBondContact O-N 2.97Å; L131-V159 HydrophobicContact CD2-CG1 3.97Å; L131-L165 HydrophobicContact CB-CD1 4.2Å; L131-L165 HydrophobicContact CD2-CB 4.16Å; L131-L165 HydrophobicContact CD2-CD1 3.91Å; L131-M218 HydrophobicContact CD1-CE 4.22Å
132	L	98.2	Very high	95.4	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62.7	-44	176.1	-71.5	162.6	0	0	0	112.5	M128 S129 Q134 M135 L136 V211 M215 Y320 I321	M128-L132 HydrophobicContact CG-CD1 4.18Å; M128-L132 WeakPolarHBondContact O-CD1 3.39Å; M128-L132 VanDerWaalsContact O-CG 3.3Å; M128-L132 WeakPolarHBondContact O-CG 3.31Å; M128-L132 PolarHBondContact O-N 2.87Å; S129-L132 PolarHBondContact O-N 3.11Å; L132-Q134 PolarHBondContact O-N 3.15Å; L132-M135 HydrophobicContact CD2-CE 3.67Å; L132-M135 HydrophobicContact CG-CE 4.1Å; L132-M135 PolarHBondContact O-N 3.43Å; L132-L136 WeakPolarHBondContact O-CB 3.48Å; L132-L136 VanDerWaalsContact O-CG 3.27Å; L132-L136 WeakPolarHBondContact O-CG 3.43Å; L132-L136 PolarHBondContact O-N 3.5Å; L132-V211 HydrophobicContact CD2-CG1 3.61Å; L132-M215 HydrophobicContact CD1-CB 4.45Å; L132-M215 HydrophobicContact CD1-CE 4.02Å; L132-M215 HydrophobicContact CD1-CG 3.86Å; L132-M215 HydrophobicContact CD1-SD 3.64Å; L132-M215 HydrophobicContact CD2-CB 3.85Å; L132-M215 HydrophobicContact CD2-CG 4.17Å; L132-M215 HydrophobicContact CD2-SD 4.28Å; L132-Y320 HydrophobicContact CD1-CD1 4.35Å; L132-Y320 HydrophobicContact CD1-CE1 3.94Å; L132-I321 HydrophobicContact CB-CD1 3.56Å; L132-I321 HydrophobicContact CD1-CD1 4.23Å
133	Y	98.6	Very high	95.8	Very high	1 Å²	1	22.6 Å²	22.6	0%	0.004	10%	0.101	C	C	.	.	H	α-helix	trans	-55.5	-51.1	174.1	167.6	-108.5	0	0	0	111.4	S129 Y130 M135 L136 C137 L316 I321 W324 D326 E329	S129-Y133 VanDerWaalsContact O-CB 3.31Å; S129-Y133 WeakPolarHBondContact O-CB 3.46Å; S129-Y133 PolarHBondContact O-N 3.47Å; Y130-Y133 HydrophobicContact CD2-CD1 4.13Å; Y130-Y133 HydrophobicContact CE2-CD1 4.18Å; Y130-Y133 PolarHBondContact O-N 3.14Å; Y133-M135 PolarHBondContact O-N 3.06Å; Y133-L136 PolarHBondContact O-N 3.38Å; Y133-L136 VanDerWaalsContact O-N 3.13Å; Y133-C137 WeakPolarHBondContact CE2-SG 3.48Å; Y133-C137 PolarHBondContact O-N 3.41Å; Y133-C137 PolarHBondContact O-SG 2.77Å; Y133-L316 HydrophobicContact CD2-CD2 3.86Å; Y133-L316 HydrophobicContact CE2-CD2 4.07Å; Y133-I321 HydrophobicContact CD2-CG2 4.01Å; Y133-I321 HydrophobicContact CG-CG2 4.48Å; Y133-W324 HydrophobicContact CD1-CB 3.54Å; Y133-W324 HydrophobicContact CD1-CG 4.33Å; Y133-W324 HydrophobicContact CD2-CB 3.8Å; Y133-W324 HydrophobicContact CE1-CB 3.95Å; Y133-W324 WeakPolarHBondContact CE1-O 3.47Å; Y133-W324 HydrophobicContact CE2-CB 4.2Å; Y133-W324 WeakPolarHBondContact CE2-O 3.36Å; Y133-W324 HydrophobicContact CG-CB 3.44Å; Y133-W324 VanDerWaalsContact CG-CB 3.44Å; Y133-W324 HydrophobicContact CG-CG 4.23Å; Y133-W324 PolarHBondContact OH-O 3.31Å; Y133-D326 PolarHBondContact OH-N 3.46Å; Y133-E329 WeakPolarHBondContact CE1-OE2 3.42Å; Y133-E329 WeakPolarHBondContact OH-CB 3.13Å; Y133-E329 PolarHBondContact OH-OE2 2.87Å
134	Q	98.4	Very high	95.7	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.009	12%	0.116	C	C	.	.	H	α-helix	trans	-62.5	-39.8	179.2	-72.8	179.2	88.7	0	0	113	N84 Y130 L131 L132 C137 G138 C163 L165	N84-Q134 VanDerWaalsContact CB-O 3.27Å; N84-Q134 WeakPolarHBondContact CB-O 3.36Å; N84-Q134 WeakPolarHBondContact ND2-CB 3.23Å; N84-Q134 WeakPolarHBondContact ND2-CG 3.44Å; N84-Q134 PolarHBondContact ND2-OE1 2.9Å; N84-Q134 VanDerWaalsContact ND2-OE1 3.14Å; Y130-Q134 HydrophobicContact CE2-CG 4.31Å; Y130-Q134 WeakPolarHBondContact O-CG 3.3Å; Y130-Q134 PolarHBondContact O-N 2.94Å; Y130-Q134 PolarHBondContact O-NE2 2.87Å; L131-Q134 PolarHBondContact O-N 3.01Å; L132-Q134 PolarHBondContact O-N 3.15Å; Q134-C137 PolarHBondContact O-N 3.35Å; Q134-G138 PolarHBondContact O-N 3.06Å; Q134-C163 PolarHBondContact NE2-O 3.14Å; Q134-L165 HydrophobicContact CB-CB 3.98Å; Q134-L165 HydrophobicContact CB-CD2 4.31Å
135	M	98	Very high	95.4	Very high	2 Å²	2	22.4 Å²	22.4	1%	0.01	11%	0.107	C	C	.	.	H	α-helix	trans	-58.9	-47.9	172	-74.9	-173.9	-84.1	0	0	111	L115 L131 L132 Y133 C137 G138 I139 I157 L165 I214 M218	L115-M135 HydrophobicContact CD2-CE 4.49Å; L115-M135 HydrophobicContact CD2-SD 4.23Å; L131-M135 HydrophobicContact CB-CE 4.44Å; L131-M135 WeakPolarHBondContact O-CG 3.39Å; L131-M135 PolarHBondContact O-N 2.97Å; L132-M135 HydrophobicContact CD2-CE 3.67Å; L132-M135 HydrophobicContact CG-CE 4.1Å; L132-M135 PolarHBondContact O-N 3.43Å; Y133-M135 PolarHBondContact O-N 3.06Å; M135-C137 PolarHBondContact O-N 2.94Å; M135-G138 PolarHBondContact O-N 3.31Å; M135-I139 WeakPolarHBondContact O-CB 3.42Å; M135-I139 WeakPolarHBondContact O-CD1 3.45Å; M135-I139 WeakPolarHBondContact O-CG1 3.43Å; M135-I139 PolarHBondContact O-N 3.02Å; M135-I157 HydrophobicContact CG-CD1 4.42Å; M135-I157 HydrophobicContact SD-CD1 3.68Å; M135-L165 HydrophobicContact CE-CD1 4.48Å; M135-L165 HydrophobicContact CG-CD1 3.56Å; M135-L165 HydrophobicContact CG-CD2 3.78Å; M135-L165 HydrophobicContact CG-CG 4.36Å; M135-L165 HydrophobicContact SD-CD1 4.29Å; M135-I214 HydrophobicContact CE-CG2 4.18Å; M135-I214 HydrophobicContact SD-CD1 4.5Å; M135-I214 HydrophobicContact SD-CG2 4.23Å; M135-M218 HydrophobicContact CE-CE 4.04Å
136	L	98.5	Very high	94.9	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64.4	-39.5	-179.9	-70	167.4	0	0	0	112.3	L132 Y133 I139 K140 I208 M301 V312 A315 L316 I321	L132-L136 WeakPolarHBondContact O-CB 3.48Å; L132-L136 VanDerWaalsContact O-CG 3.27Å; L132-L136 WeakPolarHBondContact O-CG 3.43Å; L132-L136 PolarHBondContact O-N 3.5Å; Y133-L136 PolarHBondContact O-N 3.38Å; Y133-L136 VanDerWaalsContact O-N 3.13Å; L136-I139 PolarHBondContact O-N 3.37Å; L136-K140 VanDerWaalsContact O-CB 3.28Å; L136-K140 WeakPolarHBondContact O-CB 3.42Å; L136-K140 PolarHBondContact O-N 3.2Å; L136-I208 HydrophobicContact CD2-CD1 3.46Å; L136-I208 VanDerWaalsContact CD2-CD1 3.46Å; L136-M301 HydrophobicContact CD1-CE 4.36Å; L136-M301 HydrophobicContact CD2-CE 4.29Å; L136-V312 HydrophobicContact CD2-CG1 4.26Å; L136-A315 HydrophobicContact CD1-CB 3.89Å; L136-A315 HydrophobicContact CD2-CB 3.91Å; L136-L316 HydrophobicContact CB-CD2 3.58Å; L136-L316 HydrophobicContact CB-CG 3.9Å; L136-L316 HydrophobicContact CD1-CD2 4.35Å; L136-L316 HydrophobicContact CD1-CG 4.49Å; L136-I321 HydrophobicContact CD1-CG1 4.22Å; L136-I321 HydrophobicContact CD1-CG2 4.05Å
137	C	97.8	Very high	94.5	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-63.4	-46.2	174.2	-68.6	0	0	0	0	111.7	Y133 Q134 M135 I139 K140 H141	Y133-C137 WeakPolarHBondContact CE2-SG 3.48Å; Y133-C137 PolarHBondContact O-N 3.41Å; Y133-C137 PolarHBondContact O-SG 2.77Å; Q134-C137 PolarHBondContact O-N 3.35Å; M135-C137 PolarHBondContact O-N 2.94Å; C137-I139 PolarHBondContact O-N 3.25Å; C137-K140 PolarHBondContact O-N 3.45Å; C137-H141 WeakPolarHBondContact O-CB 3.4Å; C137-H141 PolarHBondContact O-N 3.37Å
138	G	96	Very high	94.3	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-59.5	-44.4	175.2	0	0	0	0	0	112.5	Q134 M135 H141 L142	Q134-G138 PolarHBondContact O-N 3.06Å; M135-G138 PolarHBondContact O-N 3.31Å; G138-H141 PolarHBondContact O-N 3.04Å; G138-L142 WeakPolarHBondContact O-CG 3.26Å; G138-L142 PolarHBondContact O-N 3.11Å; G138-L142 VanDerWaalsContact O-N 3.12Å
139	I	95.4	Very high	94	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-63.4	-46.1	176.7	-69.1	165.4	0	0	0	111.1	M135 L136 C137 H141 L142 H143 L152 I167 D207 V211 V312	M135-I139 WeakPolarHBondContact O-CB 3.42Å; M135-I139 WeakPolarHBondContact O-CD1 3.45Å; M135-I139 WeakPolarHBondContact O-CG1 3.43Å; M135-I139 PolarHBondContact O-N 3.02Å; L136-I139 PolarHBondContact O-N 3.37Å; C137-I139 PolarHBondContact O-N 3.25Å; I139-H141 VanDerWaalsContact C-N 3.28Å; I139-H141 PolarHBondContact O-N 3.31Å; I139-L142 WeakPolarHBondContact O-CB 3.26Å; I139-L142 PolarHBondContact O-N 2.81Å; I139-L142 VanDerWaalsContact O-N 3.13Å; I139-H143 WeakPolarHBondContact CG2-CE1 3.2Å; I139-H143 WeakPolarHBondContact CG2-NE2 2.98Å; I139-H143 PolarHBondContact O-CD2 3.17Å; I139-H143 VanDerWaalsContact O-CG 3.28Å; I139-H143 PolarHBondContact O-N 3.33Å; I139-L152 HydrophobicContact CD1-CD1 3.45Å; I139-L152 VanDerWaalsContact CD1-CD1 3.45Å; I139-L152 HydrophobicContact CG1-CD1 3.78Å; I139-I167 HydrophobicContact CG1-CD1 3.97Å; I139-D207 HydrophobicContact CD1-CB 4.39Å; I139-D207 HydrophobicContact CG2-CB 3.97Å; I139-V211 HydrophobicContact CD1-CG2 3.34Å; I139-V312 HydrophobicContact CG2-CG2 3.83Å
140	K	95.8	Very high	93.5	Very high	42 Å²	42	12.4 Å²	12.4	18%	0.183	7%	0.071	C	C	.	.	H	α-helix	trans	-58.6	-41.7	178.3	-177.6	167.1	166.2	66.7	0	111.6	L136 C137 L142 H143 S144 V312 D313 L316 A330	L136-K140 VanDerWaalsContact O-CB 3.28Å; L136-K140 WeakPolarHBondContact O-CB 3.42Å; L136-K140 PolarHBondContact O-N 3.2Å; C137-K140 PolarHBondContact O-N 3.45Å; K140-L142 VanDerWaalsContact C-N 3.34Å; K140-H143 PolarHBondContact O-N 2.78Å; K140-S144 WeakPolarHBondContact O-CB 3.46Å; K140-S144 PolarHBondContact O-N 3.44Å; K140-S144 PolarHBondContact O-OG 3.18Å; K140-V312 HydrophobicContact CB-CG1 3.77Å; K140-V312 HydrophobicContact CG-CG1 4.48Å; K140-D313 WeakPolarHBondContact CE-OD1 3.35Å; K140-D313 IonicContact NZ-OD1 3.5Å; K140-D313 PolarHBondContact NZ-OD1 2.87Å; K140-D313 IonicContact NZ-OD2 3.24Å; K140-L316 HydrophobicContact CB-CD1 4.38Å; K140-L316 HydrophobicContact CD-CD1 3.47Å; K140-L316 VanDerWaalsContact CD-CD1 3.47Å; K140-A330 WeakPolarHBondContact CD-O 3.37Å; K140-A330 WeakPolarHBondContact CE-O 3.45Å
141	H	93.6	Very high	92.9	Very high	7 Å²	7	10 Å²	10	3%	0.032	6%	0.062	C	C	.	.	H	α-helix	trans	-66.7	-34.4	177.7	-172.8	88.9	0	0	0	112.8	N81 H82 I85 C137 G138 I139 S144 P333 P335	N81-H141 PolarHBondContact O-CE1 3.08Å; N81-H141 PolarHBondContact O-NE2 3.39Å; H82-H141 HydrophobicContact CB-CB 4.25Å; H82-H141 AromaticContact CD2-CG 3.87Å; H82-H141 AromaticContact CD2-ND1 3.74Å; H82-H141 AromaticContact CG-CG 3.77Å; I85-H141 HydrophobicContact CD1-CB 4.26Å; C137-H141 WeakPolarHBondContact O-CB 3.4Å; C137-H141 PolarHBondContact O-N 3.37Å; G138-H141 PolarHBondContact O-N 3.04Å; I139-H141 VanDerWaalsContact C-N 3.28Å; I139-H141 PolarHBondContact O-N 3.31Å; H141-S144 PolarHBondContact O-OG 3.16Å; H141-P333 PolarHBondContact CE1-O 3.08Å; H141-P335 WeakPolarHBondContact NE2-CD 3.42Å
142	L	91.4	Very high	92.7	Very high	0 Å²	0	10 Å²	10	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-67.5	-47	171.1	-67.2	169.8	0	0	0	111.2	V80 I85 G138 I139 K140 S144 A145 G146 I147 H149 F170	V80-L142 HydrophobicContact CG1-CD2 4.39Å; V80-L142 HydrophobicContact CG2-CD2 4.33Å; I85-L142 HydrophobicContact CD1-CD1 4.42Å; I85-L142 HydrophobicContact CD1-CD2 3.72Å; I85-L142 HydrophobicContact CD1-CG 3.7Å; G138-L142 WeakPolarHBondContact O-CG 3.26Å; G138-L142 PolarHBondContact O-N 3.11Å; G138-L142 VanDerWaalsContact O-N 3.12Å; I139-L142 WeakPolarHBondContact O-CB 3.26Å; I139-L142 PolarHBondContact O-N 2.81Å; I139-L142 VanDerWaalsContact O-N 3.13Å; K140-L142 VanDerWaalsContact C-N 3.34Å; L142-S144 PolarHBondContact O-N 2.66Å; L142-A145 CarbonylContact O-C 3.59Å; L142-A145 WeakPolarHBondContact O-CA 3.42Å; L142-A145 VanDerWaalsContact O-CB 3.31Å; L142-A145 WeakPolarHBondContact O-CB 3.35Å; L142-A145 PolarHBondContact O-N 3.41Å; L142-G146 PolarHBondContact O-N 3.44Å; L142-I147 CarbonylContact C-O 3.6Å; L142-I147 HydrophobicContact CB-CB 4.17Å; L142-I147 WeakPolarHBondContact CB-O 3.36Å; L142-I147 HydrophobicContact CD2-CB 4.39Å; L142-I147 HydrophobicContact CD2-CD1 3.86Å; L142-I147 HydrophobicContact CD2-CG2 4.32Å; L142-I147 WeakPolarHBondContact O-CB 3.44Å; L142-I147 PolarHBondContact O-N 2.99Å; L142-H149 HydrophobicContact CD1-CB 4.44Å; L142-F170 HydrophobicContact CD1-CD1 4.25Å; L142-F170 HydrophobicContact CD1-CE1 3.68Å; L142-F170 HydrophobicContact CD2-CD1 4.01Å; L142-F170 HydrophobicContact CD2-CE1 3.64Å; L142-F170 HydrophobicContact CD2-CZ 4.28Å; L142-F170 HydrophobicContact CG-CE1 4.28Å
143	H	92	Very high	92.4	Very high	24 Å²	24	11 Å²	11	11%	0.111	7%	0.067	C	C	.	.	H	α-helix	trans	-63.8	-38.3	-178.7	-68.8	177.7	0	0	0	112.3	I139 K140 A145 G146 I147 E204 D207 V312	I139-H143 WeakPolarHBondContact CG2-CE1 3.2Å; I139-H143 WeakPolarHBondContact CG2-NE2 2.98Å; I139-H143 PolarHBondContact O-CD2 3.17Å; I139-H143 VanDerWaalsContact O-CG 3.28Å; I139-H143 PolarHBondContact O-N 3.33Å; K140-H143 PolarHBondContact O-N 2.78Å; H143-A145 PolarHBondContact O-N 2.73Å; H143-G146 WeakPolarHBondContact O-CA 3.34Å; H143-G146 PolarHBondContact O-N 2.78Å; H143-I147 PolarHBondContact CD2-O 2.89Å; H143-I147 VanDerWaalsContact CD2-O 3.29Å; H143-I147 PolarHBondContact N-O 2.79Å; H143-E204 HydrophobicContact CB-CG 4.18Å; H143-E204 PolarHBondContact CE1-O 3.41Å; H143-E204 PolarHBondContact NE2-O 2.81Å; H143-D207 IonicContact CD2-OD2 3.52Å; H143-D207 IonicContact CE1-OD2 3.82Å; H143-D207 IonicContact NE2-OD2 3.97Å; H143-D207 PolarHBondContact NE2-OD2 2.92Å; H143-V312 WeakPolarHBondContact ND1-CG2 3.44Å
144	S	90.4	Very high	92.1	Very high	58 Å²	58	11 Å²	11	41%	0.406	7%	0.067	S	C	.	.	H	α-helix	trans	-64.6	-22.4	175.6	65.5	0	0	0	0	112.7	K140 H141 L142 G146 P334	K140-S144 WeakPolarHBondContact O-CB 3.46Å; K140-S144 PolarHBondContact O-N 3.44Å; K140-S144 PolarHBondContact O-OG 3.18Å; H141-S144 PolarHBondContact O-OG 3.16Å; L142-S144 PolarHBondContact O-N 2.66Å; S144-G146 VanDerWaalsContact C-N 3.33Å; S144-P334 WeakPolarHBondContact O-CB 3.42Å
145	A	85.7	Confident	91.7	Very high	18 Å²	18	13.4 Å²	13.4	15%	0.149	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-0.4	172.2	0	0	0	0	0	113	L142 H143 I147 P334 P335 I337	L142-A145 CarbonylContact O-C 3.59Å; L142-A145 WeakPolarHBondContact O-CA 3.42Å; L142-A145 VanDerWaalsContact O-CB 3.31Å; L142-A145 WeakPolarHBondContact O-CB 3.35Å; L142-A145 PolarHBondContact O-N 3.41Å; H143-A145 PolarHBondContact O-N 2.73Å; A145-I147 VanDerWaalsContact C-N 3.31Å; A145-I147 HydrophobicContact CB-CD1 4.15Å; A145-I147 HydrophobicContact CB-CG1 4.28Å; A145-P334 HydrophobicContact CB-CB 4.34Å; A145-P335 HydrophobicContact CB-CG 3.7Å; A145-I337 HydrophobicContact CB-CD1 3.47Å; A145-I337 VanDerWaalsContact CB-CD1 3.47Å; A145-I337 HydrophobicContact CB-CG1 3.92Å; A145-I337 WeakPolarHBondContact O-CD1 3.48Å
146	G	85.5	Confident	91.4	Very high	26 Å²	26	13.9 Å²	13.9	27%	0.268	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	10.4	-174.8	0	0	0	0	0	114.3	L142 H143 S144 T175 A176	L142-G146 PolarHBondContact O-N 3.44Å; H143-G146 WeakPolarHBondContact O-CA 3.34Å; H143-G146 PolarHBondContact O-N 2.78Å; S144-G146 VanDerWaalsContact C-N 3.33Å; G146-T175 VanDerWaalsContact O-CA 3.26Å; G146-T175 WeakPolarHBondContact O-CA 3.39Å; G146-A176 PolarHBondContact O-N 3.28Å
147	I	86.5	Confident	91.2	Very high	1 Å²	1	14 Å²	14	1%	0.005	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	122.4	177.8	-54.9	163	0	0	0	109.8	L76 V80 L142 H143 A145 A173 I337	L76-I147 HydrophobicContact CD1-CD1 4.42Å; L76-I147 HydrophobicContact CD1-CG2 4.38Å; L76-I147 HydrophobicContact CD2-CD1 3.5Å; L76-I147 VanDerWaalsContact CD2-CD1 3.5Å; L76-I147 HydrophobicContact CD2-CG1 4.01Å; L76-I147 HydrophobicContact CG-CD1 4.48Å; V80-I147 HydrophobicContact CG2-CD1 3.95Å; L142-I147 CarbonylContact C-O 3.6Å; L142-I147 HydrophobicContact CB-CB 4.17Å; L142-I147 WeakPolarHBondContact CB-O 3.36Å; L142-I147 HydrophobicContact CD2-CB 4.39Å; L142-I147 HydrophobicContact CD2-CD1 3.86Å; L142-I147 HydrophobicContact CD2-CG2 4.32Å; L142-I147 WeakPolarHBondContact O-CB 3.44Å; L142-I147 PolarHBondContact O-N 2.99Å; H143-I147 PolarHBondContact CD2-O 2.89Å; H143-I147 VanDerWaalsContact CD2-O 3.29Å; H143-I147 PolarHBondContact N-O 2.79Å; A145-I147 VanDerWaalsContact C-N 3.31Å; A145-I147 HydrophobicContact CB-CD1 4.15Å; A145-I147 HydrophobicContact CB-CG1 4.28Å; I147-A173 HydrophobicContact CG2-CB 3.5Å; I147-A173 VanDerWaalsContact CG2-CB 3.5Å; I147-I337 HydrophobicContact CD1-CD1 3.34Å; I147-I337 HydrophobicContact CG1-CD1 3.3Å
148	I	89.6	Confident	91.1	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.005	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	130.1	168.6	-55	179.4	0	0	0	108.8	R150 A173 R174 A176 Y202 E204 V206	I148-R150 HydrophobicContact CB-CG 4.22Å; I148-R150 HydrophobicContact CG2-CG 3.6Å; I148-A173 CarbonylContact O-C 3.57Å; I148-A173 WeakPolarHBondContact O-CA 3.43Å; I148-A173 WeakPolarHBondContact O-CB 3.29Å; I148-R174 PolarHBondContact N-O 2.93Å; I148-R174 PolarHBondContact O-N 2.92Å; I148-A176 HydrophobicContact CD1-CB 3.83Å; I148-A176 HydrophobicContact CG1-CB 4.43Å; I148-Y202 HydrophobicContact CD1-CD2 4.08Å; I148-Y202 HydrophobicContact CD1-CE2 4.04Å; I148-E204 HydrophobicContact CD1-CG 4.37Å; I148-E204 HydrophobicContact CG1-CG 4.36Å; I148-V206 HydrophobicContact CG2-CG1 3.24Å
149	H	89.2	Confident	91.1	Very high	1 Å²	1	15.1 Å²	15.1	1%	0.005	9%	0.094	C	C	.	.			trans	-74.3	-49.4	-172.1	-171.9	-71.1	0	0	0	112.9	L142 D151 L152 L168 D169 D207	L142-H149 HydrophobicContact CD1-CB 4.44Å; H149-D151 VanDerWaalsContact CE1-C 3.49Å; H149-D151 PolarHBondContact CE1-O 2.71Å; H149-D151 PolarHBondContact ND1-N 3.38Å; H149-D151 PolarHBondContact O-N 2.89Å; H149-L152 HydrophobicContact CB-CG 4.04Å; H149-L152 PolarHBondContact ND1-N 3.34Å; H149-L152 VanDerWaalsContact ND1-N 3.17Å; H149-L168 PolarHBondContact NE2-O 2.85Å; H149-D169 PolarHBondContact NE2-O 2.81Å; H149-D207 PolarHBondContact N-OD2 2.84Å
150	R	86.9	Confident	91	Very high	18 Å²	18	18.6 Å²	18.6	7%	0.068	11%	0.108	C	C	.	.			trans	66.9	-17.9	174.7	-49.9	-174.1	-55.2	155.4	11.6	118	I148 L172 Y202 V206 D207	I148-R150 HydrophobicContact CB-CG 4.22Å; I148-R150 HydrophobicContact CG2-CG 3.6Å; R150-L172 PolarHBondContact NE-O 3.42Å; R150-L172 VanDerWaalsContact NE-O 3.15Å; R150-L172 PolarHBondContact NH2-O 2.79Å; R150-Y202 VanDerWaalsContact CD-CE2 3.47Å; R150-Y202 WeakPolarHBondContact CD-OH 3.41Å; R150-Y202 HydrophobicContact CG-CE2 4.33Å; R150-Y202 PolarHBondContact NH1-OH 3.34Å; R150-V206 HydrophobicContact CG-CG1 4.29Å; R150-D207 PolarHBondContact N-OD1 3.07Å
151	D	86.2	Confident	90.7	Very high	7 Å²	7	21.8 Å²	21.8	4%	0.037	14%	0.136	C	C	.	.			trans	-124.3	37.6	176.4	-154.5	62.7	0	0	0	112	H149 K153 L172 R192	H149-D151 VanDerWaalsContact CE1-C 3.49Å; H149-D151 PolarHBondContact CE1-O 2.71Å; H149-D151 PolarHBondContact ND1-N 3.38Å; H149-D151 PolarHBondContact O-N 2.89Å; D151-K153 PolarHBondContact O-N 2.76Å; D151-K153 IonicContact OD2-NZ 2.68Å; D151-K153 PolarHBondContact OD2-NZ 2.88Å; D151-L172 HydrophobicContact CB-CB 4.11Å; D151-L172 HydrophobicContact CB-CD1 3.67Å; D151-R192 IonicContact OD1-CZ 3.61Å; D151-R192 IonicContact OD1-NE 3.02Å; D151-R192 PolarHBondContact OD1-NE 2.79Å; D151-R192 IonicContact OD1-NH2 3.75Å; D151-R192 PolarHBondContact OD1-NH2 3.46Å
152	L	92.8	Very high	90.7	Very high	3 Å²	3	26.2 Å²	26.2	2%	0.016	16%	0.16	C	C	.	.			trans	-65.5	129.5	173.6	-80.3	174.4	0	0	0	109.8	I139 H149 I167 Y191 D207 V211	I139-L152 HydrophobicContact CD1-CD1 3.45Å; I139-L152 VanDerWaalsContact CD1-CD1 3.45Å; I139-L152 HydrophobicContact CG1-CD1 3.78Å; H149-L152 HydrophobicContact CB-CG 4.04Å; H149-L152 PolarHBondContact ND1-N 3.34Å; H149-L152 VanDerWaalsContact ND1-N 3.17Å; L152-I167 HydrophobicContact CD2-CD1 4.39Å; L152-I167 HydrophobicContact CD2-CG2 3.85Å; L152-Y191 WeakPolarHBondContact O-CB 3.31Å; L152-D207 HydrophobicContact CD1-CB 3.83Å; L152-V211 HydrophobicContact CD1-CG2 4.45Å
153	K	91.9	Very high	90.8	Very high	21 Å²	21	27.9 Å²	27.9	9%	0.091	17%	0.172	C	C	.	.			trans	-160.2	159.5	-179.9	60.7	-168.9	177	-150.1	0	109.3	D151 S155 N156 Y191	D151-K153 PolarHBondContact O-N 2.76Å; D151-K153 IonicContact OD2-NZ 2.68Å; D151-K153 PolarHBondContact OD2-NZ 2.88Å; K153-S155 VanDerWaalsContact CE-OG 3.23Å; K153-S155 WeakPolarHBondContact CE-OG 3.08Å; K153-S155 WeakPolarHBondContact CG-OG 3.31Å; K153-S155 PolarHBondContact O-N 2.75Å; K153-S155 VanDerWaalsContact O-N 3.11Å; K153-N156 VanDerWaalsContact CE-CG 3.5Å; K153-N156 WeakPolarHBondContact CE-OD1 3.36Å; K153-N156 HydrophobicContact CG-CB 4.1Å; K153-N156 PolarHBondContact O-N 2.83Å; K153-Y191 HydrophobicContact CB-CD2 3.4Å; K153-Y191 HydrophobicContact CB-CE2 3.77Å; K153-Y191 HydrophobicContact CB-CG 4.02Å
154	P	93.4	Very high	90.9	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.006	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-55.6	-33.8	-176.1	-29.7	37.6	0	0	0	114.7	L115 C116 I119 N156 I157 Y191 I214	L115-P154 HydrophobicContact CB-CB 3.99Å; L115-P154 WeakPolarHBondContact CB-O 3.17Å; L115-P154 PolarHBondContact N-O 2.86Å; C116-P154 HydrophobicContact CB-CB 4.49Å; I119-P154 HydrophobicContact CD1-CB 3.63Å; I119-P154 HydrophobicContact CD1-CG 3.4Å; P154-N156 PolarHBondContact O-N 2.88Å; P154-I157 PolarHBondContact O-N 3.42Å; P154-Y191 VanDerWaalsContact CD-CE1 3.44Å; P154-Y191 VanDerWaalsContact CD-CE2 3.49Å; P154-Y191 WeakPolarHBondContact CD-OH 3.42Å; P154-Y191 HydrophobicContact CG-CE1 3.84Å; P154-Y191 HydrophobicContact CG-CE2 4.44Å; P154-Y191 WeakPolarHBondContact CG-OH 3.36Å; P154-I214 HydrophobicContact CG-CG1 4.13Å
155	S	89.4	Confident	91.3	Very high	51 Å²	51	26 Å²	26	36%	0.357	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-69.3	-20.2	177.9	69.7	0	0	0	0	114.3	C116 K153	C116-S155 PolarHBondContact SG-N 3.08Å; K153-S155 VanDerWaalsContact CE-OG 3.23Å; K153-S155 WeakPolarHBondContact CE-OG 3.08Å; K153-S155 WeakPolarHBondContact CG-OG 3.31Å; K153-S155 PolarHBondContact O-N 2.75Å; K153-S155 VanDerWaalsContact O-N 3.11Å
156	N	91.9	Very high	91.8	Very high	13 Å²	13	26.1 Å²	26.1	7%	0.07	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-98.9	11.5	179.3	-72.6	18.8	0	0	0	111.6	K153 P154 L168 D169	K153-N156 VanDerWaalsContact CE-CG 3.5Å; K153-N156 WeakPolarHBondContact CE-OD1 3.36Å; K153-N156 HydrophobicContact CG-CB 4.1Å; K153-N156 PolarHBondContact O-N 2.83Å; P154-N156 PolarHBondContact O-N 2.88Å; N156-L168 WeakPolarHBondContact O-CB 3.36Å; N156-L168 PolarHBondContact O-N 3.49Å; N156-D169 PolarHBondContact ND2-OD2 2.92Å
157	I	94.1	Very high	92.3	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	124.9	177.2	-63.7	161.6	0	0	0	106.9	N114 L115 M135 P154 L165 I214	N114-I157 CarbonylContact C-O 3.6Å; N114-I157 VanDerWaalsContact CA-O 3.28Å; N114-I157 WeakPolarHBondContact CA-O 3.26Å; L115-I157 HydrophobicContact CB-CB 4.05Å; L115-I157 HydrophobicContact CB-CG2 4.15Å; L115-I157 HydrophobicContact CD1-CG2 4.42Å; L115-I157 HydrophobicContact CD2-CB 4.11Å; L115-I157 HydrophobicContact CD2-CD1 3.91Å; L115-I157 HydrophobicContact CD2-CG2 3.95Å; L115-I157 HydrophobicContact CG-CG2 4.44Å; L115-I157 PolarHBondContact N-O 3.01Å; M135-I157 HydrophobicContact CG-CD1 4.42Å; M135-I157 HydrophobicContact SD-CD1 3.68Å; P154-I157 PolarHBondContact O-N 3.42Å; I157-L165 HydrophobicContact CG2-CD1 3.47Å; I157-L165 VanDerWaalsContact CG2-CD1 3.47Å; I157-L165 HydrophobicContact CG2-CD2 3.79Å; I157-L165 HydrophobicContact CG2-CG 3.5Å; I157-L165 VanDerWaalsContact CG2-CG 3.5Å; I157-I214 HydrophobicContact CD1-CD1 3.58Å
158	V	94.9	Very high	92.4	Very high	17 Å²	17	26.7 Å²	26.7	10%	0.103	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	147.8	-178.1	-74.2	0	0	0	0	110.9	M111 A113 N114 L165 K166 L168	M111-V158 HydrophobicContact CB-CB 3.7Å; M111-V158 HydrophobicContact CB-CG1 4.43Å; M111-V158 HydrophobicContact CB-CG2 3.96Å; M111-V158 HydrophobicContact CE-CG2 4.28Å; M111-V158 HydrophobicContact CG-CB 3.91Å; M111-V158 HydrophobicContact CG-CG2 3.56Å; A113-V158 CarbonylContact O-C 3.58Å; A113-V158 VanDerWaalsContact O-CA 3.27Å; A113-V158 WeakPolarHBondContact O-CA 3.42Å; A113-V158 WeakPolarHBondContact O-CB 3.42Å; N114-V158 HydrophobicContact CB-CG1 4.23Å; V158-L165 CarbonylContact O-C 3.55Å; V158-L165 WeakPolarHBondContact O-CA 3.18Å; V158-K166 HydrophobicContact CG2-CB 4.08Å; V158-K166 VanDerWaalsContact CG2-O 3.31Å; V158-K166 WeakPolarHBondContact CG2-O 3.45Å; V158-K166 PolarHBondContact N-O 2.74Å; V158-K166 PolarHBondContact O-N 3.23Å; V158-L168 HydrophobicContact CB-CD1 4.47Å; V158-L168 HydrophobicContact CG1-CD1 3.52Å; V158-L168 HydrophobicContact CG1-CG 4.11Å; V158-L168 HydrophobicContact CG2-CD1 4.18Å; V158-L168 HydrophobicContact CG2-CD2 3.73Å; V158-L168 HydrophobicContact CG2-CG 3.83Å
159	V	95.9	Very high	91.8	Very high	8 Å²	8	27.4 Å²	27.4	5%	0.048	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	159.2	-178	-57	0	0	0	0	111.7	D112 A113 L115 V118 L131 T164 L165	D112-V159 PolarHBondContact N-O 3.19Å; A113-V159 HydrophobicContact CB-CG2 4.01Å; A113-V159 PolarHBondContact N-O 3.5Å; A113-V159 VanDerWaalsContact N-O 3.12Å; A113-V159 PolarHBondContact O-N 2.89Å; L115-V159 HydrophobicContact CD1-CG1 4.04Å; V118-V159 HydrophobicContact CG2-CG1 4.43Å; V118-V159 HydrophobicContact CG2-CG2 3.39Å; L131-V159 HydrophobicContact CD2-CG1 3.97Å; V159-T164 CarbonylContact C-O 3.48Å; V159-T164 WeakPolarHBondContact CA-O 3.49Å; V159-L165 HydrophobicContact CG1-CB 4.21Å; V159-L165 HydrophobicContact CG1-CD1 4.3Å; V159-L165 HydrophobicContact CG1-CG 4.29Å
160	K	93.8	Very high	90.8	Very high	72 Å²	72	27.4 Å²	27.4	31%	0.313	16%	0.157	S	C	.	.			trans	-106.4	166.3	163.6	-75.5	178.5	170.1	179.6	0	111.1	M111 D112 D162 C163 T164	M111-K160 HydrophobicContact CE-CD 4.41Å; M111-K160 HydrophobicContact CE-CG 3.81Å; M111-K160 HydrophobicContact SD-CD 4.1Å; M111-K160 HydrophobicContact SD-CG 3.82Å; D112-K160 WeakPolarHBondContact OD2-CA 3.33Å; K160-D162 WeakPolarHBondContact CB-OD1 3.23Å; K160-D162 PolarHBondContact O-N 2.8Å; K160-C163 WeakPolarHBondContact O-CA 3.34Å; K160-C163 PolarHBondContact O-N 3.33Å; K160-T164 WeakPolarHBondContact CB-OG1 3.39Å; K160-T164 PolarHBondContact N-O 2.88Å
161	S	90.6	Very high	89.3	Confident	109 Å²	109	26.6 Å²	26.6	76%	0.762	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-25.2	174.3	43.2	0	0	0	0	114.1	D112 C163	D112-S161 WeakPolarHBondContact OD2-CB 3.4Å; D112-S161 PolarHBondContact OD2-N 3.38Å; D112-S161 PolarHBondContact OD2-OG 2.79Å; S161-C163 PolarHBondContact O-N 2.88Å
162	D	92.9	Very high	87.9	Confident	101 Å²	101	27.3 Å²	27.3	54%	0.54	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	10.8	173	67.9	-1.8	0	0	0	114	K160 T164	K160-D162 WeakPolarHBondContact CB-OD1 3.23Å; K160-D162 PolarHBondContact O-N 2.8Å; D162-T164 PolarHBondContact O-N 2.85Å; D162-T164 VanDerWaalsContact OD1-CB 3.32Å; D162-T164 WeakPolarHBondContact OD1-CB 3.41Å; D162-T164 VanDerWaalsContact OD1-CG2 3.27Å; D162-T164 WeakPolarHBondContact OD1-CG2 3.16Å; D162-T164 PolarHBondContact OD1-N 3.19Å; D162-T164 PolarHBondContact OD1-OG1 2.8Å
163	C	92.7	Very high	86.2	Confident	35 Å²	35	27.1 Å²	27.1	24%	0.236	16%	0.157	C	C	.	.			trans	64.4	15.3	-175.7	-62.5	0	0	0	0	115.2	Y130 Q134 K160 S161	Y130-C163 HydrophobicContact CD1-CB 4.15Å; Y130-C163 HydrophobicContact CE1-CB 4.41Å; Q134-C163 PolarHBondContact NE2-O 3.14Å; K160-C163 WeakPolarHBondContact O-CA 3.34Å; K160-C163 PolarHBondContact O-N 3.33Å; S161-C163 PolarHBondContact O-N 2.88Å
164	T	95.6	Very high	84.5	Confident	40 Å²	40	28.8 Å²	28.8	25%	0.245	16%	0.163	C	C	.	.			trans	-71.3	140.8	168.7	58.4	0	0	0	0	110.8	V159 K160 D162	V159-T164 CarbonylContact C-O 3.48Å; V159-T164 WeakPolarHBondContact CA-O 3.49Å; K160-T164 WeakPolarHBondContact CB-OG1 3.39Å; K160-T164 PolarHBondContact N-O 2.88Å; D162-T164 PolarHBondContact O-N 2.85Å; D162-T164 VanDerWaalsContact OD1-CB 3.32Å; D162-T164 WeakPolarHBondContact OD1-CB 3.41Å; D162-T164 VanDerWaalsContact OD1-CG2 3.27Å; D162-T164 WeakPolarHBondContact OD1-CG2 3.16Å; D162-T164 PolarHBondContact OD1-N 3.19Å; D162-T164 PolarHBondContact OD1-OG1 2.8Å
165	L	97.5	Very high	82.4	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	137.9	-174.3	178.1	156.5	0	0	0	111.5	N84 L131 Q134 M135 I157 V158 V159 I167	N84-L165 VanDerWaalsContact CA-O 3.29Å; N84-L165 WeakPolarHBondContact CA-O 3.29Å; N84-L165 PolarHBondContact ND2-O 3.09Å; L131-L165 HydrophobicContact CB-CD1 4.2Å; L131-L165 HydrophobicContact CD2-CB 4.16Å; L131-L165 HydrophobicContact CD2-CD1 3.91Å; Q134-L165 HydrophobicContact CB-CB 3.98Å; Q134-L165 HydrophobicContact CB-CD2 4.31Å; M135-L165 HydrophobicContact CE-CD1 4.48Å; M135-L165 HydrophobicContact CG-CD1 3.56Å; M135-L165 HydrophobicContact CG-CD2 3.78Å; M135-L165 HydrophobicContact CG-CG 4.36Å; M135-L165 HydrophobicContact SD-CD1 4.29Å; I157-L165 HydrophobicContact CG2-CD1 3.47Å; I157-L165 VanDerWaalsContact CG2-CD1 3.47Å; I157-L165 HydrophobicContact CG2-CD2 3.79Å; I157-L165 HydrophobicContact CG2-CG 3.5Å; I157-L165 VanDerWaalsContact CG2-CG 3.5Å; V158-L165 CarbonylContact O-C 3.55Å; V158-L165 WeakPolarHBondContact O-CA 3.18Å; V159-L165 HydrophobicContact CG1-CB 4.21Å; V159-L165 HydrophobicContact CG1-CD1 4.3Å; V159-L165 HydrophobicContact CG1-CG 4.29Å; L165-I167 HydrophobicContact CD2-CG1 4.32Å
166	K	96.6	Very high	80	Confident	21 Å²	21	29.1 Å²	29.1	9%	0.091	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	138.4	172.9	-73.6	167.5	174.2	-92	0	112.4	K83 N84 I85 I86 E109 M111 V158	K83-K166 WeakPolarHBondContact O-CE 3.39Å; K83-K166 VanDerWaalsContact O-CG 3.23Å; K83-K166 WeakPolarHBondContact O-CG 3.37Å; K83-K166 PolarHBondContact O-NZ 3.36Å; N84-K166 WeakPolarHBondContact O-CA 3.4Å; I85-K166 PolarHBondContact O-NZ 3.01Å; I85-K166 VanDerWaalsContact O-NZ 3.14Å; I86-K166 HydrophobicContact CD1-CD 4.37Å; E109-K166 HydrophobicContact CG-CD 4.28Å; E109-K166 WeakPolarHBondContact OE1-CD 3.32Å; E109-K166 WeakPolarHBondContact OE1-CE 3.14Å; E109-K166 IonicContact OE1-NZ 3.18Å; E109-K166 PolarHBondContact OE1-NZ 2.85Å; E109-K166 WeakPolarHBondContact OE2-CD 3.47Å; E109-K166 WeakPolarHBondContact OE2-CE 3.48Å; E109-K166 IonicContact OE2-NZ 3.78Å; E109-K166 PolarHBondContact OE2-NZ 3.36Å; M111-K166 HydrophobicContact CE-CB 4.23Å; M111-K166 HydrophobicContact CE-CD 4.02Å; M111-K166 HydrophobicContact CE-CG 4.26Å; M111-K166 HydrophobicContact SD-CD 3.97Å; V158-K166 HydrophobicContact CG2-CB 4.08Å; V158-K166 VanDerWaalsContact CG2-O 3.31Å; V158-K166 WeakPolarHBondContact CG2-O 3.45Å; V158-K166 PolarHBondContact N-O 2.74Å; V158-K166 PolarHBondContact O-N 3.23Å
167	I	95.4	Very high	77	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	135	174.2	-59.9	172.3	0	0	0	109.5	N84 I86 I139 L152 L165 F170	N84-I167 PolarHBondContact O-N 3.35Å; I86-I167 WeakPolarHBondContact CG2-O 3.32Å; I86-I167 PolarHBondContact N-O 2.94Å; I139-I167 HydrophobicContact CG1-CD1 3.97Å; L152-I167 HydrophobicContact CD2-CD1 4.39Å; L152-I167 HydrophobicContact CD2-CG2 3.85Å; L165-I167 HydrophobicContact CD2-CG1 4.32Å; I167-F170 HydrophobicContact CG2-CE1 4.22Å
168	L	90.1	Very high	74.3	Confident	39 Å²	39	34.6 Å²	34.6	20%	0.204	20%	0.204	C	C	.	.			trans	-105.4	169.9	175.8	-57.6	-178.8	0	0	0	112.1	I86 H149 N156 V158	I86-L168 HydrophobicContact CB-CD2 3.65Å; I86-L168 HydrophobicContact CD1-CD2 3.88Å; I86-L168 HydrophobicContact CG1-CD2 3.68Å; I86-L168 HydrophobicContact CG2-CD2 3.8Å; H149-L168 PolarHBondContact NE2-O 2.85Å; N156-L168 WeakPolarHBondContact O-CB 3.36Å; N156-L168 PolarHBondContact O-N 3.49Å; V158-L168 HydrophobicContact CB-CD1 4.47Å; V158-L168 HydrophobicContact CG1-CD1 3.52Å; V158-L168 HydrophobicContact CG1-CG 4.11Å; V158-L168 HydrophobicContact CG2-CD1 4.18Å; V158-L168 HydrophobicContact CG2-CD2 3.73Å; V158-L168 HydrophobicContact CG2-CG 3.83Å
169	D	75.6	Confident	71.5	Confident	17 Å²	17	39.9 Å²	39.9	9%	0.091	23%	0.232	C	C	.	.			trans	60	79.9	157.2	-176.7	14.7	0	0	0	116.3	Q37 H149 N156 G171	Q37-D169 PolarHBondContact NE2-OD1 3.47Å; Q37-D169 PolarHBondContact NE2-OD2 3.18Å; Q37-D169 VanDerWaalsContact OE1-CG 3.31Å; Q37-D169 PolarHBondContact OE1-OD1 2.84Å; Q37-D169 VanDerWaalsContact OE1-OD1 3.11Å; Q37-D169 PolarHBondContact OE1-OD2 3.37Å; H149-D169 PolarHBondContact NE2-O 2.81Å; N156-D169 PolarHBondContact ND2-OD2 2.92Å; D169-G171 VanDerWaalsContact C-N 3.27Å; D169-G171 PolarHBondContact O-N 2.82Å; D169-G171 PolarHBondContact OD1-N 3.2Å; D169-G171 VanDerWaalsContact OD1-N 3.16Å
170	F	68.6	Low	68.5	Low	1 Å²	1	47.2 Å²	47.2	0%	0.004	26%	0.263	C	S	.	.			trans	-85.1	11.1	173.7	-49.4	-65.7	0	0	0	114.1	R72 L76 L77 I85 I86 L142 I167 L172 A173	R72-F170 PolarHBondContact NE-O 3.17Å; L76-F170 HydrophobicContact CB-CB 4.13Å; L76-F170 HydrophobicContact CB-CD2 4.26Å; L76-F170 HydrophobicContact CB-CG 4.35Å; L76-F170 HydrophobicContact CD1-CB 3.5Å; L76-F170 VanDerWaalsContact CD1-CB 3.5Å; L76-F170 HydrophobicContact CD1-CG 4.29Å; L76-F170 HydrophobicContact CG-CB 4.46Å; L77-F170 HydrophobicContact CD2-CD2 4.18Å; L77-F170 HydrophobicContact CD2-CE2 3.95Å; L77-F170 HydrophobicContact CG-CD2 4.38Å; I85-F170 HydrophobicContact CG2-CE1 4.49Å; I85-F170 HydrophobicContact CG2-CE2 3.84Å; I85-F170 HydrophobicContact CG2-CZ 3.42Å; I85-F170 VanDerWaalsContact CG2-CZ 3.42Å; I86-F170 HydrophobicContact CG2-CE2 4.39Å; L142-F170 HydrophobicContact CD1-CD1 4.25Å; L142-F170 HydrophobicContact CD1-CE1 3.68Å; L142-F170 HydrophobicContact CD2-CD1 4.01Å; L142-F170 HydrophobicContact CD2-CE1 3.64Å; L142-F170 HydrophobicContact CD2-CZ 4.28Å; L142-F170 HydrophobicContact CG-CE1 4.28Å; I167-F170 HydrophobicContact CG2-CE1 4.22Å; F170-L172 PolarHBondContact O-N 3.45Å; F170-L172 VanDerWaalsContact O-N 3.14Å; F170-A173 HydrophobicContact CB-CB 4.15Å; F170-A173 VanDerWaalsContact O-CB 3.24Å; F170-A173 WeakPolarHBondContact O-CB 3.31Å; F170-A173 PolarHBondContact O-N 2.98Å
171	G	55.5	Low	65.5	Low	1 Å²	1	52.1 Å²	52.1	1%	0.01	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-22.5	-172.9	0	0	0	0	0	114.2	R69 D169	R69-G171 WeakPolarHBondContact CG-O 3.4Å; D169-G171 VanDerWaalsContact C-N 3.27Å; D169-G171 PolarHBondContact O-N 2.82Å; D169-G171 PolarHBondContact OD1-N 3.2Å; D169-G171 VanDerWaalsContact OD1-N 3.16Å
172	L	58	Low	62.9	Low	21 Å²	21	49.9 Å²	49.9	11%	0.11	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-0.7	175.1	-69.7	177.5	0	0	0	113.8	R150 D151 F170 M182	R150-L172 PolarHBondContact NE-O 3.42Å; R150-L172 VanDerWaalsContact NE-O 3.15Å; R150-L172 PolarHBondContact NH2-O 2.79Å; D151-L172 HydrophobicContact CB-CB 4.11Å; D151-L172 HydrophobicContact CB-CD1 3.67Å; F170-L172 PolarHBondContact O-N 3.45Å; F170-L172 VanDerWaalsContact O-N 3.14Å; L172-M182 HydrophobicContact CD1-CE 4.18Å; L172-M182 HydrophobicContact CD2-CE 4.44Å
173	A	55.3	Low	59.9	Low	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.269	C	S	.	.			trans	-58.4	161.4	177.7	0	0	0	0	0	110.1	R72 L76 I147 I148 F170	R72-A173 PolarHBondContact NE-O 3.3Å; R72-A173 PolarHBondContact NH1-O 3.49Å; R72-A173 PolarHBondContact NH2-O 3.49Å; R72-A173 VanDerWaalsContact NH2-O 3.11Å; L76-A173 HydrophobicContact CD1-CB 4.22Å; I147-A173 HydrophobicContact CG2-CB 3.5Å; I147-A173 VanDerWaalsContact CG2-CB 3.5Å; I148-A173 CarbonylContact O-C 3.57Å; I148-A173 WeakPolarHBondContact O-CA 3.43Å; I148-A173 WeakPolarHBondContact O-CB 3.29Å; F170-A173 HydrophobicContact CB-CB 4.15Å; F170-A173 VanDerWaalsContact O-CB 3.24Å; F170-A173 WeakPolarHBondContact O-CB 3.31Å; F170-A173 PolarHBondContact O-N 2.98Å
174	R	57.7	Low	56.9	Low	56 Å²	56	52.9 Å²	52.9	21%	0.211	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	153.2	172.5	-74.5	-63.4	177.7	-96	6.8	110.9	R72 I148 T178 E343	R72-R174 VanDerWaalsContact NH2-N 3.12Å; I148-R174 PolarHBondContact N-O 2.93Å; I148-R174 PolarHBondContact O-N 2.92Å; R174-T178 WeakPolarHBondContact CB-OG1 3.33Å; R174-T178 WeakPolarHBondContact CD-OG1 3.45Å; R174-T178 WeakPolarHBondContact CG-OG1 3.44Å; R174-E343 VanDerWaalsContact CD-OE2 3.29Å; R174-E343 WeakPolarHBondContact CD-OE2 3.26Å
175	T	49.4	Very low	53.9	Low	19 Å²	19	58.6 Å²	58.6	12%	0.117	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	142.7	160.3	39.8	0	0	0	0	109	G146 C177 T178 A340 E343	G146-T175 VanDerWaalsContact O-CA 3.26Å; G146-T175 WeakPolarHBondContact O-CA 3.39Å; T175-C177 PolarHBondContact O-N 3.06Å; T175-T178 PolarHBondContact O-N 2.97Å; T175-T178 PolarHBondContact O-OG1 2.79Å; T175-A340 HydrophobicContact CG2-CB 4.48Å; T175-E343 VanDerWaalsContact N-CD 3.27Å; T175-E343 PolarHBondContact N-OE1 2.96Å; T175-E343 PolarHBondContact N-OE2 3Å; T175-E343 VanDerWaalsContact N-OE2 3.09Å; T175-E343 PolarHBondContact OG1-OE1 2.91Å; T175-E343 PolarHBondContact OG1-OE2 3.26Å
176	A	38.7	Very low	51.1	Low	40 Å²	40	65.5 Å²	65.5	33%	0.331	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-16.2	-175.6	0	0	0	0	0	114.5	G146 I148	G146-A176 PolarHBondContact O-N 3.28Å; I148-A176 HydrophobicContact CD1-CB 3.83Å; I148-A176 HydrophobicContact CG1-CB 4.43Å
177	C	29.2	Very low	49.6	Very low	110 Å²	110	67 Å²	67	74%	0.743	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-4.2	-177.3	-66.4	0	0	0	0	115.8	T175	T175-C177 PolarHBondContact O-N 3.06Å
178	T	37.1	Very low	48.5	Very low	18 Å²	18	70.1 Å²	70.1	11%	0.11	38%	0.38	C	S	.	.			trans	-104.4	106.7	-171	59.7	0	0	0	0	114.5	R174 T175 F180 Y202	R174-T178 WeakPolarHBondContact CB-OG1 3.33Å; R174-T178 WeakPolarHBondContact CD-OG1 3.45Å; R174-T178 WeakPolarHBondContact CG-OG1 3.44Å; T175-T178 PolarHBondContact O-N 2.97Å; T175-T178 PolarHBondContact O-OG1 2.79Å; T178-F180 PolarHBondContact O-N 3.22Å; T178-Y202 PolarHBondContact O-OH 3.15Å
179	N	36.1	Very low	48.4	Very low	129 Å²	129	69.7 Å²	69.7	69%	0.69	38%	0.376	S	S	*	.			trans	-88.3	56.3	176.3	-84.9	-18.2	0	0	0	113.4
180	F	32.4	Very low	49.4	Very low	161 Å²	161	72.3 Å²	72.3	71%	0.706	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-94.4	132.5	-179.6	-108.2	-89.5	0	0	0	114	T178	T178-F180 PolarHBondContact O-N 3.22Å
181	M	31.3	Very low	50.6	Low	176 Å²	176	73.1 Å²	73.1	87%	0.867	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-62.2	133.6	172.2	-74.1	-176.1	-111.2	0	0	111.4
182	M	35.6	Very low	52.4	Low	62 Å²	62	73.6 Å²	73.6	31%	0.305	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-72.4	134.2	171.6	-92.3	-167.7	147.1	0	0	111.3	L172 R192 V196	L172-M182 HydrophobicContact CD1-CE 4.18Å; L172-M182 HydrophobicContact CD2-CE 4.44Å; M182-R192 VanDerWaalsContact SD-CZ 3.57Å; M182-R192 PolarHBondContact SD-NH1 3.33Å; M182-V196 HydrophobicContact SD-CG1 4.3Å
183	T	30.7	Very low	54.2	Low	92 Å²	92	72.6 Å²	72.6	56%	0.564	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-66.5	134.8	160.7	40.7	0	0	0	0	110.3	Y185	T183-Y185 PolarHBondContact O-N 3.43Å
184	P	29.1	Very low	56.1	Low	106 Å²	106	72.6 Å²	72.6	69%	0.688	39%	0.385	S	S	*	.			trans	-71.6	92.2	175.4	28.7	-31.9	0	0	0	110	Y230	P184-Y230 HydrophobicContact CB-CE2 4.25Å
185	Y	31.6	Very low	57.8	Low	160 Å²	160	70 Å²	70	63%	0.627	38%	0.375	S	S	*	.			trans	-104	142.6	163.6	-86.5	-89.7	0	0	0	109.5	T183 V187	T183-Y185 PolarHBondContact O-N 3.43Å; Y185-V187 PolarHBondContact O-N 2.84Å
186	V	39.3	Very low	59.8	Low	147 Å²	147	70.4 Å²	70.4	89%	0.891	38%	0.377	S	S	*	.	S	Bend	trans	-65.9	80.4	178.5	-174.8	0	0	0	0	109.3
187	V	64.2	Low	62.3	Low	52 Å²	52	69.4 Å²	69.4	32%	0.315	37%	0.366	S	S	.	.			trans	-127.5	144.9	175.5	-175.4	0	0	0	0	107.2	Y185 R189	Y185-V187 PolarHBondContact O-N 2.84Å; V187-R189 PolarHBondContact O-N 3.49Å; V187-R189 VanDerWaalsContact O-N 3.08Å
188	T	73.2	Confident	65.3	Low	65 Å²	65	64.9 Å²	64.9	40%	0.399	34%	0.335	S	S	.	.			trans	-48.7	114.8	175.9	-49.6	0	0	0	0	110.6	Y190 Y191	T188-Y190 HydrophobicContact CG2-CD2 3.37Å; T188-Y190 HydrophobicContact CG2-CE2 3.74Å; T188-Y190 HydrophobicContact CG2-CG 3.88Å; T188-Y191 HydrophobicContact CG2-CD2 4.46Å; T188-Y191 HydrophobicContact CG2-CE2 4.04Å
189	R	88.5	Confident	67.7	Low	31 Å²	31	66.5 Å²	66.5	12%	0.117	36%	0.355	C	S	.	.			trans	-103.4	-1.2	-175.7	69.6	-176.1	64.5	81.3	-2.2	114	V187 Y191 R192 G227 R228 Q233	V187-R189 PolarHBondContact O-N 3.49Å; V187-R189 VanDerWaalsContact O-N 3.08Å; R189-Y191 PolarHBondContact O-N 3.05Å; R189-Y191 VanDerWaalsContact O-N 3.09Å; R189-R192 WeakPolarHBondContact O-CB 3.23Å; R189-R192 PolarHBondContact O-N 2.98Å; R189-G227 PolarHBondContact NH1-O 3.05Å; R189-R228 PolarHBondContact NH1-O 3.1Å; R189-Q233 HydrophobicContact CG-CB 4.4Å; R189-Q233 HydrophobicContact CG-CG 4.21Å
190	Y	95	Very high	70.3	Confident	71 Å²	71	61.6 Å²	61.6	28%	0.278	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-27.4	-166.2	-52.4	-31	0	0	0	114.3	T188 V223 F225 G227 Q233	T188-Y190 HydrophobicContact CG2-CD2 3.37Å; T188-Y190 HydrophobicContact CG2-CE2 3.74Å; T188-Y190 HydrophobicContact CG2-CG 3.88Å; Y190-V223 HydrophobicContact CD2-CB 4.44Å; Y190-V223 HydrophobicContact CD2-CG1 3.6Å; Y190-V223 HydrophobicContact CD2-CG2 4.07Å; Y190-V223 HydrophobicContact CE2-CG1 4.38Å; Y190-V223 HydrophobicContact CG-CG1 3.7Å; Y190-F225 WeakPolarHBondContact CD1-O 3.45Å; Y190-G227 WeakPolarHBondContact CE1-O 3.47Å; Y190-Q233 PolarHBondContact O-NE2 3.17Å
191	Y	95.6	Very high	72.9	Confident	18 Å²	18	56.1 Å²	56.1	7%	0.071	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-1.1	-177.9	-47	-84.7	0	0	0	113	L152 K153 P154 T188 R189 W209 S210 C213 I214 E217	L152-Y191 WeakPolarHBondContact O-CB 3.31Å; K153-Y191 HydrophobicContact CB-CD2 3.4Å; K153-Y191 HydrophobicContact CB-CE2 3.77Å; K153-Y191 HydrophobicContact CB-CG 4.02Å; P154-Y191 VanDerWaalsContact CD-CE1 3.44Å; P154-Y191 VanDerWaalsContact CD-CE2 3.49Å; P154-Y191 WeakPolarHBondContact CD-OH 3.42Å; P154-Y191 HydrophobicContact CG-CE1 3.84Å; P154-Y191 HydrophobicContact CG-CE2 4.44Å; P154-Y191 WeakPolarHBondContact CG-OH 3.36Å; T188-Y191 HydrophobicContact CG2-CD2 4.46Å; T188-Y191 HydrophobicContact CG2-CE2 4.04Å; R189-Y191 PolarHBondContact O-N 3.05Å; R189-Y191 VanDerWaalsContact O-N 3.09Å; Y191-W209 VanDerWaalsContact O-CD1 3.31Å; Y191-S210 WeakPolarHBondContact O-CA 3.03Å; Y191-S210 PolarHBondContact O-OG 3.21Å; Y191-S210 VanDerWaalsContact O-OG 3.05Å; Y191-C213 HydrophobicContact CD1-CB 3.72Å; Y191-C213 HydrophobicContact CE1-CB 4.47Å; Y191-I214 HydrophobicContact CD1-CG1 3.88Å; Y191-I214 HydrophobicContact CE1-CG1 4.11Å; Y191-E217 WeakPolarHBondContact CE1-OE2 3.48Å; Y191-E217 PolarHBondContact OH-OE2 3.34Å
192	R	93.4	Very high	75.6	Confident	11 Å²	11	49 Å²	49	4%	0.042	28%	0.28	C	S	.	.			trans	-74.2	136.7	-179.1	-67.6	-175.6	179.8	167.7	2.7	110.5	D151 M182 R189 V196 I197 W209 Y230	D151-R192 IonicContact OD1-CZ 3.61Å; D151-R192 IonicContact OD1-NE 3.02Å; D151-R192 PolarHBondContact OD1-NE 2.79Å; D151-R192 IonicContact OD1-NH2 3.75Å; D151-R192 PolarHBondContact OD1-NH2 3.46Å; M182-R192 VanDerWaalsContact SD-CZ 3.57Å; M182-R192 PolarHBondContact SD-NH1 3.33Å; R189-R192 WeakPolarHBondContact O-CB 3.23Å; R189-R192 PolarHBondContact O-N 2.98Å; R192-V196 HydrophobicContact CB-CB 4.5Å; R192-V196 HydrophobicContact CB-CG1 4.44Å; R192-I197 HydrophobicContact CB-CD1 4.46Å; R192-I197 HydrophobicContact CB-CG1 4.2Å; R192-I197 WeakPolarHBondContact O-CD1 3.41Å; R192-W209 PolarHBondContact O-NE1 2.94Å; R192-W209 VanDerWaalsContact O-NE1 3.14Å; R192-Y230 PolarHBondContact NH1-OH 3.06Å
193	A	95.5	Very high	78.2	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.008	28%	0.28	C	S	.	.			trans	-67	153.9	179.3	0	0	0	0	0	112.7	E195 V196 I197 V206 W209	A193-E195 VanDerWaalsContact C-N 3.27Å; A193-E195 HydrophobicContact CB-CG 4.18Å; A193-E195 WeakPolarHBondContact CB-OE1 3.3Å; A193-E195 WeakPolarHBondContact CB-OE2 3.42Å; A193-E195 PolarHBondContact O-N 3.17Å; A193-V196 HydrophobicContact CB-CG2 4.39Å; A193-V196 WeakPolarHBondContact O-CB 3.49Å; A193-V196 PolarHBondContact O-N 3.26Å; A193-I197 PolarHBondContact O-N 3.03Å; A193-V206 HydrophobicContact CB-CG2 3.56Å; A193-W209 HydrophobicContact CB-CB 3.73Å; A193-W209 HydrophobicContact CB-CD2 4.42Å; A193-W209 HydrophobicContact CB-CG 3.72Å
194	P	95.1	Very high	81.1	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-49.6	-44.8	175.5	-35.2	41.4	0	0	0	114	V196 I197 L198 W209 W234 V237 I304	P194-V196 PolarHBondContact O-N 2.77Å; P194-I197 PolarHBondContact O-N 3.2Å; P194-L198 VanDerWaalsContact O-CB 3.29Å; P194-L198 WeakPolarHBondContact O-CB 3.45Å; P194-L198 VanDerWaalsContact O-CG 3.26Å; P194-L198 WeakPolarHBondContact O-CG 3.36Å; P194-L198 PolarHBondContact O-N 3.5Å; P194-W209 VanDerWaalsContact CD-CD2 3.47Å; P194-W209 HydrophobicContact CG-CD2 4.35Å; P194-W209 HydrophobicContact CG-CE3 4.11Å; P194-W209 HydrophobicContact CG-CH2 3.65Å; P194-W209 HydrophobicContact CG-CZ2 3.92Å; P194-W209 HydrophobicContact CG-CZ3 3.76Å; P194-W234 HydrophobicContact CB-CZ3 3.98Å; P194-W234 HydrophobicContact CG-CZ3 4.48Å; P194-V237 HydrophobicContact CG-CG1 4.49Å; P194-I304 HydrophobicContact CB-CG2 4.08Å; P194-I304 HydrophobicContact CG-CB 4.48Å; P194-I304 HydrophobicContact CG-CG1 4.49Å; P194-I304 HydrophobicContact CG-CG2 4.16Å
195	E	93.8	Very high	84.3	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.4	-32.2	178.9	59.5	-88.6	-154.3	0	0	112.6	A193 G199 M200 V206 R309	A193-E195 VanDerWaalsContact C-N 3.27Å; A193-E195 HydrophobicContact CB-CG 4.18Å; A193-E195 WeakPolarHBondContact CB-OE1 3.3Å; A193-E195 WeakPolarHBondContact CB-OE2 3.42Å; A193-E195 PolarHBondContact O-N 3.17Å; E195-G199 PolarHBondContact O-N 3.3Å; E195-M200 HydrophobicContact CB-CB 3.88Å; E195-M200 HydrophobicContact CB-CG 4.46Å; E195-M200 HydrophobicContact CB-SD 4.06Å; E195-M200 PolarHBondContact O-N 3.43Å; E195-V206 HydrophobicContact CG-CG2 4.27Å; E195-R309 IonicContact OE1-CZ 2.9Å; E195-R309 IonicContact OE1-NH1 3.39Å; E195-R309 PolarHBondContact OE1-NH1 3.32Å; E195-R309 IonicContact OE1-NH2 2.79Å; E195-R309 PolarHBondContact OE1-NH2 3.06Å; E195-R309 IonicContact OE2-CZ 3.48Å; E195-R309 IonicContact OE2-NH1 2.68Å; E195-R309 IonicContact OE2-NH2 2.65Å; E195-R309 PolarHBondContact OE2-NH2 3.42Å
196	V	90.9	Very high	87.3	Confident	28 Å²	28	36.5 Å²	36.5	17%	0.17	21%	0.21	C	C	.	.	H	α-helix	trans	-74.6	-43.2	174.9	-179.4	0	0	0	0	110.7	M182 R192 A193 P194 L198 G199 V206	M182-V196 HydrophobicContact SD-CG1 4.3Å; R192-V196 HydrophobicContact CB-CB 4.5Å; R192-V196 HydrophobicContact CB-CG1 4.44Å; A193-V196 HydrophobicContact CB-CG2 4.39Å; A193-V196 WeakPolarHBondContact O-CB 3.49Å; A193-V196 PolarHBondContact O-N 3.26Å; P194-V196 PolarHBondContact O-N 2.77Å; V196-L198 VanDerWaalsContact C-N 3.33Å; V196-L198 PolarHBondContact O-N 3.3Å; V196-G199 PolarHBondContact O-N 3.09Å; V196-V206 HydrophobicContact CG2-CG2 3.48Å; V196-V206 VanDerWaalsContact CG2-CG2 3.48Å
197	I	90.9	Very high	90	Very high	20 Å²	20	29.5 Å²	29.5	10%	0.103	17%	0.168	C	C	.	.	H	α-helix	trans	-64.4	-39.2	179.1	-67.9	161.2	0	0	0	111.2	R192 A193 P194 Y230 Q233	R192-I197 HydrophobicContact CB-CD1 4.46Å; R192-I197 HydrophobicContact CB-CG1 4.2Å; R192-I197 WeakPolarHBondContact O-CD1 3.41Å; A193-I197 PolarHBondContact O-N 3.03Å; P194-I197 PolarHBondContact O-N 3.2Å; I197-Y230 HydrophobicContact CG1-CD1 4.37Å; I197-Y230 HydrophobicContact CG2-CD1 4.14Å; I197-Q233 HydrophobicContact CD1-CB 4.43Å; I197-Q233 HydrophobicContact CD1-CG 3.44Å; I197-Q233 VanDerWaalsContact CD1-CG 3.44Å; I197-Q233 HydrophobicContact CG1-CG 4.32Å
198	L	91.7	Very high	91.7	Very high	15 Å²	15	27 Å²	27	8%	0.079	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	0.7	-176.5	-62	176.7	0	0	0	113.5	P194 V196 M200 W234 F248 L252 V256 V260	P194-L198 VanDerWaalsContact O-CB 3.29Å; P194-L198 WeakPolarHBondContact O-CB 3.45Å; P194-L198 VanDerWaalsContact O-CG 3.26Å; P194-L198 WeakPolarHBondContact O-CG 3.36Å; P194-L198 PolarHBondContact O-N 3.5Å; V196-L198 VanDerWaalsContact C-N 3.33Å; V196-L198 PolarHBondContact O-N 3.3Å; L198-M200 VanDerWaalsContact C-N 3.32Å; L198-M200 HydrophobicContact CB-CG 4.15Å; L198-M200 HydrophobicContact CB-SD 4.34Å; L198-M200 HydrophobicContact CD1-SD 4.42Å; L198-M200 PolarHBondContact O-N 3.17Å; L198-W234 HydrophobicContact CD1-CD2 4.46Å; L198-W234 HydrophobicContact CD1-CE3 4.03Å; L198-W234 HydrophobicContact CD1-CH2 3.84Å; L198-W234 HydrophobicContact CD1-CZ2 4.27Å; L198-W234 HydrophobicContact CD1-CZ3 3.74Å; L198-W234 HydrophobicContact CD2-CD2 4.07Å; L198-W234 HydrophobicContact CD2-CE3 4.2Å; L198-W234 HydrophobicContact CD2-CG 4.39Å; L198-W234 HydrophobicContact CG-CE3 4.25Å; L198-W234 HydrophobicContact CG-CZ3 4.42Å; L198-F248 HydrophobicContact CD1-CE1 4Å; L198-F248 HydrophobicContact CD1-CZ 3.91Å; L198-L252 HydrophobicContact CB-CD2 4.07Å; L198-L252 HydrophobicContact CD1-CD2 3.81Å; L198-V256 HydrophobicContact CB-CG1 4.09Å; L198-V256 HydrophobicContact CD2-CG1 3.83Å; L198-V256 HydrophobicContact CG-CG1 4.5Å; L198-V260 HydrophobicContact CD2-CG2 3.95Å
199	G	88	Confident	92.9	Very high	51 Å²	51	23.9 Å²	23.9	53%	0.526	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	32.3	178.4	0	0	0	0	0	113.9	E195 V196	E195-G199 PolarHBondContact O-N 3.3Å; V196-G199 PolarHBondContact O-N 3.09Å
200	M	90.7	Very high	93.3	Very high	27 Å²	27	22.5 Å²	22.5	13%	0.133	13%	0.129	C	C	.	.			trans	-82	164	172.8	-56.9	170.2	68.8	0	0	110.3	E195 L198 F248 K251 L252	E195-M200 HydrophobicContact CB-CB 3.88Å; E195-M200 HydrophobicContact CB-CG 4.46Å; E195-M200 HydrophobicContact CB-SD 4.06Å; E195-M200 PolarHBondContact O-N 3.43Å; L198-M200 VanDerWaalsContact C-N 3.32Å; L198-M200 HydrophobicContact CB-CG 4.15Å; L198-M200 HydrophobicContact CB-SD 4.34Å; L198-M200 HydrophobicContact CD1-SD 4.42Å; L198-M200 PolarHBondContact O-N 3.17Å; M200-F248 HydrophobicContact CE-CD2 4.37Å; M200-F248 HydrophobicContact CE-CE2 3.83Å; M200-F248 HydrophobicContact CE-CZ 4.22Å; M200-F248 HydrophobicContact SD-CE2 3.85Å; M200-F248 HydrophobicContact SD-CZ 3.7Å; M200-K251 HydrophobicContact CE-CB 3.79Å; M200-K251 HydrophobicContact CE-CD 4.5Å; M200-L252 HydrophobicContact CE-CD2 4.12Å; M200-L252 HydrophobicContact CG-CD2 3.61Å; M200-L252 HydrophobicContact SD-CD2 3.36Å; M200-L252 WeakPolarHBondContact SD-CD2 3.47Å
201	G	87.2	Confident	93.5	Very high	45 Å²	45	19.1 Å²	19.1	46%	0.464	12%	0.115	S	C	.	.			trans	-62.2	147.9	160.4	0	0	0	0	0	110.2
202	Y	87.7	Confident	93.6	Very high	28 Å²	28	18.2 Å²	18.2	11%	0.11	11%	0.112	C	C	.	.			trans	-128.9	161.9	-179.4	57.2	-97.9	0	0	0	110.4	I148 R150 T178 V206	I148-Y202 HydrophobicContact CD1-CD2 4.08Å; I148-Y202 HydrophobicContact CD1-CE2 4.04Å; R150-Y202 VanDerWaalsContact CD-CE2 3.47Å; R150-Y202 WeakPolarHBondContact CD-OH 3.41Å; R150-Y202 HydrophobicContact CG-CE2 4.33Å; R150-Y202 PolarHBondContact NH1-OH 3.34Å; T178-Y202 PolarHBondContact O-OH 3.15Å; Y202-V206 HydrophobicContact CD2-CG1 4.39Å
203	K	89.8	Confident	93.8	Very high	69 Å²	69	17.8 Å²	17.8	30%	0.3	11%	0.111	S	C	.	.			trans	-128.2	-178.3	174.3	68	-170	-179.9	-171.6	0	109.6	N205 V206 P306 D307	K203-N205 VanDerWaalsContact CE-CG 3.47Å; K203-N205 VanDerWaalsContact CE-ND2 3.33Å; K203-N205 WeakPolarHBondContact CE-ND2 3.17Å; K203-N205 WeakPolarHBondContact CE-OD1 3.3Å; K203-N205 WeakPolarHBondContact CG-OD1 3.43Å; K203-N205 PolarHBondContact O-N 3Å; K203-N205 VanDerWaalsContact O-N 3.14Å; K203-V206 VanDerWaalsContact O-CB 3.3Å; K203-V206 WeakPolarHBondContact O-CB 3.2Å; K203-V206 VanDerWaalsContact O-CG1 3.23Å; K203-V206 WeakPolarHBondContact O-CG1 3.31Å; K203-V206 PolarHBondContact O-N 3.11Å; K203-P306 WeakPolarHBondContact CE-O 3.37Å; K203-P306 PolarHBondContact NZ-O 3.09Å; K203-D307 IonicContact NZ-OD1 2.57Å; K203-D307 PolarHBondContact NZ-OD1 3.1Å
204	E	92	Very high	93.9	Very high	78 Å²	78	17.8 Å²	17.8	36%	0.364	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-40.1	-174.8	-68.2	84	-178.9	0	0	113.2	H143 I148 V206 D207	H143-E204 HydrophobicContact CB-CG 4.18Å; H143-E204 PolarHBondContact CE1-O 3.41Å; H143-E204 PolarHBondContact NE2-O 2.81Å; I148-E204 HydrophobicContact CD1-CG 4.37Å; I148-E204 HydrophobicContact CG1-CG 4.36Å; E204-V206 PolarHBondContact O-N 2.94Å; E204-D207 PolarHBondContact O-N 2.88Å
205	N	95.9	Very high	94.1	Very high	8 Å²	8	17.8 Å²	17.8	4%	0.043	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	6.8	-179.5	77.3	-12.3	0	0	0	115	K203 D207 I208 P306 R309	K203-N205 VanDerWaalsContact CE-CG 3.47Å; K203-N205 VanDerWaalsContact CE-ND2 3.33Å; K203-N205 WeakPolarHBondContact CE-ND2 3.17Å; K203-N205 WeakPolarHBondContact CE-OD1 3.3Å; K203-N205 WeakPolarHBondContact CG-OD1 3.43Å; K203-N205 PolarHBondContact O-N 3Å; K203-N205 VanDerWaalsContact O-N 3.14Å; N205-D207 PolarHBondContact O-N 2.86Å; N205-I208 HydrophobicContact CB-CB 4.35Å; N205-I208 HydrophobicContact CB-CG1 4.24Å; N205-I208 WeakPolarHBondContact O-CB 3.49Å; N205-I208 PolarHBondContact O-N 2.96Å; N205-P306 PolarHBondContact ND2-O 2.95Å; N205-R309 PolarHBondContact ND2-O 3.01Å; N205-R309 VanDerWaalsContact ND2-O 3.13Å; N205-R309 WeakPolarHBondContact O-CD 3.47Å; N205-R309 PolarHBondContact O-NH1 3.04Å
206	V	95.5	Very high	94.2	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.006	11%	0.11	C	C	.	.	H	α-helix	trans	-58.9	-35.4	162.8	72.4	0	0	0	0	111.4	I148 R150 A193 E195 V196 Y202 K203 E204 I208 W209	I148-V206 HydrophobicContact CG2-CG1 3.24Å; R150-V206 HydrophobicContact CG-CG1 4.29Å; A193-V206 HydrophobicContact CB-CG2 3.56Å; E195-V206 HydrophobicContact CG-CG2 4.27Å; V196-V206 HydrophobicContact CG2-CG2 3.48Å; V196-V206 VanDerWaalsContact CG2-CG2 3.48Å; Y202-V206 HydrophobicContact CD2-CG1 4.39Å; K203-V206 VanDerWaalsContact O-CB 3.3Å; K203-V206 WeakPolarHBondContact O-CB 3.2Å; K203-V206 VanDerWaalsContact O-CG1 3.23Å; K203-V206 WeakPolarHBondContact O-CG1 3.31Å; K203-V206 PolarHBondContact O-N 3.11Å; E204-V206 PolarHBondContact O-N 2.94Å; V206-I208 VanDerWaalsContact C-N 3.31Å; V206-I208 PolarHBondContact O-N 3.11Å; V206-W209 PolarHBondContact O-N 3.49Å
207	D	96.5	Very high	94.5	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-72.1	-28.3	179	-70.5	-32.2	0	0	0	111.4	I139 H143 H149 R150 L152 E204 N205 W209 S210 V211	I139-D207 HydrophobicContact CD1-CB 4.39Å; I139-D207 HydrophobicContact CG2-CB 3.97Å; H143-D207 IonicContact CD2-OD2 3.52Å; H143-D207 IonicContact CE1-OD2 3.82Å; H143-D207 IonicContact NE2-OD2 3.97Å; H143-D207 PolarHBondContact NE2-OD2 2.92Å; H149-D207 PolarHBondContact N-OD2 2.84Å; R150-D207 PolarHBondContact N-OD1 3.07Å; L152-D207 HydrophobicContact CD1-CB 3.83Å; E204-D207 PolarHBondContact O-N 2.88Å; N205-D207 PolarHBondContact O-N 2.86Å; D207-W209 VanDerWaalsContact C-N 3.33Å; D207-W209 PolarHBondContact O-N 3.1Å; D207-S210 VanDerWaalsContact O-CB 3.31Å; D207-S210 WeakPolarHBondContact O-CB 3.01Å; D207-S210 PolarHBondContact O-N 2.77Å; D207-S210 VanDerWaalsContact O-N 3.1Å; D207-V211 WeakPolarHBondContact O-CG2 3.06Å; D207-V211 PolarHBondContact O-N 3.31Å
208	I	98.5	Very high	94.7	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-64	-36.5	175.4	-69.6	-69.2	0	0	0	112.2	L136 N205 V206 S210 V211 G212 M301 R309 I310 V312 A315	L136-I208 HydrophobicContact CD2-CD1 3.46Å; L136-I208 VanDerWaalsContact CD2-CD1 3.46Å; N205-I208 HydrophobicContact CB-CB 4.35Å; N205-I208 HydrophobicContact CB-CG1 4.24Å; N205-I208 WeakPolarHBondContact O-CB 3.49Å; N205-I208 PolarHBondContact O-N 2.96Å; V206-I208 VanDerWaalsContact C-N 3.31Å; V206-I208 PolarHBondContact O-N 3.11Å; I208-S210 VanDerWaalsContact C-N 3.27Å; I208-S210 PolarHBondContact O-N 3.11Å; I208-V211 PolarHBondContact O-N 2.8Å; I208-G212 PolarHBondContact O-N 3.47Å; I208-M301 HydrophobicContact CG2-CB 3.96Å; I208-M301 HydrophobicContact CG2-CG 3.77Å; I208-R309 HydrophobicContact CG2-CG 4.04Å; I208-I310 HydrophobicContact CG2-CG2 3.73Å; I208-V312 HydrophobicContact CD1-CB 4.37Å; I208-V312 HydrophobicContact CD1-CG2 3.81Å; I208-V312 HydrophobicContact CG1-CG2 3.86Å; I208-A315 HydrophobicContact CD1-CB 4.21Å
209	W	98.4	Very high	94.9	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-60.2	-42.8	172.8	173.8	-83.1	0	0	0	111.4	Y191 R192 A193 P194 V206 D207 V211 G212 C213 F225 V237 L241 I304	Y191-W209 VanDerWaalsContact O-CD1 3.31Å; R192-W209 PolarHBondContact O-NE1 2.94Å; R192-W209 VanDerWaalsContact O-NE1 3.14Å; A193-W209 HydrophobicContact CB-CB 3.73Å; A193-W209 HydrophobicContact CB-CD2 4.42Å; A193-W209 HydrophobicContact CB-CG 3.72Å; P194-W209 VanDerWaalsContact CD-CD2 3.47Å; P194-W209 HydrophobicContact CG-CD2 4.35Å; P194-W209 HydrophobicContact CG-CE3 4.11Å; P194-W209 HydrophobicContact CG-CH2 3.65Å; P194-W209 HydrophobicContact CG-CZ2 3.92Å; P194-W209 HydrophobicContact CG-CZ3 3.76Å; V206-W209 PolarHBondContact O-N 3.49Å; D207-W209 VanDerWaalsContact C-N 3.33Å; D207-W209 PolarHBondContact O-N 3.1Å; W209-V211 VanDerWaalsContact C-N 3.34Å; W209-V211 PolarHBondContact O-N 3.31Å; W209-G212 PolarHBondContact O-N 2.87Å; W209-C213 PolarHBondContact NE1-SG 2.84Å; W209-C213 PolarHBondContact O-N 3.45Å; W209-C213 PolarHBondContact O-SG 3.26Å; W209-C213 VanDerWaalsContact O-SG 3.34Å; W209-F225 HydrophobicContact CH2-CE2 4.06Å; W209-F225 HydrophobicContact CH2-CZ 4.39Å; W209-F225 HydrophobicContact CZ2-CD2 4.05Å; W209-F225 AromaticContact CZ2-CE2 3.55Å; W209-F225 HydrophobicContact CZ2-CE2 3.55Å; W209-F225 HydrophobicContact CZ2-CZ 4.29Å; W209-V237 HydrophobicContact CH2-CG1 3.77Å; W209-V237 HydrophobicContact CH2-CG2 4.37Å; W209-V237 HydrophobicContact CZ2-CG1 4.23Å; W209-V237 HydrophobicContact CZ2-CG2 3.99Å; W209-L241 HydrophobicContact CH2-CD1 3.58Å; W209-L241 HydrophobicContact CZ3-CD1 3.91Å; W209-I304 HydrophobicContact CZ3-CG1 4.44Å
210	S	97.5	Very high	95.2	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.007	8%	0.081	C	C	.	.	H	α-helix	trans	-62.6	-44	179.5	-49.6	0	0	0	0	110.5	Y191 D207 I208 G212 C213 I214	Y191-S210 WeakPolarHBondContact O-CA 3.03Å; Y191-S210 PolarHBondContact O-OG 3.21Å; Y191-S210 VanDerWaalsContact O-OG 3.05Å; D207-S210 VanDerWaalsContact O-CB 3.31Å; D207-S210 WeakPolarHBondContact O-CB 3.01Å; D207-S210 PolarHBondContact O-N 2.77Å; D207-S210 VanDerWaalsContact O-N 3.1Å; I208-S210 VanDerWaalsContact C-N 3.27Å; I208-S210 PolarHBondContact O-N 3.11Å; S210-G212 PolarHBondContact O-N 3.31Å; S210-C213 PolarHBondContact O-N 2.96Å; S210-I214 VanDerWaalsContact O-CG1 3.29Å; S210-I214 WeakPolarHBondContact O-CG1 3.42Å; S210-I214 PolarHBondContact O-N 3.39Å
211	V	98.4	Very high	95.3	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-60.9	-42.8	173.6	-179.9	0	0	0	0	111.3	L132 I139 L152 D207 I208 W209 C213 I214 M215 M301	L132-V211 HydrophobicContact CD2-CG1 3.61Å; I139-V211 HydrophobicContact CD1-CG2 3.34Å; L152-V211 HydrophobicContact CD1-CG2 4.45Å; D207-V211 WeakPolarHBondContact O-CG2 3.06Å; D207-V211 PolarHBondContact O-N 3.31Å; I208-V211 PolarHBondContact O-N 2.8Å; W209-V211 VanDerWaalsContact C-N 3.34Å; W209-V211 PolarHBondContact O-N 3.31Å; V211-C213 VanDerWaalsContact C-N 3.33Å; V211-C213 PolarHBondContact O-N 3.11Å; V211-I214 PolarHBondContact O-N 2.96Å; V211-M215 WeakPolarHBondContact O-CB 3.11Å; V211-M215 PolarHBondContact O-N 2.9Å; V211-M301 HydrophobicContact CB-SD 4.42Å; V211-M301 HydrophobicContact CG1-CE 4.01Å; V211-M301 HydrophobicContact CG1-SD 4.01Å
212	G	98.5	Very high	95.7	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-60	-40.9	175.7	0	0	0	0	0	112.8	I208 W209 S210 M215 A216	I208-G212 PolarHBondContact O-N 3.47Å; W209-G212 PolarHBondContact O-N 2.87Å; S210-G212 PolarHBondContact O-N 3.31Å; G212-M215 PolarHBondContact O-N 3.24Å; G212-A216 VanDerWaalsContact O-CB 3.31Å; G212-A216 WeakPolarHBondContact O-CB 3.23Å; G212-A216 PolarHBondContact O-N 3.07Å
213	C	98.4	Very high	96	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.014	11%	0.105	C	C	.	.	H	α-helix	trans	-66.3	-40.5	175.5	-67.2	0	0	0	0	112	Y191 W209 S210 V211 A216 E217	Y191-C213 HydrophobicContact CD1-CB 3.72Å; Y191-C213 HydrophobicContact CE1-CB 4.47Å; W209-C213 PolarHBondContact NE1-SG 2.84Å; W209-C213 PolarHBondContact O-N 3.45Å; W209-C213 PolarHBondContact O-SG 3.26Å; W209-C213 VanDerWaalsContact O-SG 3.34Å; S210-C213 PolarHBondContact O-N 2.96Å; V211-C213 VanDerWaalsContact C-N 3.33Å; V211-C213 PolarHBondContact O-N 3.11Å; C213-A216 PolarHBondContact O-N 3Å; C213-E217 WeakPolarHBondContact O-CB 3.18Å; C213-E217 PolarHBondContact O-N 3.14Å
214	I	97.4	Very high	96.4	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-64.3	-46.3	175.8	-68.8	163.3	0	0	0	110.5	L115 M135 P154 I157 Y191 S210 V211 A216 E217 M218	L115-I214 HydrophobicContact CD2-CG2 3.47Å; L115-I214 VanDerWaalsContact CD2-CG2 3.47Å; M135-I214 HydrophobicContact CE-CG2 4.18Å; M135-I214 HydrophobicContact SD-CD1 4.5Å; M135-I214 HydrophobicContact SD-CG2 4.23Å; P154-I214 HydrophobicContact CG-CG1 4.13Å; I157-I214 HydrophobicContact CD1-CD1 3.58Å; Y191-I214 HydrophobicContact CD1-CG1 3.88Å; Y191-I214 HydrophobicContact CE1-CG1 4.11Å; S210-I214 VanDerWaalsContact O-CG1 3.29Å; S210-I214 WeakPolarHBondContact O-CG1 3.42Å; S210-I214 PolarHBondContact O-N 3.39Å; V211-I214 PolarHBondContact O-N 2.96Å; I214-A216 VanDerWaalsContact C-N 3.33Å; I214-A216 PolarHBondContact O-N 3.18Å; I214-E217 PolarHBondContact O-N 2.8Å; I214-M218 HydrophobicContact CG2-CE 3.86Å; I214-M218 HydrophobicContact CG2-SD 4.43Å; I214-M218 WeakPolarHBondContact O-CG 3.28Å; I214-M218 PolarHBondContact O-N 2.7Å
215	M	97.8	Very high	96.6	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-60.6	-43.3	176.7	-177.1	176.6	177.6	0	0	111.5	L132 V211 G212 E217 M218 V219 A294 L297 L298 Y320	L132-M215 HydrophobicContact CD1-CB 4.45Å; L132-M215 HydrophobicContact CD1-CE 4.02Å; L132-M215 HydrophobicContact CD1-CG 3.86Å; L132-M215 HydrophobicContact CD1-SD 3.64Å; L132-M215 HydrophobicContact CD2-CB 3.85Å; L132-M215 HydrophobicContact CD2-CG 4.17Å; L132-M215 HydrophobicContact CD2-SD 4.28Å; V211-M215 WeakPolarHBondContact O-CB 3.11Å; V211-M215 PolarHBondContact O-N 2.9Å; G212-M215 PolarHBondContact O-N 3.24Å; M215-E217 VanDerWaalsContact C-N 3.3Å; M215-E217 PolarHBondContact O-N 3.44Å; M215-M218 WeakPolarHBondContact O-CB 3.45Å; M215-M218 PolarHBondContact O-N 3.41Å; M215-V219 PolarHBondContact O-N 2.97Å; M215-A294 HydrophobicContact CE-CB 3.77Å; M215-A294 VanDerWaalsContact CE-O 3.28Å; M215-A294 WeakPolarHBondContact CE-O 3.37Å; M215-L297 HydrophobicContact CE-CB 4.43Å; M215-L297 HydrophobicContact CE-CD2 4.37Å; M215-L297 HydrophobicContact SD-CD2 4.12Å; M215-L297 HydrophobicContact SD-CG 4.32Å; M215-L298 HydrophobicContact CB-CD2 3.91Å; M215-L298 HydrophobicContact CE-CD1 4.27Å; M215-L298 HydrophobicContact CE-CG 3.92Å; M215-L298 HydrophobicContact CG-CD2 3.75Å; M215-L298 HydrophobicContact CG-CG 4.08Å; M215-L298 HydrophobicContact SD-CD2 3.91Å; M215-L298 HydrophobicContact SD-CG 3.79Å; M215-Y320 HydrophobicContact CE-CD1 4.14Å; M215-Y320 HydrophobicContact CE-CE1 3.86Å
216	A	97.6	Very high	96.6	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-61.8	-40.4	176.1	0	0	0	0	0	111.8	G212 C213 I214 V219 L220 L224 F275 L298 L302	G212-A216 VanDerWaalsContact O-CB 3.31Å; G212-A216 WeakPolarHBondContact O-CB 3.23Å; G212-A216 PolarHBondContact O-N 3.07Å; C213-A216 PolarHBondContact O-N 3Å; I214-A216 VanDerWaalsContact C-N 3.33Å; I214-A216 PolarHBondContact O-N 3.18Å; A216-V219 WeakPolarHBondContact O-CG2 3.41Å; A216-V219 PolarHBondContact O-N 2.96Å; A216-L220 VanDerWaalsContact O-CB 3.25Å; A216-L220 WeakPolarHBondContact O-CB 3.28Å; A216-L220 VanDerWaalsContact O-CG 3.28Å; A216-L220 WeakPolarHBondContact O-CG 3.48Å; A216-L220 PolarHBondContact O-N 3.35Å; A216-L224 HydrophobicContact CB-CB 4.19Å; A216-L224 HydrophobicContact CB-CD1 4.47Å; A216-L224 HydrophobicContact CB-CD2 3.66Å; A216-L224 HydrophobicContact CB-CG 4.33Å; A216-F275 HydrophobicContact CB-CE1 3.62Å; A216-F275 HydrophobicContact CB-CZ 3.68Å; A216-L298 HydrophobicContact CB-CD2 4.02Å; A216-L302 HydrophobicContact CB-CD1 4.21Å
217	E	96.5	Very high	96.5	Very high	14 Å²	14	18.1 Å²	18.1	7%	0.065	9%	0.092	C	C	.	.	H	α-helix	trans	-69.5	-34.7	177.7	-174.8	172.6	-177.3	0	0	112.4	I119 Y191 C213 I214 M215 V219 H221 V223	I119-E217 HydrophobicContact CD1-CB 4.44Å; I119-E217 HydrophobicContact CD1-CG 4.03Å; I119-E217 HydrophobicContact CG2-CG 3.64Å; Y191-E217 WeakPolarHBondContact CE1-OE2 3.48Å; Y191-E217 PolarHBondContact OH-OE2 3.34Å; C213-E217 WeakPolarHBondContact O-CB 3.18Å; C213-E217 PolarHBondContact O-N 3.14Å; I214-E217 PolarHBondContact O-N 2.8Å; M215-E217 VanDerWaalsContact C-N 3.3Å; M215-E217 PolarHBondContact O-N 3.44Å; E217-V219 VanDerWaalsContact C-N 3.29Å; E217-V219 PolarHBondContact O-N 3.29Å; E217-H221 VanDerWaalsContact O-CA 3.27Å; E217-H221 WeakPolarHBondContact O-CA 3.13Å; E217-H221 PolarHBondContact O-N 3.42Å; E217-V223 WeakPolarHBondContact OE1-CG2 3.36Å
218	M	95.3	Very high	96.2	Very high	3 Å²	3	27.4 Å²	27.4	2%	0.015	13%	0.127	C	C	.	.	H	α-helix	trans	-60	-36.9	172.8	-72.6	172.3	170.5	0	0	112.8	L115 I119 L123 M128 L131 M135 I214 M215 H221	L115-M218 HydrophobicContact CD1-CE 3.62Å; L115-M218 HydrophobicContact CD2-CE 3.6Å; L115-M218 HydrophobicContact CG-CE 3.77Å; I119-M218 HydrophobicContact CG1-CG 3.84Å; L123-M218 HydrophobicContact CD1-CG 4.43Å; M128-M218 HydrophobicContact CG-SD 4.19Å; L131-M218 HydrophobicContact CD1-CE 4.22Å; M135-M218 HydrophobicContact CE-CE 4.04Å; I214-M218 HydrophobicContact CG2-CE 3.86Å; I214-M218 HydrophobicContact CG2-SD 4.43Å; I214-M218 WeakPolarHBondContact O-CG 3.28Å; I214-M218 PolarHBondContact O-N 2.7Å; M215-M218 WeakPolarHBondContact O-CB 3.45Å; M215-M218 PolarHBondContact O-N 3.41Å; M218-H221 PolarHBondContact O-CE1 3.31Å
219	V	94.5	Very high	95.8	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.018	15%	0.145	C	C	.	.	H	α-helix	trans	-88.9	-30	-179.5	-60.6	0	0	0	0	113	M128 M215 A216 E217 F275 I279 F280 L298	M128-V219 HydrophobicContact CE-CG1 3.66Å; M128-V219 HydrophobicContact SD-CG1 3.7Å; M215-V219 PolarHBondContact O-N 2.97Å; A216-V219 WeakPolarHBondContact O-CG2 3.41Å; A216-V219 PolarHBondContact O-N 2.96Å; E217-V219 VanDerWaalsContact C-N 3.29Å; E217-V219 PolarHBondContact O-N 3.29Å; V219-F275 HydrophobicContact CG2-CD1 3.75Å; V219-F275 HydrophobicContact CG2-CE1 4.04Å; V219-I279 HydrophobicContact CB-CD1 4.03Å; V219-I279 HydrophobicContact CB-CG1 4.3Å; V219-I279 HydrophobicContact CG2-CD1 3.84Å; V219-F280 HydrophobicContact CB-CE1 4.22Å; V219-F280 HydrophobicContact CG1-CD1 3.9Å; V219-F280 HydrophobicContact CG1-CE1 3.65Å; V219-F280 HydrophobicContact CG1-CZ 4.44Å; V219-F280 HydrophobicContact CG2-CE1 4.48Å; V219-L298 HydrophobicContact CG2-CD1 4.39Å
220	L	94.5	Very high	95.4	Very high	32 Å²	32	33.6 Å²	33.6	17%	0.168	16%	0.156	C	C	.	.	H	α-helix	trans	-90	-15.1	-179.7	-68.6	171.3	0	0	0	113.4	A216 K222 L224 F275 I279	A216-L220 VanDerWaalsContact O-CB 3.25Å; A216-L220 WeakPolarHBondContact O-CB 3.28Å; A216-L220 VanDerWaalsContact O-CG 3.28Å; A216-L220 WeakPolarHBondContact O-CG 3.48Å; A216-L220 PolarHBondContact O-N 3.35Å; L220-K222 HydrophobicContact CB-CG 3.94Å; L220-K222 PolarHBondContact O-N 2.87Å; L220-L224 HydrophobicContact CD1-CD1 3.64Å; L220-F275 HydrophobicContact CD1-CD1 4.25Å; L220-F275 HydrophobicContact CD1-CE1 3.67Å; L220-F275 HydrophobicContact CD2-CD1 4.27Å; L220-F275 HydrophobicContact CG-CD1 4.12Å; L220-F275 HydrophobicContact CG-CE1 3.97Å; L220-I279 HydrophobicContact CD2-CD1 3.64Å; L220-I279 HydrophobicContact CG-CD1 4.25Å
221	H	93.7	Very high	95.1	Very high	81 Å²	81	37.9 Å²	37.9	38%	0.375	18%	0.178	S	C	.	.	S	Bend	trans	53.1	20.4	-169.1	-56.2	-63.1	0	0	0	114.4	I119 M121 E217 M218	I119-H221 PolarHBondContact O-ND1 3.13Å; M121-H221 PolarHBondContact O-CE1 3.12Å; E217-H221 VanDerWaalsContact O-CA 3.27Å; E217-H221 WeakPolarHBondContact O-CA 3.13Å; E217-H221 PolarHBondContact O-N 3.42Å; M218-H221 PolarHBondContact O-CE1 3.31Å
222	K	94.4	Very high	94.8	Very high	137 Å²	137	38.6 Å²	38.6	60%	0.596	18%	0.182	S	C	*	.	S	Bend	trans	-148	148.4	177.4	68	-176.4	178.9	-175.2	0	110.2	L220 L224	L220-K222 HydrophobicContact CB-CG 3.94Å; L220-K222 PolarHBondContact O-N 2.87Å; K222-L224 PolarHBondContact O-N 3.5Å
223	V	96	Very high	94.7	Very high	38 Å²	38	38.6 Å²	38.6	23%	0.23	18%	0.182	C	C	.	.			trans	-55.7	127.2	175	176	0	0	0	0	110.5	Y190 E217 P226	Y190-V223 HydrophobicContact CD2-CB 4.44Å; Y190-V223 HydrophobicContact CD2-CG1 3.6Å; Y190-V223 HydrophobicContact CD2-CG2 4.07Å; Y190-V223 HydrophobicContact CE2-CG1 4.38Å; Y190-V223 HydrophobicContact CG-CG1 3.7Å; E217-V223 WeakPolarHBondContact OE1-CG2 3.36Å; V223-P226 HydrophobicContact CB-CB 4.49Å; V223-P226 HydrophobicContact CG1-CB 4.15Å
224	L	97	Very high	94.5	Very high	7 Å²	7	38.6 Å²	38.6	4%	0.037	18%	0.182	C	C	.	.	S	Bend	trans	-66.7	-44	-178.2	-175.5	64.3	0	0	0	112.6	A216 L220 K222 P226 Q240 L274 F275 L302	A216-L224 HydrophobicContact CB-CB 4.19Å; A216-L224 HydrophobicContact CB-CD1 4.47Å; A216-L224 HydrophobicContact CB-CD2 3.66Å; A216-L224 HydrophobicContact CB-CG 4.33Å; L220-L224 HydrophobicContact CD1-CD1 3.64Å; K222-L224 PolarHBondContact O-N 3.5Å; L224-P226 WeakPolarHBondContact O-CD 3.36Å; L224-Q240 PolarHBondContact O-NE2 3.48Å; L224-L274 HydrophobicContact CD1-CD1 4.28Å; L224-L274 HydrophobicContact CD1-CD2 4.48Å; L224-F275 HydrophobicContact CD1-CZ 4.33Å; L224-F275 HydrophobicContact CD2-CZ 4.39Å; L224-L302 HydrophobicContact CD2-CD1 3.6Å; L224-L302 HydrophobicContact CD2-CD2 4.21Å
225	F	97.2	Very high	94.4	Very high	1 Å²	1	40 Å²	40	0%	0.004	19%	0.189	C	C	.	.			trans	-125.9	78.4	-175.9	-51.7	-58.9	0	0	0	112.1	Y190 W209 G227 Q233 K236 V237 Q240 L241 L302	Y190-F225 WeakPolarHBondContact CD1-O 3.45Å; W209-F225 HydrophobicContact CH2-CE2 4.06Å; W209-F225 HydrophobicContact CH2-CZ 4.39Å; W209-F225 HydrophobicContact CZ2-CD2 4.05Å; W209-F225 AromaticContact CZ2-CE2 3.55Å; W209-F225 HydrophobicContact CZ2-CE2 3.55Å; W209-F225 HydrophobicContact CZ2-CZ 4.29Å; F225-G227 PolarHBondContact O-N 3.3Å; F225-G227 VanDerWaalsContact O-N 3.11Å; F225-Q233 PolarHBondContact O-NE2 3.3Å; F225-Q233 PolarHBondContact O-OE1 3.34Å; F225-K236 HydrophobicContact CB-CB 4.31Å; F225-K236 HydrophobicContact CD1-CB 4.37Å; F225-V237 HydrophobicContact CB-CG2 4.36Å; F225-V237 HydrophobicContact CD1-CG2 3.98Å; F225-V237 HydrophobicContact CD2-CG2 4.07Å; F225-V237 HydrophobicContact CE1-CG2 4.26Å; F225-V237 HydrophobicContact CE2-CG2 4.33Å; F225-V237 HydrophobicContact CG-CG2 3.88Å; F225-V237 HydrophobicContact CZ-CG2 4.42Å; F225-Q240 HydrophobicContact CE1-CB 4.17Å; F225-Q240 HydrophobicContact CE1-CG 4.47Å; F225-L241 HydrophobicContact CE1-CG 4.49Å; F225-L241 HydrophobicContact CZ-CD1 3.94Å; F225-L241 HydrophobicContact CZ-CG 4.12Å; F225-L302 HydrophobicContact CE2-CD2 4.27Å
226	P	95.1	Very high	94.4	Very high	62 Å²	62	42.8 Å²	42.8	40%	0.403	20%	0.201	S	C	.	.			trans	-84.8	77.8	-177.6	33.8	-35	0	0	0	111.9	V223 L224	V223-P226 HydrophobicContact CB-CB 4.49Å; V223-P226 HydrophobicContact CG1-CB 4.15Å; L224-P226 WeakPolarHBondContact O-CD 3.36Å
227	G	93.4	Very high	94.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.201	C	C	.	.			trans	-89.2	127.4	-179.6	0	0	0	0	0	114.7	R189 Y190 F225 D229 Q233	R189-G227 PolarHBondContact NH1-O 3.05Å; Y190-G227 WeakPolarHBondContact CE1-O 3.47Å; F225-G227 PolarHBondContact O-N 3.3Å; F225-G227 VanDerWaalsContact O-N 3.11Å; G227-D229 VanDerWaalsContact C-N 3.31Å; G227-D229 PolarHBondContact O-N 3.4Å; G227-Q233 VanDerWaalsContact CA-OE1 3.25Å
228	R	91	Very high	94.4	Very high	194 Å²	194	42.2 Å²	42.2	73%	0.732	20%	0.199	S	C	*	.	S	Bend	trans	-64.3	-33.1	179.4	-66.3	169	-68.3	163.6	3.1	113.6	R189 D232	R189-R228 PolarHBondContact NH1-O 3.1Å; R228-D232 HydrophobicContact CB-CB 4.31Å; R228-D232 WeakPolarHBondContact CB-OD2 3.11Å; R228-D232 WeakPolarHBondContact CG-OD2 3.33Å; R228-D232 IonicContact CZ-OD1 3.8Å; R228-D232 IonicContact CZ-OD2 3.49Å; R228-D232 PolarHBondContact N-OD2 3.43Å; R228-D232 IonicContact NE-OD1 3.4Å; R228-D232 IonicContact NE-OD2 2.8Å; R228-D232 PolarHBondContact NE-OD2 3.18Å; R228-D232 IonicContact NH2-OD1 3.73Å; R228-D232 PolarHBondContact NH2-OD1 3.3Å; R228-D232 IonicContact NH2-OD2 3.41Å
229	D	89.5	Confident	94.5	Very high	72 Å²	72	45.4 Å²	45.4	39%	0.385	21%	0.213	S	C	.	.	S	Bend	trans	-145.4	-174.6	174.7	58.9	44.6	0	0	0	109.8	G227 I231 D232 Q233	G227-D229 VanDerWaalsContact C-N 3.31Å; G227-D229 PolarHBondContact O-N 3.4Å; D229-I231 VanDerWaalsContact C-N 3.3Å; D229-I231 PolarHBondContact O-N 2.96Å; D229-I231 WeakPolarHBondContact OD1-CA 3.27Å; D229-I231 VanDerWaalsContact OD1-CB 3.31Å; D229-I231 WeakPolarHBondContact OD1-CB 3.43Å; D229-I231 PolarHBondContact OD1-N 2.94Å; D229-D232 WeakPolarHBondContact OD1-CB 3.43Å; D229-D232 PolarHBondContact OD1-N 3.48Å; D229-Q233 WeakPolarHBondContact O-CB 3.1Å; D229-Q233 PolarHBondContact O-N 3.48Å
230	Y	89.3	Confident	94.6	Very high	59 Å²	59	46.9 Å²	46.9	23%	0.231	22%	0.22	C	C	.	.	H	α-helix	trans	-65.4	-32	-179.8	-69.2	-69	0	0	0	113.6	P184 R192 I197 W234	P184-Y230 HydrophobicContact CB-CE2 4.25Å; R192-Y230 PolarHBondContact NH1-OH 3.06Å; I197-Y230 HydrophobicContact CG1-CD1 4.37Å; I197-Y230 HydrophobicContact CG2-CD1 4.14Å; Y230-W234 PolarHBondContact O-N 3.14Å; Y230-W234 VanDerWaalsContact O-N 3.09Å
231	I	90.9	Very high	94.7	Very high	91 Å²	91	47 Å²	47	47%	0.467	22%	0.22	S	C	.	.	H	α-helix	trans	-70.8	-49.6	179.2	-78.5	166	0	0	0	109.5	D229 Q233 W234 N235 Y259	D229-I231 VanDerWaalsContact C-N 3.3Å; D229-I231 PolarHBondContact O-N 2.96Å; D229-I231 WeakPolarHBondContact OD1-CA 3.27Å; D229-I231 VanDerWaalsContact OD1-CB 3.31Å; D229-I231 WeakPolarHBondContact OD1-CB 3.43Å; D229-I231 PolarHBondContact OD1-N 2.94Å; I231-Q233 VanDerWaalsContact C-N 3.34Å; I231-W234 PolarHBondContact O-N 3.14Å; I231-N235 VanDerWaalsContact O-CG 3.29Å; I231-N235 PolarHBondContact O-N 2.85Å; I231-N235 PolarHBondContact O-ND2 3.13Å; I231-Y259 HydrophobicContact CG1-CE1 4.45Å; I231-Y259 HydrophobicContact CG1-CE2 4.32Å; I231-Y259 WeakPolarHBondContact CG2-OH 3.28Å
232	D	93.7	Very high	94.9	Very high	15 Å²	15	43.3 Å²	43.3	8%	0.08	20%	0.204	C	C	.	.	H	α-helix	trans	-63.7	-41.1	177.8	-162.5	55.2	0	0	0	110.8	R228 D229 W234 N235 K236	R228-D232 HydrophobicContact CB-CB 4.31Å; R228-D232 WeakPolarHBondContact CB-OD2 3.11Å; R228-D232 WeakPolarHBondContact CG-OD2 3.33Å; R228-D232 IonicContact CZ-OD1 3.8Å; R228-D232 IonicContact CZ-OD2 3.49Å; R228-D232 PolarHBondContact N-OD2 3.43Å; R228-D232 IonicContact NE-OD1 3.4Å; R228-D232 IonicContact NE-OD2 2.8Å; R228-D232 PolarHBondContact NE-OD2 3.18Å; R228-D232 IonicContact NH2-OD1 3.73Å; R228-D232 PolarHBondContact NH2-OD1 3.3Å; R228-D232 IonicContact NH2-OD2 3.41Å; D229-D232 WeakPolarHBondContact OD1-CB 3.43Å; D229-D232 PolarHBondContact OD1-N 3.48Å; D232-W234 VanDerWaalsContact C-N 3.35Å; D232-W234 PolarHBondContact O-N 3.37Å; D232-N235 PolarHBondContact O-N 3.4Å; D232-K236 WeakPolarHBondContact O-CG 3.05Å; D232-K236 PolarHBondContact O-N 3.09Å
233	Q	94.5	Very high	95	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-56.5	-47.8	174.1	-173	69	32.2	0	0	111.7	R189 Y190 I197 F225 G227 D229 I231 N235 K236 V237	R189-Q233 HydrophobicContact CG-CB 4.4Å; R189-Q233 HydrophobicContact CG-CG 4.21Å; Y190-Q233 PolarHBondContact O-NE2 3.17Å; I197-Q233 HydrophobicContact CD1-CB 4.43Å; I197-Q233 HydrophobicContact CD1-CG 3.44Å; I197-Q233 VanDerWaalsContact CD1-CG 3.44Å; I197-Q233 HydrophobicContact CG1-CG 4.32Å; F225-Q233 PolarHBondContact O-NE2 3.3Å; F225-Q233 PolarHBondContact O-OE1 3.34Å; G227-Q233 VanDerWaalsContact CA-OE1 3.25Å; D229-Q233 WeakPolarHBondContact O-CB 3.1Å; D229-Q233 PolarHBondContact O-N 3.48Å; I231-Q233 VanDerWaalsContact C-N 3.34Å; Q233-N235 PolarHBondContact O-N 2.68Å; Q233-K236 PolarHBondContact O-N 3.3Å; Q233-V237 WeakPolarHBondContact O-CG2 3.43Å; Q233-V237 PolarHBondContact O-N 3.44Å
234	W	95.5	Very high	95	Very high	2 Å²	2	38 Å²	38	1%	0.008	18%	0.184	C	C	.	.	H	α-helix	trans	-61.6	-43.4	177	176.5	-110.1	0	0	0	112	P194 L198 Y230 I231 D232 K236 V237 I238 P244 F248 V260 I304	P194-W234 HydrophobicContact CB-CZ3 3.98Å; P194-W234 HydrophobicContact CG-CZ3 4.48Å; L198-W234 HydrophobicContact CD1-CD2 4.46Å; L198-W234 HydrophobicContact CD1-CE3 4.03Å; L198-W234 HydrophobicContact CD1-CH2 3.84Å; L198-W234 HydrophobicContact CD1-CZ2 4.27Å; L198-W234 HydrophobicContact CD1-CZ3 3.74Å; L198-W234 HydrophobicContact CD2-CD2 4.07Å; L198-W234 HydrophobicContact CD2-CE3 4.2Å; L198-W234 HydrophobicContact CD2-CG 4.39Å; L198-W234 HydrophobicContact CG-CE3 4.25Å; L198-W234 HydrophobicContact CG-CZ3 4.42Å; Y230-W234 PolarHBondContact O-N 3.14Å; Y230-W234 VanDerWaalsContact O-N 3.09Å; I231-W234 PolarHBondContact O-N 3.14Å; D232-W234 VanDerWaalsContact C-N 3.35Å; D232-W234 PolarHBondContact O-N 3.37Å; W234-K236 VanDerWaalsContact C-N 3.35Å; W234-K236 PolarHBondContact O-N 2.93Å; W234-V237 HydrophobicContact CZ3-CG1 4.38Å; W234-V237 WeakPolarHBondContact O-CB 3.47Å; W234-V237 PolarHBondContact O-N 3.48Å; W234-I238 HydrophobicContact CD2-CG2 4.11Å; W234-I238 HydrophobicContact CE3-CG2 4.4Å; W234-I238 HydrophobicContact CH2-CG2 3.74Å; W234-I238 HydrophobicContact CZ2-CG2 3.4Å; W234-I238 HydrophobicContact CZ3-CG2 4.2Å; W234-I238 PolarHBondContact O-N 2.52Å; W234-I238 VanDerWaalsContact O-N 3.09Å; W234-P244 HydrophobicContact CH2-CG 3.99Å; W234-P244 HydrophobicContact CZ2-CG 4.06Å; W234-F248 HydrophobicContact CH2-CE1 4.17Å; W234-V260 HydrophobicContact CZ2-CG1 3.68Å; W234-V260 HydrophobicContact CZ2-CG2 4.19Å; W234-I304 HydrophobicContact CH2-CG2 4.05Å; W234-I304 HydrophobicContact CZ3-CG2 4.25Å
235	N	95.3	Very high	94.9	Very high	28 Å²	28	40 Å²	40	15%	0.15	20%	0.199	C	C	.	.	H	α-helix	trans	-59.1	-45.4	177.1	-65.5	-27.6	0	0	0	111.3	I231 D232 Q233 V237 I238 E239	I231-N235 VanDerWaalsContact O-CG 3.29Å; I231-N235 PolarHBondContact O-N 2.85Å; I231-N235 PolarHBondContact O-ND2 3.13Å; D232-N235 PolarHBondContact O-N 3.4Å; Q233-N235 PolarHBondContact O-N 2.68Å; N235-V237 VanDerWaalsContact C-N 3.26Å; N235-V237 PolarHBondContact O-N 2.89Å; N235-I238 WeakPolarHBondContact O-CG1 3.44Å; N235-I238 PolarHBondContact O-N 2.85Å; N235-E239 VanDerWaalsContact O-CB 3.28Å; N235-E239 WeakPolarHBondContact O-CB 3.38Å; N235-E239 WeakPolarHBondContact O-CG 3.49Å; N235-E239 PolarHBondContact O-N 3.04Å
236	K	96.8	Very high	94.7	Very high	60 Å²	60	42.8 Å²	42.8	26%	0.261	22%	0.222	S	C	.	.	H	α-helix	trans	-58.6	-37.4	176.7	-65.1	-59.3	169.4	-158.5	0	113.2	F225 D232 Q233 W234 E239	F225-K236 HydrophobicContact CB-CB 4.31Å; F225-K236 HydrophobicContact CD1-CB 4.37Å; D232-K236 WeakPolarHBondContact O-CG 3.05Å; D232-K236 PolarHBondContact O-N 3.09Å; Q233-K236 PolarHBondContact O-N 3.3Å; W234-K236 VanDerWaalsContact C-N 3.35Å; W234-K236 PolarHBondContact O-N 2.93Å; K236-E239 IonicContact NZ-OE2 2.66Å; K236-E239 PolarHBondContact NZ-OE2 3.22Å
237	V	97.5	Very high	94.7	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-66.3	-51.8	177.7	170.3	0	0	0	0	111	P194 W209 F225 Q233 W234 N235 Q240 L241 I304	P194-V237 HydrophobicContact CG-CG1 4.49Å; W209-V237 HydrophobicContact CH2-CG1 3.77Å; W209-V237 HydrophobicContact CH2-CG2 4.37Å; W209-V237 HydrophobicContact CZ2-CG1 4.23Å; W209-V237 HydrophobicContact CZ2-CG2 3.99Å; F225-V237 HydrophobicContact CB-CG2 4.36Å; F225-V237 HydrophobicContact CD1-CG2 3.98Å; F225-V237 HydrophobicContact CD2-CG2 4.07Å; F225-V237 HydrophobicContact CE1-CG2 4.26Å; F225-V237 HydrophobicContact CE2-CG2 4.33Å; F225-V237 HydrophobicContact CG-CG2 3.88Å; F225-V237 HydrophobicContact CZ-CG2 4.42Å; Q233-V237 WeakPolarHBondContact O-CG2 3.43Å; Q233-V237 PolarHBondContact O-N 3.44Å; W234-V237 HydrophobicContact CZ3-CG1 4.38Å; W234-V237 WeakPolarHBondContact O-CB 3.47Å; W234-V237 PolarHBondContact O-N 3.48Å; N235-V237 VanDerWaalsContact C-N 3.26Å; N235-V237 PolarHBondContact O-N 2.89Å; V237-Q240 PolarHBondContact O-N 2.88Å; V237-L241 HydrophobicContact CG1-CD1 4.22Å; V237-L241 WeakPolarHBondContact O-CB 3.3Å; V237-L241 PolarHBondContact O-N 2.82Å; V237-I304 HydrophobicContact CG1-CD1 3.97Å; V237-I304 HydrophobicContact CG1-CG1 4.02Å
238	I	97	Very high	94.8	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-73.8	-28.9	-176.6	63.2	175	0	0	0	113.3	W234 N235 Q240 G242 R263 Y266 I304	W234-I238 HydrophobicContact CD2-CG2 4.11Å; W234-I238 HydrophobicContact CE3-CG2 4.4Å; W234-I238 HydrophobicContact CH2-CG2 3.74Å; W234-I238 HydrophobicContact CZ2-CG2 3.4Å; W234-I238 HydrophobicContact CZ3-CG2 4.2Å; W234-I238 PolarHBondContact O-N 2.52Å; W234-I238 VanDerWaalsContact O-N 3.09Å; N235-I238 WeakPolarHBondContact O-CG1 3.44Å; N235-I238 PolarHBondContact O-N 2.85Å; I238-Q240 PolarHBondContact O-N 3.25Å; I238-G242 CarbonylContact O-C 3.54Å; I238-G242 WeakPolarHBondContact O-CA 3.28Å; I238-G242 PolarHBondContact O-N 3.3Å; I238-R263 HydrophobicContact CD1-CB 3.97Å; I238-R263 HydrophobicContact CD1-CG 4.25Å; I238-Y266 HydrophobicContact CB-CD2 4.41Å; I238-Y266 HydrophobicContact CD1-CD2 4Å; I238-Y266 HydrophobicContact CD1-CE2 4.06Å; I238-Y266 HydrophobicContact CG1-CD2 3.92Å; I238-Y266 HydrophobicContact CG1-CE2 4.17Å; I238-Y266 WeakPolarHBondContact O-CB 3.31Å; I238-I304 HydrophobicContact CG2-CD1 4.45Å
239	E	96.8	Very high	95	Very high	69 Å²	69	37.1 Å²	37.1	32%	0.322	20%	0.199	S	C	.	.	H	α-helix	trans	-59.3	-34.4	174	-80.3	169.2	-172.8	0	0	111.4	N235 K236 Y266	N235-E239 VanDerWaalsContact O-CB 3.28Å; N235-E239 WeakPolarHBondContact O-CB 3.38Å; N235-E239 WeakPolarHBondContact O-CG 3.49Å; N235-E239 PolarHBondContact O-N 3.04Å; K236-E239 IonicContact NZ-OE2 2.66Å; K236-E239 PolarHBondContact NZ-OE2 3.22Å; E239-Y266 HydrophobicContact CG-CD1 4.32Å; E239-Y266 HydrophobicContact CG-CE1 3.83Å; E239-Y266 HydrophobicContact CG-CE2 4.08Å
240	Q	97.3	Very high	95.2	Very high	35 Å²	35	40.5 Å²	40.5	16%	0.164	21%	0.21	C	C	.	.	H	α-helix	trans	-97.5	-45.7	-178.5	-63.4	-175.5	37.5	0	0	113.3	L224 F225 V237 I238 G268 I269	L224-Q240 PolarHBondContact O-NE2 3.48Å; F225-Q240 HydrophobicContact CE1-CB 4.17Å; F225-Q240 HydrophobicContact CE1-CG 4.47Å; V237-Q240 PolarHBondContact O-N 2.88Å; I238-Q240 PolarHBondContact O-N 3.25Å; Q240-G268 WeakPolarHBondContact O-CA 3.38Å; Q240-I269 PolarHBondContact O-N 3.45Å
241	L	97.8	Very high	95.4	Very high	33 Å²	33	41.3 Å²	41.3	17%	0.173	22%	0.215	C	C	.	.	H	α-helix	trans	-94.2	-8.4	-174.5	-58.3	-176.3	0	0	0	113.7	W209 F225 V237 F271 L274 L302 I304	W209-L241 HydrophobicContact CH2-CD1 3.58Å; W209-L241 HydrophobicContact CZ3-CD1 3.91Å; F225-L241 HydrophobicContact CE1-CG 4.49Å; F225-L241 HydrophobicContact CZ-CD1 3.94Å; F225-L241 HydrophobicContact CZ-CG 4.12Å; V237-L241 HydrophobicContact CG1-CD1 4.22Å; V237-L241 WeakPolarHBondContact O-CB 3.3Å; V237-L241 PolarHBondContact O-N 2.82Å; L241-F271 HydrophobicContact CD2-CE2 4.28Å; L241-F271 HydrophobicContact CD2-CZ 3.94Å; L241-L274 HydrophobicContact CD2-CD2 4.3Å; L241-L302 HydrophobicContact CD1-CB 4.4Å; L241-L302 WeakPolarHBondContact CD1-O 3.14Å; L241-I304 HydrophobicContact CB-CD1 4.09Å; L241-I304 HydrophobicContact CB-CG1 4.38Å; L241-I304 HydrophobicContact CD1-CG1 4.14Å
242	G	97	Very high	95.6	Very high	4 Å²	4	37.5 Å²	37.5	4%	0.041	20%	0.195	C	C	.	.			trans	90.6	165.3	-179.5	0	0	0	0	0	114	I238 Y266 G268 I304	I238-G242 CarbonylContact O-C 3.54Å; I238-G242 WeakPolarHBondContact O-CA 3.28Å; I238-G242 PolarHBondContact O-N 3.3Å; G242-Y266 CarbonylContact C-O 3.57Å; G242-Y266 VanDerWaalsContact CA-O 3.31Å; G242-Y266 WeakPolarHBondContact CA-O 3.39Å; G242-G268 VanDerWaalsContact CA-CA 3.46Å; G242-G268 VanDerWaalsContact N-CA 3.34Å; G242-I304 WeakPolarHBondContact O-CD1 3.17Å
243	T	96.5	Very high	95.5	Very high	48 Å²	48	42.8 Å²	42.8	29%	0.294	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-69.8	129.2	176.5	-58.7	0	0	0	0	110.1	K265 Y266	T243-K265 WeakPolarHBondContact OG1-CA 3.44Å; T243-Y266 PolarHBondContact N-O 2.83Å; T243-Y266 PolarHBondContact OG1-N 2.98Å
244	P	95.2	Very high	95.5	Very high	16 Å²	16	47.5 Å²	47.5	10%	0.104	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-67.1	160.8	-177.4	29.6	-37.9	0	0	0	112.7	W234 F248 M249 I304	W234-P244 HydrophobicContact CH2-CG 3.99Å; W234-P244 HydrophobicContact CZ2-CG 4.06Å; P244-F248 HydrophobicContact CB-CB 4.11Å; P244-F248 HydrophobicContact CB-CD1 3.43Å; P244-F248 VanDerWaalsContact CB-CD1 3.43Å; P244-F248 HydrophobicContact CB-CE1 4.05Å; P244-F248 HydrophobicContact CB-CG 3.91Å; P244-F248 HydrophobicContact CG-CD1 3.54Å; P244-F248 HydrophobicContact CG-CE1 3.86Å; P244-F248 HydrophobicContact CG-CG 4.49Å; P244-M249 HydrophobicContact CG-CG 4.34Å; P244-I304 HydrophobicContact CB-CG2 4.02Å
245	S	95	Very high	95.3	Very high	50 Å²	50	52.8 Å²	52.8	35%	0.35	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-61.2	157	179.8	72.2	0	0	0	0	113.3	E247 F248 M249	S245-E247 PolarHBondContact O-N 3.22Å; S245-F248 WeakPolarHBondContact O-CB 3.49Å; S245-F248 PolarHBondContact O-N 3.34Å; S245-F248 VanDerWaalsContact O-N 3.13Å; S245-F248 PolarHBondContact OG-N 3.13Å; S245-M249 PolarHBondContact O-N 3.17Å; S245-M249 VanDerWaalsContact O-N 3.11Å
246	A	94.2	Very high	95.2	Very high	59 Å²	59	53.2 Å²	53.2	49%	0.488	29%	0.286	S	S	.	.	H	α-helix	trans	-59.8	-28.9	174	0	0	0	0	0	113.1	M249 K250	A246-M249 HydrophobicContact CB-CE 4.33Å; A246-M249 PolarHBondContact O-N 2.92Å; A246-K250 VanDerWaalsContact O-CG 3.31Å; A246-K250 WeakPolarHBondContact O-CG 3.34Å; A246-K250 PolarHBondContact O-N 3.01Å; A246-K250 VanDerWaalsContact O-N 3.11Å
247	E	95	Very high	95	Very high	112 Å²	112	54.1 Å²	54.1	52%	0.523	29%	0.288	S	S	.	.	H	α-helix	trans	-63.9	-45.2	174.6	-175	-176.8	-168.7	0	0	111.7	S245 K250 K308	S245-E247 PolarHBondContact O-N 3.22Å; E247-K250 PolarHBondContact O-N 3.13Å; E247-K308 IonicContact OE2-NZ 2.65Å
248	F	95.2	Very high	94.8	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61.8	-46.9	173.9	173.2	-92.7	0	0	0	111.3	L198 M200 W234 P244 S245 K250 K251 L252 I304 D305	L198-F248 HydrophobicContact CD1-CE1 4Å; L198-F248 HydrophobicContact CD1-CZ 3.91Å; M200-F248 HydrophobicContact CE-CD2 4.37Å; M200-F248 HydrophobicContact CE-CE2 3.83Å; M200-F248 HydrophobicContact CE-CZ 4.22Å; M200-F248 HydrophobicContact SD-CE2 3.85Å; M200-F248 HydrophobicContact SD-CZ 3.7Å; W234-F248 HydrophobicContact CH2-CE1 4.17Å; P244-F248 HydrophobicContact CB-CB 4.11Å; P244-F248 HydrophobicContact CB-CD1 3.43Å; P244-F248 VanDerWaalsContact CB-CD1 3.43Å; P244-F248 HydrophobicContact CB-CE1 4.05Å; P244-F248 HydrophobicContact CB-CG 3.91Å; P244-F248 HydrophobicContact CG-CD1 3.54Å; P244-F248 HydrophobicContact CG-CE1 3.86Å; P244-F248 HydrophobicContact CG-CG 4.49Å; S245-F248 WeakPolarHBondContact O-CB 3.49Å; S245-F248 PolarHBondContact O-N 3.34Å; S245-F248 VanDerWaalsContact O-N 3.13Å; S245-F248 PolarHBondContact OG-N 3.13Å; F248-K250 PolarHBondContact O-N 3.47Å; F248-K251 WeakPolarHBondContact O-CB 3.31Å; F248-K251 PolarHBondContact O-N 3.22Å; F248-L252 HydrophobicContact CE1-CD1 4.39Å; F248-L252 HydrophobicContact CE1-CD2 4.29Å; F248-L252 HydrophobicContact CZ-CD2 4.44Å; F248-I304 HydrophobicContact CD1-CG2 4.48Å; F248-I304 HydrophobicContact CD2-CG2 4.45Å; F248-I304 HydrophobicContact CE1-CG2 4.01Å; F248-I304 HydrophobicContact CE2-CG2 3.97Å; F248-I304 HydrophobicContact CZ-CG2 3.72Å; F248-D305 HydrophobicContact CD2-CB 3.97Å
249	M	94.1	Very high	94.6	Very high	24 Å²	24	61.5 Å²	61.5	12%	0.118	32%	0.323	C	S	.	.	H	α-helix	trans	-62	-29.5	-178.6	-67.8	-173.2	-70.4	0	0	112.9	P244 S245 A246 K251 L252 R257 V260 E261	P244-M249 HydrophobicContact CG-CG 4.34Å; S245-M249 PolarHBondContact O-N 3.17Å; S245-M249 VanDerWaalsContact O-N 3.11Å; A246-M249 HydrophobicContact CB-CE 4.33Å; A246-M249 PolarHBondContact O-N 2.92Å; M249-K251 PolarHBondContact O-N 3.12Å; M249-L252 WeakPolarHBondContact O-CB 3.44Å; M249-L252 PolarHBondContact O-N 3.13Å; M249-R257 VanDerWaalsContact O-CD 3.26Å; M249-R257 WeakPolarHBondContact O-CD 3.36Å; M249-R257 WeakPolarHBondContact O-CG 3.36Å; M249-V260 HydrophobicContact CG-CG1 4.33Å; M249-V260 HydrophobicContact SD-CG1 4.21Å; M249-E261 HydrophobicContact CE-CG 4.36Å; M249-E261 HydrophobicContact SD-CG 3.56Å; M249-E261 VanDerWaalsContact SD-CG 3.56Å
250	K	94.5	Very high	94.3	Very high	144 Å²	144	58.4 Å²	58.4	63%	0.626	31%	0.309	S	S	*	.	H	α-helix	trans	-64.7	-22.8	173.9	-75.6	172.4	-176	-178.3	0	113.7	A246 E247 F248 L252	A246-K250 VanDerWaalsContact O-CG 3.31Å; A246-K250 WeakPolarHBondContact O-CG 3.34Å; A246-K250 PolarHBondContact O-N 3.01Å; A246-K250 VanDerWaalsContact O-N 3.11Å; E247-K250 PolarHBondContact O-N 3.13Å; F248-K250 PolarHBondContact O-N 3.47Å; K250-L252 VanDerWaalsContact C-N 3.28Å
251	K	94.3	Very high	94.1	Very high	76 Å²	76	60.6 Å²	60.6	33%	0.33	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-10.6	178.4	-54.6	174.7	-169	176.1	0	112.6	M200 F248 M249 D305 D307	M200-K251 HydrophobicContact CE-CB 3.79Å; M200-K251 HydrophobicContact CE-CD 4.5Å; F248-K251 WeakPolarHBondContact O-CB 3.31Å; F248-K251 PolarHBondContact O-N 3.22Å; M249-K251 PolarHBondContact O-N 3.12Å; K251-D305 IonicContact NZ-OD1 2.73Å; K251-D305 PolarHBondContact NZ-OD1 3.46Å; K251-D305 IonicContact NZ-OD2 3.41Å; K251-D305 PolarHBondContact NZ-OD2 3.33Å; K251-D307 IonicContact NZ-OD2 2.71Å; K251-D307 PolarHBondContact NZ-OD2 3.21Å
252	L	93.9	Very high	93.9	Very high	11 Å²	11	64.2 Å²	64.2	6%	0.058	34%	0.339	C	S	.	.	S	Bend	trans	-81.7	149.3	-177.4	-59.9	177.1	0	0	0	112.1	L198 M200 F248 M249 K250 V256 R257 V260	L198-L252 HydrophobicContact CB-CD2 4.07Å; L198-L252 HydrophobicContact CD1-CD2 3.81Å; M200-L252 HydrophobicContact CE-CD2 4.12Å; M200-L252 HydrophobicContact CG-CD2 3.61Å; M200-L252 HydrophobicContact SD-CD2 3.36Å; M200-L252 WeakPolarHBondContact SD-CD2 3.47Å; F248-L252 HydrophobicContact CE1-CD1 4.39Å; F248-L252 HydrophobicContact CE1-CD2 4.29Å; F248-L252 HydrophobicContact CZ-CD2 4.44Å; M249-L252 WeakPolarHBondContact O-CB 3.44Å; M249-L252 PolarHBondContact O-N 3.13Å; K250-L252 VanDerWaalsContact C-N 3.28Å; L252-V256 HydrophobicContact CD2-CG1 4.48Å; L252-R257 HydrophobicContact CB-CB 3.84Å; L252-R257 HydrophobicContact CB-CG 4.45Å; L252-V260 HydrophobicContact CD1-CB 4.05Å; L252-V260 HydrophobicContact CD1-CG1 4.24Å; L252-V260 HydrophobicContact CD1-CG2 3.93Å
253	Q	92.7	Very high	93.7	Very high	126 Å²	126	68 Å²	68	59%	0.589	35%	0.352	S	S	*	.			trans	-59.1	145.1	168.7	-70.3	-65.7	-17.9	0	0	110.7	T255 V256 R257	Q253-T255 VanDerWaalsContact C-N 3.31Å; Q253-T255 PolarHBondContact O-N 3.39Å; Q253-T255 VanDerWaalsContact O-N 3.12Å; Q253-V256 HydrophobicContact CB-CG2 4.34Å; Q253-V256 PolarHBondContact O-N 2.65Å; Q253-V256 VanDerWaalsContact O-N 3.09Å; Q253-R257 WeakPolarHBondContact O-CB 3.41Å; Q253-R257 PolarHBondContact O-N 3.23Å
254	P	93.5	Very high	93.5	Very high	98 Å²	98	69.3 Å²	69.3	64%	0.636	36%	0.361	S	S	*	.	H	α-helix	trans	-53.5	-40.2	-170.4	-29.5	35.3	0	0	0	115.3	N258	P254-N258 WeakPolarHBondContact O-CB 3.31Å; P254-N258 PolarHBondContact O-N 3.08Å
255	T	92.6	Very high	93.5	Very high	114 Å²	114	77.2 Å²	77.2	70%	0.699	39%	0.394	S	S	*	.	H	α-helix	trans	-68.3	-46.1	179.1	49.7	0	0	0	0	112.1	Q253 N258 Y259	Q253-T255 VanDerWaalsContact C-N 3.31Å; Q253-T255 PolarHBondContact O-N 3.39Å; Q253-T255 VanDerWaalsContact O-N 3.12Å; T255-N258 PolarHBondContact O-N 2.9Å; T255-Y259 PolarHBondContact O-N 2.79Å; T255-Y259 VanDerWaalsContact O-N 3.14Å
256	V	92.2	Very high	93.6	Very high	37 Å²	37	78.3 Å²	78.3	22%	0.224	39%	0.391	C	S	.	.	H	α-helix	trans	-65.6	-42.4	177.2	-178.1	0	0	0	0	110.3	L198 L252 Q253 N258 Y259 V260	L198-V256 HydrophobicContact CB-CG1 4.09Å; L198-V256 HydrophobicContact CD2-CG1 3.83Å; L198-V256 HydrophobicContact CG-CG1 4.5Å; L252-V256 HydrophobicContact CD2-CG1 4.48Å; Q253-V256 HydrophobicContact CB-CG2 4.34Å; Q253-V256 PolarHBondContact O-N 2.65Å; Q253-V256 VanDerWaalsContact O-N 3.09Å; V256-N258 PolarHBondContact O-N 2.93Å; V256-Y259 WeakPolarHBondContact O-CB 3.17Å; V256-Y259 PolarHBondContact O-N 2.95Å; V256-V260 HydrophobicContact CG1-CG2 4.32Å; V256-V260 WeakPolarHBondContact O-CG2 3.43Å; V256-V260 PolarHBondContact O-N 2.85Å
257	R	93.6	Very high	93.7	Very high	78 Å²	78	82 Å²	82	29%	0.294	41%	0.409	S	S	.	.	H	α-helix	trans	-56.7	-50.6	176.3	-174	176.9	173.4	178.8	-6	111.7	M249 L252 Q253 Y259 V260 E261	M249-R257 VanDerWaalsContact O-CD 3.26Å; M249-R257 WeakPolarHBondContact O-CD 3.36Å; M249-R257 WeakPolarHBondContact O-CG 3.36Å; L252-R257 HydrophobicContact CB-CB 3.84Å; L252-R257 HydrophobicContact CB-CG 4.45Å; Q253-R257 WeakPolarHBondContact O-CB 3.41Å; Q253-R257 PolarHBondContact O-N 3.23Å; R257-Y259 VanDerWaalsContact C-N 3.27Å; R257-Y259 PolarHBondContact O-N 3.3Å; R257-V260 PolarHBondContact O-N 3.16Å; R257-E261 HydrophobicContact CG-CG 4.24Å; R257-E261 IonicContact CZ-OE1 2.68Å; R257-E261 VanDerWaalsContact CZ-OE1 3.32Å; R257-E261 IonicContact NE-OE1 3.06Å; R257-E261 PolarHBondContact NE-OE1 3.18Å; R257-E261 IonicContact NE-OE2 2.66Å; R257-E261 IonicContact NH2-OE1 2.72Å; R257-E261 PolarHBondContact NH2-OE1 3.44Å; R257-E261 WeakPolarHBondContact O-CB 3.27Å; R257-E261 WeakPolarHBondContact O-CG 3.29Å; R257-E261 PolarHBondContact O-N 2.97Å
258	N	93.4	Very high	93.7	Very high	95 Å²	95	77.7 Å²	77.7	51%	0.508	40%	0.395	S	S	.	.	H	α-helix	trans	-60.3	-39.3	178.2	-171.8	31	0	0	0	111.4	P254 T255 V256 N262	P254-N258 WeakPolarHBondContact O-CB 3.31Å; P254-N258 PolarHBondContact O-N 3.08Å; T255-N258 PolarHBondContact O-N 2.9Å; V256-N258 PolarHBondContact O-N 2.93Å; N258-N262 WeakPolarHBondContact O-CB 3.16Å; N258-N262 VanDerWaalsContact O-CG 3.3Å; N258-N262 PolarHBondContact O-N 3.13Å; N258-N262 PolarHBondContact O-ND2 3.45Å; N258-N262 PolarHBondContact OD1-ND2 2.75Å
259	Y	91.5	Very high	93.8	Very high	62 Å²	62	81 Å²	81	24%	0.243	41%	0.413	C	S	.	.	H	α-helix	trans	-62.1	-46.3	174.8	171.8	-95.8	0	0	0	112.4	I231 T255 V256 R257 R263	I231-Y259 HydrophobicContact CG1-CE1 4.45Å; I231-Y259 HydrophobicContact CG1-CE2 4.32Å; I231-Y259 WeakPolarHBondContact CG2-OH 3.28Å; T255-Y259 PolarHBondContact O-N 2.79Å; T255-Y259 VanDerWaalsContact O-N 3.14Å; V256-Y259 WeakPolarHBondContact O-CB 3.17Å; V256-Y259 PolarHBondContact O-N 2.95Å; R257-Y259 VanDerWaalsContact C-N 3.27Å; R257-Y259 PolarHBondContact O-N 3.3Å; Y259-R263 PolarHBondContact O-NE 3.48Å
260	V	91.8	Very high	93.9	Very high	4 Å²	4	86.5 Å²	86.5	2%	0.024	44%	0.436	C	S	.	.	H	α-helix	trans	-67.9	-45.1	-179.1	172.8	0	0	0	0	111.8	L198 W234 M249 L252 V256 R257 N262 R263	L198-V260 HydrophobicContact CD2-CG2 3.95Å; W234-V260 HydrophobicContact CZ2-CG1 3.68Å; W234-V260 HydrophobicContact CZ2-CG2 4.19Å; M249-V260 HydrophobicContact CG-CG1 4.33Å; M249-V260 HydrophobicContact SD-CG1 4.21Å; L252-V260 HydrophobicContact CD1-CB 4.05Å; L252-V260 HydrophobicContact CD1-CG1 4.24Å; L252-V260 HydrophobicContact CD1-CG2 3.93Å; V256-V260 HydrophobicContact CG1-CG2 4.32Å; V256-V260 WeakPolarHBondContact O-CG2 3.43Å; V256-V260 PolarHBondContact O-N 2.85Å; R257-V260 PolarHBondContact O-N 3.16Å; V260-N262 VanDerWaalsContact C-N 3.25Å; V260-N262 PolarHBondContact O-N 3.28Å; V260-R263 WeakPolarHBondContact O-CB 3.21Å; V260-R263 PolarHBondContact O-N 3.35Å; V260-R263 VanDerWaalsContact O-N 3.15Å
261	E	92.8	Very high	94.1	Very high	81 Å²	81	81.4 Å²	81.4	38%	0.379	41%	0.414	S	S	.	.	H	α-helix	trans	-64.5	-28.8	179.8	-76.5	177.8	164.9	0	0	112.6	M249 R257 R263	M249-E261 HydrophobicContact CE-CG 4.36Å; M249-E261 HydrophobicContact SD-CG 3.56Å; M249-E261 VanDerWaalsContact SD-CG 3.56Å; R257-E261 HydrophobicContact CG-CG 4.24Å; R257-E261 IonicContact CZ-OE1 2.68Å; R257-E261 VanDerWaalsContact CZ-OE1 3.32Å; R257-E261 IonicContact NE-OE1 3.06Å; R257-E261 PolarHBondContact NE-OE1 3.18Å; R257-E261 IonicContact NE-OE2 2.66Å; R257-E261 IonicContact NH2-OE1 2.72Å; R257-E261 PolarHBondContact NH2-OE1 3.44Å; R257-E261 WeakPolarHBondContact O-CB 3.27Å; R257-E261 WeakPolarHBondContact O-CG 3.29Å; R257-E261 PolarHBondContact O-N 2.97Å; E261-R263 VanDerWaalsContact C-N 3.33Å
262	N	93.3	Very high	94.1	Very high	109 Å²	109	83.2 Å²	83.2	58%	0.583	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	3.4	177.1	-72	-44.4	0	0	0	114.2	N258 V260	N258-N262 WeakPolarHBondContact O-CB 3.16Å; N258-N262 VanDerWaalsContact O-CG 3.3Å; N258-N262 PolarHBondContact O-N 3.13Å; N258-N262 PolarHBondContact O-ND2 3.45Å; N258-N262 PolarHBondContact OD1-ND2 2.75Å; V260-N262 VanDerWaalsContact C-N 3.25Å; V260-N262 PolarHBondContact O-N 3.28Å
263	R	92.2	Very high	94.3	Very high	85 Å²	85	88.9 Å²	88.9	32%	0.321	45%	0.449	S	S	.	.	S	Bend	trans	-76	155.1	171.6	-66.8	-60.1	98.7	-170.7	3.7	110.7	I238 Y259 V260 E261 K265	I238-R263 HydrophobicContact CD1-CB 3.97Å; I238-R263 HydrophobicContact CD1-CG 4.25Å; Y259-R263 PolarHBondContact O-NE 3.48Å; V260-R263 WeakPolarHBondContact O-CB 3.21Å; V260-R263 PolarHBondContact O-N 3.35Å; V260-R263 VanDerWaalsContact O-N 3.15Å; E261-R263 VanDerWaalsContact C-N 3.33Å; R263-K265 PolarHBondContact O-N 3.39Å
264	P	93.7	Very high	94.4	Very high	74 Å²	74	83.9 Å²	83.9	48%	0.481	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-53.2	141.7	168.7	-23.1	33.4	0	0	0	111	Y266	P264-Y266 HydrophobicContact CB-CE2 3.8Å; P264-Y266 HydrophobicContact CG-CE2 4.42Å; P264-Y266 WeakPolarHBondContact O-CD2 3.29Å; P264-Y266 VanDerWaalsContact O-CE2 3.3Å; P264-Y266 WeakPolarHBondContact O-CE2 3.45Å
265	K	94.8	Very high	94.6	Very high	183 Å²	183	79.2 Å²	79.2	80%	0.796	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-82.1	125	176.9	-66.4	-174.9	-179.9	179.8	0	109.5	T243 R263	T243-K265 WeakPolarHBondContact OG1-CA 3.44Å; R263-K265 PolarHBondContact O-N 3.39Å
266	Y	96.3	Very high	94.7	Very high	72 Å²	72	75.1 Å²	75.1	28%	0.282	37%	0.372	S	S	.	.			trans	-112.4	134.2	177.5	-64	-83	0	0	0	109.6	I238 E239 G242 T243 P264 G268	I238-Y266 HydrophobicContact CB-CD2 4.41Å; I238-Y266 HydrophobicContact CD1-CD2 4Å; I238-Y266 HydrophobicContact CD1-CE2 4.06Å; I238-Y266 HydrophobicContact CG1-CD2 3.92Å; I238-Y266 HydrophobicContact CG1-CE2 4.17Å; I238-Y266 WeakPolarHBondContact O-CB 3.31Å; E239-Y266 HydrophobicContact CG-CD1 4.32Å; E239-Y266 HydrophobicContact CG-CE1 3.83Å; E239-Y266 HydrophobicContact CG-CE2 4.08Å; G242-Y266 CarbonylContact C-O 3.57Å; G242-Y266 VanDerWaalsContact CA-O 3.31Å; G242-Y266 WeakPolarHBondContact CA-O 3.39Å; T243-Y266 PolarHBondContact N-O 2.83Å; T243-Y266 PolarHBondContact OG1-N 2.98Å; P264-Y266 HydrophobicContact CB-CE2 3.8Å; P264-Y266 HydrophobicContact CG-CE2 4.42Å; P264-Y266 WeakPolarHBondContact O-CD2 3.29Å; P264-Y266 VanDerWaalsContact O-CE2 3.3Å; P264-Y266 WeakPolarHBondContact O-CE2 3.45Å; Y266-G268 PolarHBondContact O-N 3.32Å
267	P	95.8	Very high	94.7	Very high	136 Å²	136	78.1 Å²	78.1	88%	0.883	39%	0.386	S	S	*	.			trans	-71.9	-18.3	177.9	29.1	-34.7	0	0	0	113.2
268	G	95.5	Very high	94.6	Very high	22 Å²	22	84.6 Å²	84.6	23%	0.227	41%	0.411	C	S	.	.			trans	81.9	149.1	-168.1	0	0	0	0	0	111.8	Q240 G242 Y266	Q240-G268 WeakPolarHBondContact O-CA 3.38Å; G242-G268 VanDerWaalsContact CA-CA 3.46Å; G242-G268 VanDerWaalsContact N-CA 3.34Å; Y266-G268 PolarHBondContact O-N 3.32Å
269	I	96.8	Very high	94.6	Very high	71 Å²	71	81.2 Å²	81.2	36%	0.364	39%	0.393	S	S	.	.			trans	-90.5	137.6	174.1	-57.4	173.5	0	0	0	107	Q240 E273 L274	Q240-I269 PolarHBondContact O-N 3.45Å; I269-E273 HydrophobicContact CG2-CB 3.58Å; I269-L274 HydrophobicContact CG2-CB 4.23Å
270	K	97.3	Very high	94.7	Very high	138 Å²	138	78.8 Å²	78.8	60%	0.6	38%	0.383	S	S	*	.			trans	-64.1	147.6	176.1	-65.9	-179.5	-178.3	172.6	0	110.4	E272 E273 L274	K270-E272 PolarHBondContact O-N 2.91Å; K270-E273 HydrophobicContact CB-CG 4.39Å; K270-E273 PolarHBondContact O-N 2.91Å; K270-L274 PolarHBondContact O-N 3.18Å
271	F	97.4	Very high	94.3	Very high	37 Å²	37	80.6 Å²	80.6	16%	0.162	40%	0.395	C	S	.	.	H	α-helix	trans	-63.2	-26.7	-178.7	-88	-100.2	0	0	0	112.8	L241 E273 F275 R295 L298 L302	L241-F271 HydrophobicContact CD2-CE2 4.28Å; L241-F271 HydrophobicContact CD2-CZ 3.94Å; F271-E273 VanDerWaalsContact C-N 3.32Å; F271-F275 AromaticContact CD1-CD2 3.67Å; F271-F275 HydrophobicContact CD1-CD2 3.67Å; F271-F275 AromaticContact CD1-CE2 3.59Å; F271-F275 HydrophobicContact CD1-CE2 3.59Å; F271-F275 HydrophobicContact CE1-CD2 4.27Å; F271-F275 AromaticContact CE1-CE2 3.71Å; F271-F275 HydrophobicContact CE1-CE2 3.71Å; F271-F275 HydrophobicContact CG-CD2 4.5Å; F271-F275 WeakPolarHBondContact O-CA 3.4Å; F271-F275 WeakPolarHBondContact O-CB 3.36Å; F271-F275 PolarHBondContact O-N 3.06Å; F271-R295 HydrophobicContact CB-CG 4.02Å; F271-L298 HydrophobicContact CD1-CB 4.18Å; F271-L298 HydrophobicContact CE1-CB 4.12Å; F271-L302 HydrophobicContact CE1-CB 4.15Å; F271-L302 HydrophobicContact CE1-CD1 4.19Å; F271-L302 HydrophobicContact CZ-CB 3.95Å
272	E	96	Very high	93.5	Very high	114 Å²	114	79.4 Å²	79.4	53%	0.533	40%	0.396	S	S	.	.	H	α-helix	trans	-69.3	-29.6	173	-61.8	71.8	-156.4	0	0	112.7	K270 F275 P276	K270-E272 PolarHBondContact O-N 2.91Å; E272-F275 CarbonylContact O-C 3.58Å; E272-P276 WeakPolarHBondContact O-CA 3.37Å
273	E	96.5	Very high	92.7	Very high	130 Å²	130	83.5 Å²	83.5	61%	0.607	41%	0.411	S	S	*	.	H	α-helix	trans	-85.4	-35.8	176.5	-68.4	173.5	-144.9	0	0	111.2	I269 K270 F271	I269-E273 HydrophobicContact CG2-CB 3.58Å; K270-E273 HydrophobicContact CB-CG 4.39Å; K270-E273 PolarHBondContact O-N 2.91Å; F271-E273 VanDerWaalsContact C-N 3.32Å
274	L	96.4	Very high	92.2	Very high	22 Å²	22	81.8 Å²	81.8	12%	0.115	41%	0.413	C	S	.	.	H	α-helix	trans	-71.3	-37.5	176.6	-173	60.1	0	0	0	111.8	L224 L241 I269 K270	L224-L274 HydrophobicContact CD1-CD1 4.28Å; L224-L274 HydrophobicContact CD1-CD2 4.48Å; L241-L274 HydrophobicContact CD2-CD2 4.3Å; I269-L274 HydrophobicContact CG2-CB 4.23Å; K270-L274 PolarHBondContact O-N 3.18Å
275	F	96.8	Very high	91.7	Very high	0 Å²	0	84.4 Å²	84.4	0%	0	42%	0.418	C	S	.	.	S	Bend	trans	-127.3	74.1	178.8	-52.9	-75.7	0	0	0	110	A216 V219 L220 L224 F271 E272 I279 F280 R295 L298 L302	A216-F275 HydrophobicContact CB-CE1 3.62Å; A216-F275 HydrophobicContact CB-CZ 3.68Å; V219-F275 HydrophobicContact CG2-CD1 3.75Å; V219-F275 HydrophobicContact CG2-CE1 4.04Å; L220-F275 HydrophobicContact CD1-CD1 4.25Å; L220-F275 HydrophobicContact CD1-CE1 3.67Å; L220-F275 HydrophobicContact CD2-CD1 4.27Å; L220-F275 HydrophobicContact CG-CD1 4.12Å; L220-F275 HydrophobicContact CG-CE1 3.97Å; L224-F275 HydrophobicContact CD1-CZ 4.33Å; L224-F275 HydrophobicContact CD2-CZ 4.39Å; F271-F275 AromaticContact CD1-CD2 3.67Å; F271-F275 HydrophobicContact CD1-CD2 3.67Å; F271-F275 AromaticContact CD1-CE2 3.59Å; F271-F275 HydrophobicContact CD1-CE2 3.59Å; F271-F275 HydrophobicContact CE1-CD2 4.27Å; F271-F275 AromaticContact CE1-CE2 3.71Å; F271-F275 HydrophobicContact CE1-CE2 3.71Å; F271-F275 HydrophobicContact CG-CD2 4.5Å; F271-F275 WeakPolarHBondContact O-CA 3.4Å; F271-F275 WeakPolarHBondContact O-CB 3.36Å; F271-F275 PolarHBondContact O-N 3.06Å; E272-F275 CarbonylContact O-C 3.58Å; F275-I279 HydrophobicContact CB-CD1 3.91Å; F275-I279 HydrophobicContact CD1-CD1 3.84Å; F275-I279 HydrophobicContact CG-CD1 4.38Å; F275-F280 HydrophobicContact CB-CE2 3.76Å; F275-F280 HydrophobicContact CB-CZ 3.85Å; F275-F280 WeakPolarHBondContact O-CE2 3.43Å; F275-R295 VanDerWaalsContact O-CZ 3.31Å; F275-R295 PolarHBondContact O-NE 2.95Å; F275-R295 PolarHBondContact O-NH2 2.98Å; F275-L298 HydrophobicContact CD1-CD1 3.97Å; F275-L298 HydrophobicContact CD2-CD1 3.98Å; F275-L298 HydrophobicContact CE1-CD1 4.06Å; F275-L298 HydrophobicContact CE2-CB 4.29Å; F275-L298 HydrophobicContact CE2-CD1 4.07Å; F275-L298 HydrophobicContact CG-CD1 3.93Å; F275-L298 HydrophobicContact CZ-CD1 4.11Å; F275-L298 HydrophobicContact CZ-CD2 4.25Å; F275-L302 HydrophobicContact CE2-CD1 4.16Å; F275-L302 HydrophobicContact CZ-CD1 3.9Å
276	P	95.2	Very high	91.3	Very high	27 Å²	27	85.5 Å²	85.5	18%	0.175	42%	0.418	C	S	.	.			trans	-70.1	153.9	-178.5	30.3	-35.9	0	0	0	111.7	E272 W278 I279	E272-P276 WeakPolarHBondContact O-CA 3.37Å; P276-W278 HydrophobicContact CG-CD2 4.34Å; P276-W278 HydrophobicContact CG-CG 4.48Å; P276-W278 HydrophobicContact CG-CZ2 3.83Å; P276-W278 PolarHBondContact O-N 3.43Å; P276-I279 HydrophobicContact CG-CG2 4.06Å; P276-I279 WeakPolarHBondContact O-CG1 3.41Å; P276-I279 PolarHBondContact O-N 2.89Å; P276-I279 VanDerWaalsContact O-N 3.15Å
277	D	92.5	Very high	90.9	Very high	100 Å²	100	83.9 Å²	83.9	54%	0.535	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-53.6	-32.9	-171.6	-67.9	-24.7	0	0	0	114.4	I279 F280 R295	D277-I279 VanDerWaalsContact C-N 3.25Å; D277-I279 PolarHBondContact O-N 3.33Å; D277-F280 PolarHBondContact O-N 3.02Å; D277-F280 VanDerWaalsContact O-N 3.12Å; D277-R295 IonicContact OD1-CZ 2.71Å; D277-R295 IonicContact OD1-NH1 2.85Å; D277-R295 PolarHBondContact OD1-NH1 2.67Å; D277-R295 VanDerWaalsContact OD1-NH1 3.15Å; D277-R295 IonicContact OD1-NH2 3.38Å; D277-R295 PolarHBondContact OD1-NH2 2.99Å
278	W	91.5	Very high	90.6	Very high	214 Å²	214	82.6 Å²	82.6	81%	0.811	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-69.9	-12.5	-176.1	63	-96.7	0	0	0	115.3	P276 F280	P276-W278 HydrophobicContact CG-CD2 4.34Å; P276-W278 HydrophobicContact CG-CG 4.48Å; P276-W278 HydrophobicContact CG-CZ2 3.83Å; P276-W278 PolarHBondContact O-N 3.43Å; W278-F280 VanDerWaalsContact C-N 3.35Å
279	I	93	Very high	90.5	Very high	25 Å²	25	86.4 Å²	86.4	13%	0.128	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-85.4	-13.9	173.4	76	176.8	0	0	0	112.3	V219 L220 F275 P276 D277	V219-I279 HydrophobicContact CB-CD1 4.03Å; V219-I279 HydrophobicContact CB-CG1 4.3Å; V219-I279 HydrophobicContact CG2-CD1 3.84Å; L220-I279 HydrophobicContact CD2-CD1 3.64Å; L220-I279 HydrophobicContact CG-CD1 4.25Å; F275-I279 HydrophobicContact CB-CD1 3.91Å; F275-I279 HydrophobicContact CD1-CD1 3.84Å; F275-I279 HydrophobicContact CG-CD1 4.38Å; P276-I279 HydrophobicContact CG-CG2 4.06Å; P276-I279 WeakPolarHBondContact O-CG1 3.41Å; P276-I279 PolarHBondContact O-N 2.89Å; P276-I279 VanDerWaalsContact O-N 3.15Å; D277-I279 VanDerWaalsContact C-N 3.25Å; D277-I279 PolarHBondContact O-N 3.33Å
280	F	92.2	Very high	90.4	Very high	10 Å²	10	85.2 Å²	85.2	4%	0.044	40%	0.4	C	S	.	.	S	Bend	trans	-92.8	152.4	178.7	-65.5	-88.8	0	0	0	110	V219 F275 D277 W278 S282 T291 A294 L298	V219-F280 HydrophobicContact CB-CE1 4.22Å; V219-F280 HydrophobicContact CG1-CD1 3.9Å; V219-F280 HydrophobicContact CG1-CE1 3.65Å; V219-F280 HydrophobicContact CG1-CZ 4.44Å; V219-F280 HydrophobicContact CG2-CE1 4.48Å; F275-F280 HydrophobicContact CB-CE2 3.76Å; F275-F280 HydrophobicContact CB-CZ 3.85Å; F275-F280 WeakPolarHBondContact O-CE2 3.43Å; D277-F280 PolarHBondContact O-N 3.02Å; D277-F280 VanDerWaalsContact O-N 3.12Å; W278-F280 VanDerWaalsContact C-N 3.35Å; F280-S282 PolarHBondContact O-N 3.42Å; F280-S282 VanDerWaalsContact O-N 3.12Å; F280-T291 HydrophobicContact CB-CG2 3.91Å; F280-T291 WeakPolarHBondContact CB-OG1 3.12Å; F280-T291 HydrophobicContact CD1-CG2 4.48Å; F280-T291 HydrophobicContact CD2-CG2 3.63Å; F280-T291 HydrophobicContact CE2-CG2 4.23Å; F280-T291 HydrophobicContact CG-CG2 3.76Å; F280-A294 HydrophobicContact CD1-CB 4.19Å; F280-A294 HydrophobicContact CE1-CB 3.7Å; F280-L298 HydrophobicContact CZ-CD1 4.26Å
281	P	83.6	Confident	90.3	Very high	43 Å²	43	78.8 Å²	78.8	28%	0.279	37%	0.373	S	S	.	.			trans	-64.1	114.5	169.5	-9.8	25.1	0	0	0	108.1	L123 H125 D287	L123-P281 WeakPolarHBondContact O-CG 3.32Å; H125-P281 PolarHBondContact CD2-O 2.9Å; H125-P281 PolarHBondContact NE2-O 3.33Å; H125-P281 VanDerWaalsContact NE2-O 3.12Å; P281-D287 WeakPolarHBondContact O-CB 3.27Å
282	S	77.9	Confident	90.2	Very high	56 Å²	56	80.4 Å²	80.4	39%	0.392	39%	0.389	S	S	.	.			trans	-140.8	82.9	-177.4	171.6	0	0	0	0	111.3	F280	F280-S282 PolarHBondContact O-N 3.42Å; F280-S282 VanDerWaalsContact O-N 3.12Å
283	E	75.5	Confident	90.3	Very high	194 Å²	194	77 Å²	77	91%	0.907	37%	0.373	S	S	*	.	S	Bend	trans	-101.2	-29.4	175.5	-62.3	-171	172.8	0	0	112.4	D287	E283-D287 PolarHBondContact N-OD2 3.01Å
284	S	82.6	Confident	90.3	Very high	49 Å²	49	70.9 Å²	70.9	34%	0.343	34%	0.344	S	S	.	.	S	Bend	trans	-124.1	164.6	-173.7	75.7	0	0	0	0	113.6	R286 D287 K288	S284-R286 PolarHBondContact O-N 3.5Å; S284-R286 PolarHBondContact OG-N 3.45Å; S284-D287 WeakPolarHBondContact CB-OD2 3.25Å; S284-D287 PolarHBondContact N-OD2 3.41Å; S284-D287 WeakPolarHBondContact O-CB 3.18Å; S284-D287 PolarHBondContact O-N 3.28Å; S284-D287 PolarHBondContact OG-N 3.09Å; S284-D287 PolarHBondContact OG-OD2 3.13Å; S284-K288 PolarHBondContact O-N 2.91Å
285	E	83.1	Confident	90.4	Very high	129 Å²	129	70.9 Å²	70.9	60%	0.603	34%	0.343	S	S	*	.	H	α-helix	trans	-60.8	-29.2	171.5	-78.8	-58.1	141.8	0	0	112.9	D287 K288 I289	E285-D287 VanDerWaalsContact C-N 3.28Å; E285-D287 PolarHBondContact O-N 2.93Å; E285-K288 PolarHBondContact O-N 2.92Å; E285-K288 WeakPolarHBondContact OE1-CE 3.27Å; E285-K288 IonicContact OE1-NZ 3.07Å; E285-K288 PolarHBondContact OE1-NZ 2.87Å; E285-I289 PolarHBondContact O-N 3.33Å
286	R	85.2	Confident	90.5	Very high	207 Å²	207	73.7 Å²	73.7	78%	0.781	36%	0.358	S	S	*	.	H	α-helix	trans	-65.3	-37.1	173.8	-68.3	-177.4	179.7	-175.8	0.6	110.9	S284 K288 I289 K290	S284-R286 PolarHBondContact O-N 3.5Å; S284-R286 PolarHBondContact OG-N 3.45Å; R286-K288 VanDerWaalsContact C-N 3.34Å; R286-I289 PolarHBondContact O-N 3.35Å; R286-K290 WeakPolarHBondContact O-CG 3.28Å; R286-K290 PolarHBondContact O-N 3.25Å
287	D	87.5	Confident	90.6	Very high	38 Å²	38	72.4 Å²	72.4	20%	0.203	35%	0.35	C	S	.	.	H	α-helix	trans	-69.2	-32.9	178.3	-57.5	-39.6	0	0	0	112	H125 P281 E283 S284 E285 I289 K290 T291	H125-D287 IonicContact CD2-OD1 2.69Å; H125-D287 PolarHBondContact NE2-O 2.89Å; P281-D287 WeakPolarHBondContact O-CB 3.27Å; E283-D287 PolarHBondContact N-OD2 3.01Å; S284-D287 WeakPolarHBondContact CB-OD2 3.25Å; S284-D287 PolarHBondContact N-OD2 3.41Å; S284-D287 WeakPolarHBondContact O-CB 3.18Å; S284-D287 PolarHBondContact O-N 3.28Å; S284-D287 PolarHBondContact OG-N 3.09Å; S284-D287 PolarHBondContact OG-OD2 3.13Å; E285-D287 VanDerWaalsContact C-N 3.28Å; E285-D287 PolarHBondContact O-N 2.93Å; D287-I289 VanDerWaalsContact C-N 3.34Å; D287-I289 PolarHBondContact O-N 3.42Å; D287-K290 CarbonylContact O-C 3.54Å; D287-K290 PolarHBondContact O-N 2.94Å; D287-T291 VanDerWaalsContact O-CB 3.31Å; D287-T291 WeakPolarHBondContact O-CB 3.36Å; D287-T291 PolarHBondContact O-N 3.48Å; D287-T291 PolarHBondContact O-OG1 3.22Å
288	K	90.3	Very high	90.9	Very high	109 Å²	109	67.7 Å²	67.7	47%	0.474	32%	0.324	S	S	.	.	H	α-helix	trans	-62.1	-41.5	173.1	-65.5	-175.8	-173.7	169.3	0	112.4	S284 E285 R286 T291 S292	S284-K288 PolarHBondContact O-N 2.91Å; E285-K288 PolarHBondContact O-N 2.92Å; E285-K288 WeakPolarHBondContact OE1-CE 3.27Å; E285-K288 IonicContact OE1-NZ 3.07Å; E285-K288 PolarHBondContact OE1-NZ 2.87Å; R286-K288 VanDerWaalsContact C-N 3.34Å; K288-T291 PolarHBondContact O-N 3.49Å; K288-S292 PolarHBondContact O-N 3.49Å; K288-S292 VanDerWaalsContact O-N 3.1Å
289	I	93.2	Very high	91.3	Very high	102 Å²	102	59.3 Å²	59.3	52%	0.523	30%	0.299	S	S	.	.	H	α-helix	trans	-63.5	-45.8	174.1	-62.8	172.8	0	0	0	109.8	E285 R286 D287 T291 S292 Q293	E285-I289 PolarHBondContact O-N 3.33Å; R286-I289 PolarHBondContact O-N 3.35Å; D287-I289 VanDerWaalsContact C-N 3.34Å; D287-I289 PolarHBondContact O-N 3.42Å; I289-T291 PolarHBondContact O-N 3.19Å; I289-S292 PolarHBondContact O-N 2.98Å; I289-Q293 HydrophobicContact CG2-CG 4.47Å; I289-Q293 VanDerWaalsContact O-CG 3.31Å; I289-Q293 WeakPolarHBondContact O-CG 3.43Å; I289-Q293 PolarHBondContact O-N 2.94Å
290	K	94.9	Very high	91.5	Very high	45 Å²	45	61.8 Å²	61.8	20%	0.196	31%	0.308	C	S	.	.	H	α-helix	trans	-64.2	-37.3	178.5	-74.9	-73.4	-179.4	-175.9	0	112.9	H125 R286 D287 Q293 A294 Y320	H125-K290 HydrophobicContact CB-CB 4.06Å; H125-K290 HydrophobicContact CB-CG 4.34Å; R286-K290 WeakPolarHBondContact O-CG 3.28Å; R286-K290 PolarHBondContact O-N 3.25Å; D287-K290 CarbonylContact O-C 3.54Å; D287-K290 PolarHBondContact O-N 2.94Å; K290-Q293 CarbonylContact O-C 3.59Å; K290-Q293 PolarHBondContact O-N 3.14Å; K290-A294 WeakPolarHBondContact O-CB 3.34Å; K290-A294 PolarHBondContact O-N 2.98Å; K290-Y320 HydrophobicContact CB-CE2 4.2Å; K290-Y320 HydrophobicContact CD-CD2 3.95Å; K290-Y320 HydrophobicContact CD-CE2 4.03Å; K290-Y320 WeakPolarHBondContact O-CD2 3.2Å; K290-Y320 WeakPolarHBondContact O-CE2 3.32Å
291	T	95.4	Very high	91.8	Very high	3 Å²	3	61.3 Å²	61.3	2%	0.018	31%	0.306	C	S	.	.	H	α-helix	trans	-59.7	-47.9	173.2	-69.3	0	0	0	0	110.7	H125 F280 D287 K288 I289 Q293 A294 R295	H125-T291 PolarHBondContact NE2-N 2.91Å; H125-T291 PolarHBondContact NE2-OG1 2.81Å; H125-T291 VanDerWaalsContact NE2-OG1 3.15Å; F280-T291 HydrophobicContact CB-CG2 3.91Å; F280-T291 WeakPolarHBondContact CB-OG1 3.12Å; F280-T291 HydrophobicContact CD1-CG2 4.48Å; F280-T291 HydrophobicContact CD2-CG2 3.63Å; F280-T291 HydrophobicContact CE2-CG2 4.23Å; F280-T291 HydrophobicContact CG-CG2 3.76Å; D287-T291 VanDerWaalsContact O-CB 3.31Å; D287-T291 WeakPolarHBondContact O-CB 3.36Å; D287-T291 PolarHBondContact O-N 3.48Å; D287-T291 PolarHBondContact O-OG1 3.22Å; K288-T291 PolarHBondContact O-N 3.49Å; I289-T291 PolarHBondContact O-N 3.19Å; T291-Q293 PolarHBondContact O-N 3.2Å; T291-A294 PolarHBondContact O-N 3.46Å; T291-R295 WeakPolarHBondContact O-CB 2.94Å; T291-R295 PolarHBondContact O-N 3.46Å
292	S	95.6	Very high	92.5	Very high	71 Å²	71	59.5 Å²	59.5	50%	0.497	29%	0.294	S	S	.	.	H	α-helix	trans	-60.5	-44.2	174.9	-176.8	0	0	0	0	111.9	K288 I289 A294 R295 D296	K288-S292 PolarHBondContact O-N 3.49Å; K288-S292 VanDerWaalsContact O-N 3.1Å; I289-S292 PolarHBondContact O-N 2.98Å; S292-A294 PolarHBondContact O-N 3.33Å; S292-R295 PolarHBondContact O-N 2.96Å; S292-D296 WeakPolarHBondContact O-CB 3.26Å; S292-D296 PolarHBondContact O-N 3.31Å
293	Q	97.2	Very high	93.5	Very high	44 Å²	44	58.4 Å²	58.4	21%	0.206	29%	0.285	C	S	.	.	H	α-helix	trans	-64.8	-38.1	176.4	-68.6	174.1	-4.2	0	0	112.9	I289 K290 T291 L297 H318 P319 Y320	I289-Q293 HydrophobicContact CG2-CG 4.47Å; I289-Q293 VanDerWaalsContact O-CG 3.31Å; I289-Q293 WeakPolarHBondContact O-CG 3.43Å; I289-Q293 PolarHBondContact O-N 2.94Å; K290-Q293 CarbonylContact O-C 3.59Å; K290-Q293 PolarHBondContact O-N 3.14Å; T291-Q293 PolarHBondContact O-N 3.2Å; Q293-L297 WeakPolarHBondContact O-CB 3.39Å; Q293-L297 PolarHBondContact O-N 2.85Å; Q293-H318 PolarHBondContact O-CE1 3.27Å; Q293-P319 HydrophobicContact CG-CB 4.12Å; Q293-P319 PolarHBondContact OE1-O 3.3Å; Q293-Y320 HydrophobicContact CB-CD2 3.92Å; Q293-Y320 HydrophobicContact CB-CG 4.37Å
294	A	97.5	Very high	94.6	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.4	-45.2	177.3	0	0	0	0	0	110.9	M215 F280 K290 T291 S292 L297 L298 Y320	M215-A294 HydrophobicContact CE-CB 3.77Å; M215-A294 VanDerWaalsContact CE-O 3.28Å; M215-A294 WeakPolarHBondContact CE-O 3.37Å; F280-A294 HydrophobicContact CD1-CB 4.19Å; F280-A294 HydrophobicContact CE1-CB 3.7Å; K290-A294 WeakPolarHBondContact O-CB 3.34Å; K290-A294 PolarHBondContact O-N 2.98Å; T291-A294 PolarHBondContact O-N 3.46Å; S292-A294 PolarHBondContact O-N 3.33Å; A294-L297 PolarHBondContact O-N 2.91Å; A294-L298 PolarHBondContact O-N 3.38Å; A294-Y320 HydrophobicContact CB-CD1 4.43Å; A294-Y320 HydrophobicContact CB-CD2 4.04Å; A294-Y320 HydrophobicContact CB-CE1 4.07Å; A294-Y320 HydrophobicContact CB-CE2 3.67Å; A294-Y320 HydrophobicContact CB-CG 4.42Å
295	R	97.7	Very high	95.2	Very high	22 Å²	22	48 Å²	48	8%	0.083	23%	0.231	C	C	.	.	H	α-helix	trans	-63.7	-43	176.1	-174.3	-178	-61.9	113.8	7	112.3	F271 F275 D277 T291 S292 L297 L298 S299	F271-R295 HydrophobicContact CB-CG 4.02Å; F275-R295 VanDerWaalsContact O-CZ 3.31Å; F275-R295 PolarHBondContact O-NE 2.95Å; F275-R295 PolarHBondContact O-NH2 2.98Å; D277-R295 IonicContact OD1-CZ 2.71Å; D277-R295 IonicContact OD1-NH1 2.85Å; D277-R295 PolarHBondContact OD1-NH1 2.67Å; D277-R295 VanDerWaalsContact OD1-NH1 3.15Å; D277-R295 IonicContact OD1-NH2 3.38Å; D277-R295 PolarHBondContact OD1-NH2 2.99Å; T291-R295 WeakPolarHBondContact O-CB 2.94Å; T291-R295 PolarHBondContact O-N 3.46Å; S292-R295 PolarHBondContact O-N 2.96Å; R295-L297 VanDerWaalsContact C-N 3.33Å; R295-L297 PolarHBondContact O-N 3.45Å; R295-L298 WeakPolarHBondContact O-CB 3.2Å; R295-L298 PolarHBondContact O-N 2.92Å; R295-S299 PolarHBondContact O-N 2.97Å
296	D	98.4	Very high	95.9	Very high	60 Å²	60	42.3 Å²	42.3	32%	0.321	21%	0.206	S	C	.	.	H	α-helix	trans	-60	-43.6	175.1	-179.2	48.2	0	0	0	111	S292 S299 K300 H318	S292-D296 WeakPolarHBondContact O-CB 3.26Å; S292-D296 PolarHBondContact O-N 3.31Å; D296-S299 PolarHBondContact O-N 3.16Å; D296-S299 PolarHBondContact O-OG 3.22Å; D296-K300 VanDerWaalsContact CG-NZ 3.3Å; D296-K300 WeakPolarHBondContact O-CG 3.37Å; D296-K300 PolarHBondContact O-N 2.91Å; D296-K300 WeakPolarHBondContact OD1-CE 3.33Å; D296-K300 IonicContact OD1-NZ 3.39Å; D296-K300 PolarHBondContact OD1-NZ 2.77Å; D296-K300 IonicContact OD2-NZ 3.34Å; D296-K300 PolarHBondContact OD2-NZ 3.48Å; D296-H318 IonicContact OD2-CE1 2.66Å; D296-H318 IonicContact OD2-NE2 3.89Å; D296-H318 PolarHBondContact OD2-NE2 3.39Å
297	L	98.7	Very high	96.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.8	-46.7	175.1	-172.9	56.2	0	0	0	112.2	M215 Q293 A294 R295 S299 K300 M301 I310 H318 Y320 I321	M215-L297 HydrophobicContact CE-CB 4.43Å; M215-L297 HydrophobicContact CE-CD2 4.37Å; M215-L297 HydrophobicContact SD-CD2 4.12Å; M215-L297 HydrophobicContact SD-CG 4.32Å; Q293-L297 WeakPolarHBondContact O-CB 3.39Å; Q293-L297 PolarHBondContact O-N 2.85Å; A294-L297 PolarHBondContact O-N 2.91Å; R295-L297 VanDerWaalsContact C-N 3.33Å; R295-L297 PolarHBondContact O-N 3.45Å; L297-S299 VanDerWaalsContact C-N 3.26Å; L297-S299 PolarHBondContact O-N 2.95Å; L297-K300 PolarHBondContact O-N 2.76Å; L297-K300 VanDerWaalsContact O-N 3.09Å; L297-M301 HydrophobicContact CD1-CE 3.77Å; L297-M301 HydrophobicContact CD1-CG 4.21Å; L297-M301 HydrophobicContact CD1-SD 4.39Å; L297-M301 HydrophobicContact CD2-CE 4.02Å; L297-M301 HydrophobicContact CG-CE 3.87Å; L297-M301 HydrophobicContact CG-CG 4.34Å; L297-M301 HydrophobicContact CG-SD 4.1Å; L297-M301 WeakPolarHBondContact O-CG 3.46Å; L297-M301 PolarHBondContact O-N 3.08Å; L297-I310 HydrophobicContact CD1-CD1 4.39Å; L297-H318 HydrophobicContact CD1-CB 3.93Å; L297-Y320 HydrophobicContact CD2-CD1 4.01Å; L297-I321 HydrophobicContact CD2-CD1 3.91Å; L297-I321 HydrophobicContact CD2-CG1 3.66Å
298	L	98.6	Very high	96.8	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-54.8	-43.8	174.5	-81.2	165.3	0	0	0	111.4	M215 A216 V219 F271 F275 F280 A294 R295 K300 M301 L302	M215-L298 HydrophobicContact CB-CD2 3.91Å; M215-L298 HydrophobicContact CE-CD1 4.27Å; M215-L298 HydrophobicContact CE-CG 3.92Å; M215-L298 HydrophobicContact CG-CD2 3.75Å; M215-L298 HydrophobicContact CG-CG 4.08Å; M215-L298 HydrophobicContact SD-CD2 3.91Å; M215-L298 HydrophobicContact SD-CG 3.79Å; A216-L298 HydrophobicContact CB-CD2 4.02Å; V219-L298 HydrophobicContact CG2-CD1 4.39Å; F271-L298 HydrophobicContact CD1-CB 4.18Å; F271-L298 HydrophobicContact CE1-CB 4.12Å; F275-L298 HydrophobicContact CD1-CD1 3.97Å; F275-L298 HydrophobicContact CD2-CD1 3.98Å; F275-L298 HydrophobicContact CE1-CD1 4.06Å; F275-L298 HydrophobicContact CE2-CB 4.29Å; F275-L298 HydrophobicContact CE2-CD1 4.07Å; F275-L298 HydrophobicContact CG-CD1 3.93Å; F275-L298 HydrophobicContact CZ-CD1 4.11Å; F275-L298 HydrophobicContact CZ-CD2 4.25Å; F280-L298 HydrophobicContact CZ-CD1 4.26Å; A294-L298 PolarHBondContact O-N 3.38Å; R295-L298 WeakPolarHBondContact O-CB 3.2Å; R295-L298 PolarHBondContact O-N 2.92Å; L298-K300 PolarHBondContact O-N 3.06Å; L298-M301 PolarHBondContact O-N 2.69Å; L298-L302 HydrophobicContact CD2-CD1 3.97Å; L298-L302 WeakPolarHBondContact O-CB 3.09Å; L298-L302 PolarHBondContact O-N 2.95Å
299	S	98.3	Very high	97.2	Very high	39 Å²	39	36.2 Å²	36.2	27%	0.273	19%	0.188	S	C	.	.	H	α-helix	trans	-63.5	-27.3	179.5	83.4	0	0	0	0	114	R295 D296 L297 V303	R295-S299 PolarHBondContact O-N 2.97Å; D296-S299 PolarHBondContact O-N 3.16Å; D296-S299 PolarHBondContact O-OG 3.22Å; L297-S299 VanDerWaalsContact C-N 3.26Å; L297-S299 PolarHBondContact O-N 2.95Å; S299-V303 WeakPolarHBondContact O-CG2 3.5Å
300	K	98.6	Very high	97.5	Very high	77 Å²	77	32.1 Å²	32.1	34%	0.335	17%	0.167	S	C	.	.	H	α-helix	trans	-89	-28.1	179.1	-71.4	171.2	-178.6	164.6	0	112.9	D296 L297 L298 V303 I310 H318	D296-K300 VanDerWaalsContact CG-NZ 3.3Å; D296-K300 WeakPolarHBondContact O-CG 3.37Å; D296-K300 PolarHBondContact O-N 2.91Å; D296-K300 WeakPolarHBondContact OD1-CE 3.33Å; D296-K300 IonicContact OD1-NZ 3.39Å; D296-K300 PolarHBondContact OD1-NZ 2.77Å; D296-K300 IonicContact OD2-NZ 3.34Å; D296-K300 PolarHBondContact OD2-NZ 3.48Å; L297-K300 PolarHBondContact O-N 2.76Å; L297-K300 VanDerWaalsContact O-N 3.09Å; L298-K300 PolarHBondContact O-N 3.06Å; K300-V303 WeakPolarHBondContact O-CG2 3.46Å; K300-I310 HydrophobicContact CB-CB 4Å; K300-I310 HydrophobicContact CB-CD1 4.11Å; K300-I310 HydrophobicContact CB-CG2 4.08Å; K300-I310 HydrophobicContact CD-CD1 4.17Å; K300-I310 VanDerWaalsContact O-CG2 3.3Å; K300-I310 WeakPolarHBondContact O-CG2 3.43Å; K300-I310 PolarHBondContact O-N 3.28Å; K300-I310 VanDerWaalsContact O-N 3.08Å; K300-H318 PolarHBondContact NZ-NE2 2.66Å
301	M	98.7	Very high	97.6	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-83.8	-44.1	176.6	-67.3	-172.7	165	0	0	112.8	L136 I208 V211 L297 L298 V303 R309 I310 A315	L136-M301 HydrophobicContact CD1-CE 4.36Å; L136-M301 HydrophobicContact CD2-CE 4.29Å; I208-M301 HydrophobicContact CG2-CB 3.96Å; I208-M301 HydrophobicContact CG2-CG 3.77Å; V211-M301 HydrophobicContact CB-SD 4.42Å; V211-M301 HydrophobicContact CG1-CE 4.01Å; V211-M301 HydrophobicContact CG1-SD 4.01Å; L297-M301 HydrophobicContact CD1-CE 3.77Å; L297-M301 HydrophobicContact CD1-CG 4.21Å; L297-M301 HydrophobicContact CD1-SD 4.39Å; L297-M301 HydrophobicContact CD2-CE 4.02Å; L297-M301 HydrophobicContact CG-CE 3.87Å; L297-M301 HydrophobicContact CG-CG 4.34Å; L297-M301 HydrophobicContact CG-SD 4.1Å; L297-M301 WeakPolarHBondContact O-CG 3.46Å; L297-M301 PolarHBondContact O-N 3.08Å; L298-M301 PolarHBondContact O-N 2.69Å; M301-V303 PolarHBondContact O-N 3.25Å; M301-R309 WeakPolarHBondContact O-CD 3.27Å; M301-R309 WeakPolarHBondContact O-CG 3.39Å; M301-I310 HydrophobicContact CG-CG2 3.86Å; M301-A315 HydrophobicContact CE-CB 3.94Å
302	L	98.7	Very high	97.8	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.021	17%	0.173	C	C	.	.	S	Bend	trans	-84.8	56.5	-177.9	-66.5	175.5	0	0	0	111.5	A216 L224 F225 L241 F271 F275 L298	A216-L302 HydrophobicContact CB-CD1 4.21Å; L224-L302 HydrophobicContact CD2-CD1 3.6Å; L224-L302 HydrophobicContact CD2-CD2 4.21Å; F225-L302 HydrophobicContact CE2-CD2 4.27Å; L241-L302 HydrophobicContact CD1-CB 4.4Å; L241-L302 WeakPolarHBondContact CD1-O 3.14Å; F271-L302 HydrophobicContact CE1-CB 4.15Å; F271-L302 HydrophobicContact CE1-CD1 4.19Å; F271-L302 HydrophobicContact CZ-CB 3.95Å; F275-L302 HydrophobicContact CE2-CD1 4.16Å; F275-L302 HydrophobicContact CZ-CD1 3.9Å; L298-L302 HydrophobicContact CD2-CD1 3.97Å; L298-L302 WeakPolarHBondContact O-CB 3.09Å; L298-L302 PolarHBondContact O-N 2.95Å
303	V	98.3	Very high	97.8	Very high	33 Å²	33	31.9 Å²	31.9	20%	0.2	17%	0.165	C	C	.	.			trans	-109.9	125.5	178.8	179.9	0	0	0	0	109.5	S299 K300 M301 K308 R309	S299-V303 WeakPolarHBondContact O-CG2 3.5Å; K300-V303 WeakPolarHBondContact O-CG2 3.46Å; M301-V303 PolarHBondContact O-N 3.25Å; V303-K308 HydrophobicContact CG1-CB 3.87Å; V303-R309 HydrophobicContact CB-CB 4Å; V303-R309 HydrophobicContact CB-CG 4.25Å; V303-R309 HydrophobicContact CG1-CB 4.49Å; V303-R309 PolarHBondContact O-NE 3.38Å; V303-R309 PolarHBondContact O-NH2 3.43Å
304	I	97.7	Very high	97.9	Very high	15 Å²	15	35 Å²	35	8%	0.077	18%	0.18	C	C	.	.	S	Bend	trans	-63.6	-45.8	-176.8	-64.9	175.9	0	0	0	111.6	P194 W209 W234 V237 I238 L241 G242 P244 F248 P306 R309	P194-I304 HydrophobicContact CB-CG2 4.08Å; P194-I304 HydrophobicContact CG-CB 4.48Å; P194-I304 HydrophobicContact CG-CG1 4.49Å; P194-I304 HydrophobicContact CG-CG2 4.16Å; W209-I304 HydrophobicContact CZ3-CG1 4.44Å; W234-I304 HydrophobicContact CH2-CG2 4.05Å; W234-I304 HydrophobicContact CZ3-CG2 4.25Å; V237-I304 HydrophobicContact CG1-CD1 3.97Å; V237-I304 HydrophobicContact CG1-CG1 4.02Å; I238-I304 HydrophobicContact CG2-CD1 4.45Å; L241-I304 HydrophobicContact CB-CD1 4.09Å; L241-I304 HydrophobicContact CB-CG1 4.38Å; L241-I304 HydrophobicContact CD1-CG1 4.14Å; G242-I304 WeakPolarHBondContact O-CD1 3.17Å; P244-I304 HydrophobicContact CB-CG2 4.02Å; F248-I304 HydrophobicContact CD1-CG2 4.48Å; F248-I304 HydrophobicContact CD2-CG2 4.45Å; F248-I304 HydrophobicContact CE1-CG2 4.01Å; F248-I304 HydrophobicContact CE2-CG2 3.97Å; F248-I304 HydrophobicContact CZ-CG2 3.72Å; I304-P306 VanDerWaalsContact O-CD 3.3Å; I304-P306 WeakPolarHBondContact O-CD 3.3Å; I304-R309 PolarHBondContact O-NH2 2.82Å
305	D	96.6	Very high	98	Very high	9 Å²	9	35 Å²	35	5%	0.048	18%	0.18	C	C	.	.	S	Bend	trans	-77.9	113.1	-179.4	-168.6	-10.1	0	0	0	110.3	F248 K251 D307 K308 R309	F248-D305 HydrophobicContact CD2-CB 3.97Å; K251-D305 IonicContact NZ-OD1 2.73Å; K251-D305 PolarHBondContact NZ-OD1 3.46Å; K251-D305 IonicContact NZ-OD2 3.41Å; K251-D305 PolarHBondContact NZ-OD2 3.33Å; D305-D307 PolarHBondContact O-N 2.9Å; D305-D307 VanDerWaalsContact O-N 3.08Å; D305-D307 PolarHBondContact OD1-N 2.88Å; D305-K308 HydrophobicContact CB-CB 4.4Å; D305-K308 HydrophobicContact CB-CD 4.26Å; D305-K308 HydrophobicContact CB-CG 4.29Å; D305-K308 PolarHBondContact O-N 3.28Å; D305-K308 IonicContact OD2-NZ 3.74Å; D305-R309 PolarHBondContact O-N 3.49Å
306	P	96.6	Very high	98	Very high	10 Å²	10	34 Å²	34	7%	0.065	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-18.8	-178.1	26.3	-35.3	0	0	0	112.6	K203 N205 I304 K308	K203-P306 WeakPolarHBondContact CE-O 3.37Å; K203-P306 PolarHBondContact NZ-O 3.09Å; N205-P306 PolarHBondContact ND2-O 2.95Å; I304-P306 VanDerWaalsContact O-CD 3.3Å; I304-P306 WeakPolarHBondContact O-CD 3.3Å; P306-K308 VanDerWaalsContact C-N 3.28Å; P306-K308 PolarHBondContact O-N 3.46Å
307	D	95.7	Very high	98	Very high	99 Å²	99	38.7 Å²	38.7	53%	0.529	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-14.6	175.6	-64.4	-31.5	0	0	0	114	K203 K251 D305	K203-D307 IonicContact NZ-OD1 2.57Å; K203-D307 PolarHBondContact NZ-OD1 3.1Å; K251-D307 IonicContact NZ-OD2 2.71Å; K251-D307 PolarHBondContact NZ-OD2 3.21Å; D305-D307 PolarHBondContact O-N 2.9Å; D305-D307 VanDerWaalsContact O-N 3.08Å; D305-D307 PolarHBondContact OD1-N 2.88Å
308	K	97.1	Very high	98	Very high	120 Å²	120	39 Å²	39	52%	0.522	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-10.6	178.5	-58.5	179.7	-172	177	0	112.5	E247 V303 D305 P306	E247-K308 IonicContact OE2-NZ 2.65Å; V303-K308 HydrophobicContact CG1-CB 3.87Å; D305-K308 HydrophobicContact CB-CB 4.4Å; D305-K308 HydrophobicContact CB-CD 4.26Å; D305-K308 HydrophobicContact CB-CG 4.29Å; D305-K308 PolarHBondContact O-N 3.28Å; D305-K308 IonicContact OD2-NZ 3.74Å; P306-K308 VanDerWaalsContact C-N 3.28Å; P306-K308 PolarHBondContact O-N 3.46Å
309	R	98.4	Very high	97.9	Very high	8 Å²	8	42.1 Å²	42.1	3%	0.03	21%	0.211	C	C	.	.	S	Bend	trans	-74.7	135	178.5	-169	-174.2	-55	146.6	4.9	110.3	E195 N205 I208 M301 V303 I304 D305	E195-R309 IonicContact OE1-CZ 2.9Å; E195-R309 IonicContact OE1-NH1 3.39Å; E195-R309 PolarHBondContact OE1-NH1 3.32Å; E195-R309 IonicContact OE1-NH2 2.79Å; E195-R309 PolarHBondContact OE1-NH2 3.06Å; E195-R309 IonicContact OE2-CZ 3.48Å; E195-R309 IonicContact OE2-NH1 2.68Å; E195-R309 IonicContact OE2-NH2 2.65Å; E195-R309 PolarHBondContact OE2-NH2 3.42Å; N205-R309 PolarHBondContact ND2-O 3.01Å; N205-R309 VanDerWaalsContact ND2-O 3.13Å; N205-R309 WeakPolarHBondContact O-CD 3.47Å; N205-R309 PolarHBondContact O-NH1 3.04Å; I208-R309 HydrophobicContact CG2-CG 4.04Å; M301-R309 WeakPolarHBondContact O-CD 3.27Å; M301-R309 WeakPolarHBondContact O-CG 3.39Å; V303-R309 HydrophobicContact CB-CB 4Å; V303-R309 HydrophobicContact CB-CG 4.25Å; V303-R309 HydrophobicContact CG1-CB 4.49Å; V303-R309 PolarHBondContact O-NE 3.38Å; V303-R309 PolarHBondContact O-NH2 3.43Å; I304-R309 PolarHBondContact O-NH2 2.82Å; D305-R309 PolarHBondContact O-N 3.49Å
310	I	98.6	Very high	97.9	Very high	16 Å²	16	40.2 Å²	40.2	8%	0.082	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-52.8	141.2	178.3	-164.1	170.9	0	0	0	111.8	I208 L297 K300 M301 E314 A315	I208-I310 HydrophobicContact CG2-CG2 3.73Å; L297-I310 HydrophobicContact CD1-CD1 4.39Å; K300-I310 HydrophobicContact CB-CB 4Å; K300-I310 HydrophobicContact CB-CD1 4.11Å; K300-I310 HydrophobicContact CB-CG2 4.08Å; K300-I310 HydrophobicContact CD-CD1 4.17Å; K300-I310 VanDerWaalsContact O-CG2 3.3Å; K300-I310 WeakPolarHBondContact O-CG2 3.43Å; K300-I310 PolarHBondContact O-N 3.28Å; K300-I310 VanDerWaalsContact O-N 3.08Å; M301-I310 HydrophobicContact CG-CG2 3.86Å; I310-E314 HydrophobicContact CD1-CB 3.84Å; I310-E314 HydrophobicContact CG1-CB 3.36Å; I310-E314 HydrophobicContact CG1-CG 4.48Å; I310-A315 HydrophobicContact CD1-CB 4.2Å; I310-A315 HydrophobicContact CG1-CB 4.46Å; I310-A315 HydrophobicContact CG2-CB 4.47Å
311	S	98.1	Very high	97.9	Very high	40 Å²	40	36.6 Å²	36.6	28%	0.28	18%	0.182	S	C	.	.	P	Polyproline II helix	trans	-78.6	166.4	172.4	65.4	0	0	0	0	111.8	D313 E314 A315	S311-D313 VanDerWaalsContact C-N 3.3Å; S311-D313 PolarHBondContact O-N 2.89Å; S311-E314 WeakPolarHBondContact CB-OE2 3.48Å; S311-E314 PolarHBondContact N-OE2 2.96Å; S311-E314 PolarHBondContact O-N 3.42Å; S311-E314 WeakPolarHBondContact OG-CB 3.27Å; S311-E314 WeakPolarHBondContact OG-CG 3.35Å; S311-E314 PolarHBondContact OG-N 2.72Å; S311-E314 PolarHBondContact OG-OE2 2.71Å; S311-A315 WeakPolarHBondContact O-CB 3.19Å; S311-A315 PolarHBondContact O-N 3.43Å
312	V	97.7	Very high	97.9	Very high	10 Å²	10	39.6 Å²	39.6	6%	0.061	20%	0.2	C	C	.	.	H	α-helix	trans	-60.6	-41.3	175.2	-178.2	0	0	0	0	111.4	L136 I139 K140 H143 I208 E314 A315 L316	L136-V312 HydrophobicContact CD2-CG1 4.26Å; I139-V312 HydrophobicContact CG2-CG2 3.83Å; K140-V312 HydrophobicContact CB-CG1 3.77Å; K140-V312 HydrophobicContact CG-CG1 4.48Å; H143-V312 WeakPolarHBondContact ND1-CG2 3.44Å; I208-V312 HydrophobicContact CD1-CB 4.37Å; I208-V312 HydrophobicContact CD1-CG2 3.81Å; I208-V312 HydrophobicContact CG1-CG2 3.86Å; V312-E314 PolarHBondContact O-N 2.57Å; V312-A315 PolarHBondContact O-N 3.02Å; V312-L316 HydrophobicContact CG1-CD1 4.17Å; V312-L316 WeakPolarHBondContact O-CG 3.38Å; V312-L316 PolarHBondContact O-N 3.21Å
313	D	97.4	Very high	97.8	Very high	63 Å²	63	43.4 Å²	43.4	34%	0.337	22%	0.224	S	C	.	.	H	α-helix	trans	-67.4	-35.7	-179.8	-71.5	-28.3	0	0	0	113.3	K140 S311 R317	K140-D313 WeakPolarHBondContact CE-OD1 3.35Å; K140-D313 IonicContact NZ-OD1 3.5Å; K140-D313 PolarHBondContact NZ-OD1 2.87Å; K140-D313 IonicContact NZ-OD2 3.24Å; S311-D313 VanDerWaalsContact C-N 3.3Å; S311-D313 PolarHBondContact O-N 2.89Å; D313-R317 WeakPolarHBondContact O-CG 3.48Å; D313-R317 PolarHBondContact O-N 3.38Å; D313-R317 PolarHBondContact O-NE 2.86Å
314	E	98.3	Very high	97.8	Very high	110 Å²	110	45.1 Å²	45.1	51%	0.514	23%	0.227	S	C	.	.	H	α-helix	trans	-73.2	-37.5	174.3	-70.2	164	140.7	0	0	111.1	I310 S311 V312 R317 H318	I310-E314 HydrophobicContact CD1-CB 3.84Å; I310-E314 HydrophobicContact CG1-CB 3.36Å; I310-E314 HydrophobicContact CG1-CG 4.48Å; S311-E314 WeakPolarHBondContact CB-OE2 3.48Å; S311-E314 PolarHBondContact N-OE2 2.96Å; S311-E314 PolarHBondContact O-N 3.42Å; S311-E314 WeakPolarHBondContact OG-CB 3.27Å; S311-E314 WeakPolarHBondContact OG-CG 3.35Å; S311-E314 PolarHBondContact OG-N 2.72Å; S311-E314 PolarHBondContact OG-OE2 2.71Å; V312-E314 PolarHBondContact O-N 2.57Å; E314-R317 CarbonylContact O-C 3.43Å; E314-R317 PolarHBondContact O-N 3.03Å; E314-H318 PolarHBondContact O-N 3.49Å; E314-H318 VanDerWaalsContact O-N 3.12Å
315	A	98.6	Very high	97.8	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-65.2	-40.3	176.7	0	0	0	0	0	112.2	L136 I208 M301 I310 S311 V312 R317 H318 I321	L136-A315 HydrophobicContact CD1-CB 3.89Å; L136-A315 HydrophobicContact CD2-CB 3.91Å; I208-A315 HydrophobicContact CD1-CB 4.21Å; M301-A315 HydrophobicContact CE-CB 3.94Å; I310-A315 HydrophobicContact CD1-CB 4.2Å; I310-A315 HydrophobicContact CG1-CB 4.46Å; I310-A315 HydrophobicContact CG2-CB 4.47Å; S311-A315 WeakPolarHBondContact O-CB 3.19Å; S311-A315 PolarHBondContact O-N 3.43Å; V312-A315 PolarHBondContact O-N 3.02Å; A315-R317 VanDerWaalsContact C-N 3.25Å; A315-R317 PolarHBondContact O-N 3.43Å; A315-H318 WeakPolarHBondContact O-CB 3.3Å; A315-H318 PolarHBondContact O-N 3.46Å; A315-H318 VanDerWaalsContact O-N 3.12Å; A315-I321 WeakPolarHBondContact O-CB 3.49Å
316	L	98.3	Very high	97.8	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-62.8	-31.6	174.1	-78	166.9	0	0	0	112.9	Y133 L136 K140 V312 H318 I321 T322 Y325 A330	Y133-L316 HydrophobicContact CD2-CD2 3.86Å; Y133-L316 HydrophobicContact CE2-CD2 4.07Å; L136-L316 HydrophobicContact CB-CD2 3.58Å; L136-L316 HydrophobicContact CB-CG 3.9Å; L136-L316 HydrophobicContact CD1-CD2 4.35Å; L136-L316 HydrophobicContact CD1-CG 4.49Å; K140-L316 HydrophobicContact CB-CD1 4.38Å; K140-L316 HydrophobicContact CD-CD1 3.47Å; K140-L316 VanDerWaalsContact CD-CD1 3.47Å; V312-L316 HydrophobicContact CG1-CD1 4.17Å; V312-L316 WeakPolarHBondContact O-CG 3.38Å; V312-L316 PolarHBondContact O-N 3.21Å; L316-H318 VanDerWaalsContact C-N 3.34Å; L316-I321 HydrophobicContact CD2-CG2 4.4Å; L316-T322 WeakPolarHBondContact O-CA 3.47Å; L316-Y325 HydrophobicContact CB-CD2 4.23Å; L316-Y325 HydrophobicContact CB-CE2 4.16Å; L316-A330 HydrophobicContact CD1-CB 4.32Å
317	R	98.2	Very high	97.7	Very high	159 Å²	159	53 Å²	53	60%	0.6	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	0.3	176	-70.9	-174.4	-109.6	-120.5	3.8	113.9	D313 E314 A315	D313-R317 WeakPolarHBondContact O-CG 3.48Å; D313-R317 PolarHBondContact O-N 3.38Å; D313-R317 PolarHBondContact O-NE 2.86Å; E314-R317 CarbonylContact O-C 3.43Å; E314-R317 PolarHBondContact O-N 3.03Å; A315-R317 VanDerWaalsContact C-N 3.25Å; A315-R317 PolarHBondContact O-N 3.43Å
318	H	98.7	Very high	97.7	Very high	7 Å²	7	51.8 Å²	51.8	3%	0.032	27%	0.272	C	S	.	.	S	Bend	trans	-66	140.8	-179.7	-164.5	-95	0	0	0	111.1	Q293 D296 L297 K300 E314 A315 L316 Y320 I321 T322	Q293-H318 PolarHBondContact O-CE1 3.27Å; D296-H318 IonicContact OD2-CE1 2.66Å; D296-H318 IonicContact OD2-NE2 3.89Å; D296-H318 PolarHBondContact OD2-NE2 3.39Å; L297-H318 HydrophobicContact CD1-CB 3.93Å; K300-H318 PolarHBondContact NZ-NE2 2.66Å; E314-H318 PolarHBondContact O-N 3.49Å; E314-H318 VanDerWaalsContact O-N 3.12Å; A315-H318 WeakPolarHBondContact O-CB 3.3Å; A315-H318 PolarHBondContact O-N 3.46Å; A315-H318 VanDerWaalsContact O-N 3.12Å; L316-H318 VanDerWaalsContact C-N 3.34Å; H318-Y320 PolarHBondContact ND1-N 2.78Å; H318-Y320 PolarHBondContact O-N 3.05Å; H318-I321 HydrophobicContact CB-CG1 4.49Å; H318-I321 PolarHBondContact O-N 3.27Å; H318-T322 WeakPolarHBondContact O-CB 3.31Å; H318-T322 WeakPolarHBondContact O-CG2 3.32Å; H318-T322 PolarHBondContact O-N 2.8Å
319	P	98.1	Very high	97.6	Very high	64 Å²	64	48.2 Å²	48.2	42%	0.416	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-28	-179.1	-30	36.3	0	0	0	115.4	Q293	Q293-P319 HydrophobicContact CG-CB 4.12Å; Q293-P319 PolarHBondContact OE1-O 3.3Å
320	Y	98.1	Very high	97.5	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-34	175.5	-163.2	-117.7	0	0	0	113	H125 M128 S129 L132 M215 K290 Q293 A294 L297 H318	H125-Y320 HydrophobicContact CB-CE2 4.34Å; H125-Y320 AromaticContact ND1-CE2 3.48Å; H125-Y320 WeakPolarHBondContact ND1-CE2 3.44Å; H125-Y320 AromaticContact ND1-CZ 3.6Å; H125-Y320 PolarHBondContact ND1-OH 3.42Å; M128-Y320 PolarHBondContact SD-OH 3.12Å; M128-Y320 VanDerWaalsContact SD-OH 3.42Å; S129-Y320 VanDerWaalsContact CB-O 3.3Å; S129-Y320 WeakPolarHBondContact CB-O 3.47Å; L132-Y320 HydrophobicContact CD1-CD1 4.35Å; L132-Y320 HydrophobicContact CD1-CE1 3.94Å; M215-Y320 HydrophobicContact CE-CD1 4.14Å; M215-Y320 HydrophobicContact CE-CE1 3.86Å; K290-Y320 HydrophobicContact CB-CE2 4.2Å; K290-Y320 HydrophobicContact CD-CD2 3.95Å; K290-Y320 HydrophobicContact CD-CE2 4.03Å; K290-Y320 WeakPolarHBondContact O-CD2 3.2Å; K290-Y320 WeakPolarHBondContact O-CE2 3.32Å; Q293-Y320 HydrophobicContact CB-CD2 3.92Å; Q293-Y320 HydrophobicContact CB-CG 4.37Å; A294-Y320 HydrophobicContact CB-CD1 4.43Å; A294-Y320 HydrophobicContact CB-CD2 4.04Å; A294-Y320 HydrophobicContact CB-CE1 4.07Å; A294-Y320 HydrophobicContact CB-CE2 3.67Å; A294-Y320 HydrophobicContact CB-CG 4.42Å; L297-Y320 HydrophobicContact CD2-CD1 4.01Å; H318-Y320 PolarHBondContact ND1-N 2.78Å; H318-Y320 PolarHBondContact O-N 3.05Å
321	I	98.4	Very high	97.2	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	-37.1	-170.7	-58.1	-57.3	0	0	0	112.4	L132 Y133 L136 L297 A315 L316 H318 V323 W324	L132-I321 HydrophobicContact CB-CD1 3.56Å; L132-I321 HydrophobicContact CD1-CD1 4.23Å; Y133-I321 HydrophobicContact CD2-CG2 4.01Å; Y133-I321 HydrophobicContact CG-CG2 4.48Å; L136-I321 HydrophobicContact CD1-CG1 4.22Å; L136-I321 HydrophobicContact CD1-CG2 4.05Å; L297-I321 HydrophobicContact CD2-CD1 3.91Å; L297-I321 HydrophobicContact CD2-CG1 3.66Å; A315-I321 WeakPolarHBondContact O-CB 3.49Å; L316-I321 HydrophobicContact CD2-CG2 4.4Å; H318-I321 HydrophobicContact CB-CG1 4.49Å; H318-I321 PolarHBondContact O-N 3.27Å; I321-V323 PolarHBondContact O-N 3.44Å; I321-W324 PolarHBondContact O-N 2.92Å
322	T	97.6	Very high	97	Very high	63 Å²	63	51.9 Å²	51.9	39%	0.387	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-58.6	-16.6	-170.6	-168.3	0	0	0	0	114.6	L316 H318 W324 Y325	L316-T322 WeakPolarHBondContact O-CA 3.47Å; H318-T322 WeakPolarHBondContact O-CB 3.31Å; H318-T322 WeakPolarHBondContact O-CG2 3.32Å; H318-T322 PolarHBondContact O-N 2.8Å; T322-W324 PolarHBondContact O-N 3.46Å; T322-Y325 WeakPolarHBondContact O-CB 3.42Å; T322-Y325 PolarHBondContact O-N 3.38Å
323	V	97	Very high	96.6	Very high	85 Å²	85	56.5 Å²	56.5	52%	0.515	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-62.5	-23	174.8	-60.6	0	0	0	0	112.7	I321	I321-V323 PolarHBondContact O-N 3.44Å
324	W	97.9	Very high	95.9	Very high	69 Å²	69	56.8 Å²	56.8	26%	0.261	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-99.3	-2.6	178.4	-55.3	114.9	0	0	0	113.5	E126 S129 Y130 Y133 I321 T322 D326	E126-W324 HydrophobicContact CB-CZ2 4.32Å; E126-W324 HydrophobicContact CG-CH2 3.83Å; E126-W324 HydrophobicContact CG-CZ2 3.73Å; E126-W324 WeakPolarHBondContact OE1-CH2 3.19Å; S129-W324 PolarHBondContact OG-NE1 3.46Å; Y130-W324 HydrophobicContact CD2-CB 4.46Å; Y130-W324 AromaticContact CD2-CD2 3.69Å; Y130-W324 HydrophobicContact CD2-CD2 3.69Å; Y130-W324 AromaticContact CD2-CE3 3.78Å; Y130-W324 HydrophobicContact CD2-CE3 3.78Å; Y130-W324 AromaticContact CD2-CG 3.98Å; Y130-W324 HydrophobicContact CD2-CG 3.98Å; Y130-W324 HydrophobicContact CD2-CZ3 4.34Å; Y130-W324 HydrophobicContact CE2-CE3 4.27Å; Y130-W324 HydrophobicContact CG-CD2 4.4Å; Y133-W324 HydrophobicContact CD1-CB 3.54Å; Y133-W324 HydrophobicContact CD1-CG 4.33Å; Y133-W324 HydrophobicContact CD2-CB 3.8Å; Y133-W324 HydrophobicContact CE1-CB 3.95Å; Y133-W324 WeakPolarHBondContact CE1-O 3.47Å; Y133-W324 HydrophobicContact CE2-CB 4.2Å; Y133-W324 WeakPolarHBondContact CE2-O 3.36Å; Y133-W324 HydrophobicContact CG-CB 3.44Å; Y133-W324 VanDerWaalsContact CG-CB 3.44Å; Y133-W324 HydrophobicContact CG-CG 4.23Å; Y133-W324 PolarHBondContact OH-O 3.31Å; I321-W324 PolarHBondContact O-N 2.92Å; T322-W324 PolarHBondContact O-N 3.46Å; W324-D326 PolarHBondContact O-N 3.29Å; W324-D326 VanDerWaalsContact O-N 3.08Å
325	Y	97.4	Very high	94.8	Very high	65 Å²	65	52.5 Å²	52.5	26%	0.255	29%	0.291	S	S	.	.			trans	-62.9	114.2	-169.4	-169.6	-85.9	0	0	0	111.6	L316 T322 P327 A330 E331	L316-Y325 HydrophobicContact CB-CD2 4.23Å; L316-Y325 HydrophobicContact CB-CE2 4.16Å; T322-Y325 WeakPolarHBondContact O-CB 3.42Å; T322-Y325 PolarHBondContact O-N 3.38Å; Y325-P327 HydrophobicContact CD1-CG 4.35Å; Y325-P327 HydrophobicContact CE1-CB 4.45Å; Y325-P327 HydrophobicContact CE1-CG 3.93Å; Y325-A330 HydrophobicContact CD2-CB 4.37Å; Y325-A330 HydrophobicContact CE2-CB 3.83Å; Y325-E331 PolarHBondContact OH-OE1 3.12Å
326	D	97	Very high	93.5	Very high	64 Å²	64	61.5 Å²	61.5	34%	0.342	33%	0.333	S	S	.	.			trans	-118.6	117.7	168.5	-174.4	-15.2	0	0	0	109.2	Y133 W324 A328 E329 A330	Y133-D326 PolarHBondContact OH-N 3.46Å; W324-D326 PolarHBondContact O-N 3.29Å; W324-D326 VanDerWaalsContact O-N 3.08Å; D326-A328 PolarHBondContact O-N 3.3Å; D326-A328 WeakPolarHBondContact OD1-CB 3.48Å; D326-A328 PolarHBondContact OD1-N 2.64Å; D326-E329 HydrophobicContact CB-CB 4.27Å; D326-E329 HydrophobicContact CB-CG 3.83Å; D326-E329 PolarHBondContact O-N 3.25Å; D326-A330 WeakPolarHBondContact O-CB 3.49Å; D326-A330 PolarHBondContact O-N 3.18Å
327	P	95.5	Very high	91.9	Very high	69 Å²	69	63.7 Å²	63.7	45%	0.448	34%	0.344	S	S	.	.	H	α-helix	trans	-54.1	-34.5	175.4	-22	29.7	0	0	0	113.7	Y325 E329 E331	Y325-P327 HydrophobicContact CD1-CG 4.35Å; Y325-P327 HydrophobicContact CE1-CB 4.45Å; Y325-P327 HydrophobicContact CE1-CG 3.93Å; P327-E329 PolarHBondContact O-N 3.4Å; P327-E331 WeakPolarHBondContact O-CA 3.28Å; P327-E331 VanDerWaalsContact O-CB 3.26Å; P327-E331 WeakPolarHBondContact O-CB 3.45Å; P327-E331 PolarHBondContact O-N 3.28Å
328	A	95.3	Very high	89.9	Confident	75 Å²	75	64.8 Å²	64.8	62%	0.62	35%	0.35	S	S	*	.	H	α-helix	trans	-63.7	-25.9	-179.9	0	0	0	0	0	112.4	D326	D326-A328 PolarHBondContact O-N 3.3Å; D326-A328 WeakPolarHBondContact OD1-CB 3.48Å; D326-A328 PolarHBondContact OD1-N 2.64Å
329	E	95.5	Very high	88	Confident	44 Å²	44	66.8 Å²	66.8	21%	0.206	36%	0.36	C	S	.	.	H	α-helix	trans	-97.5	-51.3	-178.8	-52.3	-179.6	159.5	0	0	110.8	H82 K83 Y133 D326 P327 E331	H82-E329 PolarHBondContact NE2-O 3.37Å; H82-E329 VanDerWaalsContact NE2-O 3.1Å; K83-E329 HydrophobicContact CD-CG 4.42Å; K83-E329 WeakPolarHBondContact CE-OE1 3.5Å; K83-E329 VanDerWaalsContact CE-OE2 3.27Å; K83-E329 WeakPolarHBondContact CE-OE2 3.39Å; K83-E329 IonicContact NZ-OE1 3.33Å; K83-E329 PolarHBondContact NZ-OE1 3.12Å; K83-E329 IonicContact NZ-OE2 2.92Å; K83-E329 PolarHBondContact NZ-OE2 3.22Å; Y133-E329 WeakPolarHBondContact CE1-OE2 3.42Å; Y133-E329 WeakPolarHBondContact OH-CB 3.13Å; Y133-E329 PolarHBondContact OH-OE2 2.87Å; D326-E329 HydrophobicContact CB-CB 4.27Å; D326-E329 HydrophobicContact CB-CG 3.83Å; D326-E329 PolarHBondContact O-N 3.25Å; P327-E329 PolarHBondContact O-N 3.4Å; E329-E331 VanDerWaalsContact C-N 3.35Å; E329-E331 PolarHBondContact O-N 3.09Å
330	A	95.3	Very high	86.1	Confident	4 Å²	4	66.8 Å²	66.8	3%	0.033	37%	0.366	C	S	.	.	H	α-helix	trans	-69.3	-31.8	-177.5	0	0	0	0	0	112.8	K140 L316 Y325 D326	K140-A330 WeakPolarHBondContact CD-O 3.37Å; K140-A330 WeakPolarHBondContact CE-O 3.45Å; L316-A330 HydrophobicContact CD1-CB 4.32Å; Y325-A330 HydrophobicContact CD2-CB 4.37Å; Y325-A330 HydrophobicContact CE2-CB 3.83Å; D326-A330 WeakPolarHBondContact O-CB 3.49Å; D326-A330 PolarHBondContact O-N 3.18Å
331	E	93.7	Very high	84.1	Confident	117 Å²	117	72.1 Å²	72.1	55%	0.547	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	21.8	-175.8	-53.1	176.5	-154.6	0	0	112.3	Y325 P327 E329	Y325-E331 PolarHBondContact OH-OE1 3.12Å; P327-E331 WeakPolarHBondContact O-CA 3.28Å; P327-E331 VanDerWaalsContact O-CB 3.26Å; P327-E331 WeakPolarHBondContact O-CB 3.45Å; P327-E331 PolarHBondContact O-N 3.28Å; E329-E331 VanDerWaalsContact C-N 3.35Å; E329-E331 PolarHBondContact O-N 3.09Å
332	A	92.6	Very high	82.2	Confident	21 Å²	21	73.4 Å²	73.4	17%	0.174	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-53.5	133.5	175.2	0	0	0	0	0	111
333	P	90.1	Very high	80.4	Confident	106 Å²	106	71.8 Å²	71.8	69%	0.688	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-60	139.8	-172.9	24	-33.9	0	0	0	111.1	H141	H141-P333 PolarHBondContact CE1-O 3.08Å
334	P	83.2	Confident	78.9	Confident	70 Å²	70	74.3 Å²	74.3	46%	0.455	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-63.9	149.2	-179.9	26	-33.2	0	0	0	110.7	S144 A145	S144-P334 WeakPolarHBondContact O-CB 3.42Å; A145-P334 HydrophobicContact CB-CB 4.34Å
335	P	74.4	Confident	77.7	Confident	20 Å²	20	76.2 Å²	76.2	13%	0.13	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-63.7	142.7	168	31.5	-35	0	0	0	109.1	C79 V80 H141 A145 I337	C79-P335 HydrophobicContact CB-CB 4.3Å; C79-P335 WeakPolarHBondContact O-CB 3.5Å; V80-P335 HydrophobicContact CG2-CG 4.04Å; H141-P335 WeakPolarHBondContact NE2-CD 3.42Å; A145-P335 HydrophobicContact CB-CG 3.7Å; P335-I337 VanDerWaalsContact C-N 3.3Å; P335-I337 HydrophobicContact CG-CG1 4.19Å; P335-I337 PolarHBondContact O-N 3.18Å
336	Q	70.2	Confident	76.8	Confident	188 Å²	188	80.8 Å²	80.8	88%	0.879	42%	0.423	S	S	*	.			trans	-69.5	93.8	168.7	-73.3	-173.5	-3.1	0	0	108	Y338	Q336-Y338 PolarHBondContact O-N 3.18Å
337	I	66.2	Low	76.2	Confident	48 Å²	48	79.5 Å²	79.5	25%	0.246	42%	0.415	C	S	.	.			trans	-72.2	115.9	174.9	-61.3	-166.5	0	0	0	108.3	L76 A145 I147 P335 D339	L76-I337 HydrophobicContact CD2-CD1 4.24Å; A145-I337 HydrophobicContact CB-CD1 3.47Å; A145-I337 VanDerWaalsContact CB-CD1 3.47Å; A145-I337 HydrophobicContact CB-CG1 3.92Å; A145-I337 WeakPolarHBondContact O-CD1 3.48Å; I147-I337 HydrophobicContact CD1-CD1 3.34Å; I147-I337 HydrophobicContact CG1-CD1 3.3Å; P335-I337 VanDerWaalsContact C-N 3.3Å; P335-I337 HydrophobicContact CG-CG1 4.19Å; P335-I337 PolarHBondContact O-N 3.18Å; I337-D339 PolarHBondContact O-N 3.2Å; I337-D339 VanDerWaalsContact O-N 3.13Å
338	Y	55	Low	76	Confident	182 Å²	182	78.5 Å²	78.5	71%	0.714	41%	0.412	S	S	*	.			trans	-72.6	105.7	175	-164.3	-97.8	0	0	0	108.9	Q336	Q336-Y338 PolarHBondContact O-N 3.18Å
339	D	59.4	Low	75.9	Confident	48 Å²	48	77.4 Å²	77.4	26%	0.257	40%	0.395	S	S	.	.			trans	72.2	97.4	163.9	-159	6.1	0	0	0	117.1	I337 Q341 L342 R345	I337-D339 PolarHBondContact O-N 3.2Å; I337-D339 VanDerWaalsContact O-N 3.13Å; D339-Q341 PolarHBondContact O-N 2.7Å; D339-Q341 WeakPolarHBondContact OD1-CA 3.34Å; D339-Q341 WeakPolarHBondContact OD1-CB 3.48Å; D339-Q341 WeakPolarHBondContact OD1-CG 3.42Å; D339-Q341 PolarHBondContact OD1-N 3.4Å; D339-L342 HydrophobicContact CB-CB 4.27Å; D339-L342 HydrophobicContact CB-CD1 4.27Å; D339-L342 VanDerWaalsContact O-CB 3.23Å; D339-L342 WeakPolarHBondContact O-CB 3.33Å; D339-L342 PolarHBondContact O-N 3.22Å; D339-L342 VanDerWaalsContact O-N 3.08Å; D339-R345 IonicContact OD2-CZ 3.55Å; D339-R345 IonicContact OD2-NH2 3.89Å; D339-R345 PolarHBondContact OD2-NH2 3.2Å
340	A	58.6	Low	75.8	Confident	64 Å²	64	81 Å²	81	53%	0.529	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-59.4	-21.9	166.6	0	0	0	0	0	112.7	T175 L342 E343	T175-A340 HydrophobicContact CG2-CB 4.48Å; A340-L342 PolarHBondContact O-N 2.93Å; A340-E343 PolarHBondContact O-N 3.34Å
341	Q	54.9	Low	75.7	Confident	112 Å²	112	84.9 Å²	84.9	52%	0.523	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-73.3	-16.2	177	-50.8	178.9	-17.3	0	0	112.7	D339 E343 E344 R345	D339-Q341 PolarHBondContact O-N 2.7Å; D339-Q341 WeakPolarHBondContact OD1-CA 3.34Å; D339-Q341 WeakPolarHBondContact OD1-CB 3.48Å; D339-Q341 WeakPolarHBondContact OD1-CG 3.42Å; D339-Q341 PolarHBondContact OD1-N 3.4Å; Q341-E343 PolarHBondContact O-N 2.92Å; Q341-E344 PolarHBondContact O-N 2.89Å; Q341-R345 PolarHBondContact O-N 2.99Å
342	L	59.6	Low	75.7	Confident	27 Å²	27	79.5 Å²	79.5	14%	0.141	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-65	-22.4	177.6	-123.8	163.6	0	0	0	111.4	Y71 D339 A340 W352	Y71-L342 HydrophobicContact CD1-CD2 4.11Å; Y71-L342 HydrophobicContact CE1-CD1 4.16Å; Y71-L342 HydrophobicContact CE1-CD2 3.29Å; Y71-L342 HydrophobicContact CE1-CG 4.33Å; D339-L342 HydrophobicContact CB-CB 4.27Å; D339-L342 HydrophobicContact CB-CD1 4.27Å; D339-L342 VanDerWaalsContact O-CB 3.23Å; D339-L342 WeakPolarHBondContact O-CB 3.33Å; D339-L342 PolarHBondContact O-N 3.22Å; D339-L342 VanDerWaalsContact O-N 3.08Å; A340-L342 PolarHBondContact O-N 2.93Å; L342-W352 HydrophobicContact CD2-CZ3 4.47Å
343	E	60	Low	75.8	Confident	29 Å²	29	79.6 Å²	79.6	14%	0.136	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-78.1	-26	171.5	-66.8	-157.2	-168.1	0	0	114.2	K68 R72 R174 T175 A340 Q341	K68-E343 WeakPolarHBondContact CE-O 3.21Å; K68-E343 PolarHBondContact NZ-O 3.3Å; R72-E343 IonicContact CZ-OE1 3.73Å; R72-E343 IonicContact CZ-OE2 3.32Å; R72-E343 IonicContact NH1-OE1 3.07Å; R72-E343 PolarHBondContact NH1-OE1 2.96Å; R72-E343 IonicContact NH1-OE2 2.94Å; R72-E343 PolarHBondContact NH1-OE2 3.32Å; R72-E343 IonicContact NH2-OE1 2.77Å; R72-E343 PolarHBondContact NH2-OE1 3.48Å; R174-E343 VanDerWaalsContact CD-OE2 3.29Å; R174-E343 WeakPolarHBondContact CD-OE2 3.26Å; T175-E343 VanDerWaalsContact N-CD 3.27Å; T175-E343 PolarHBondContact N-OE1 2.96Å; T175-E343 PolarHBondContact N-OE2 3Å; T175-E343 VanDerWaalsContact N-OE2 3.09Å; T175-E343 PolarHBondContact OG1-OE1 2.91Å; T175-E343 PolarHBondContact OG1-OE2 3.26Å; A340-E343 PolarHBondContact O-N 3.34Å; Q341-E343 PolarHBondContact O-N 2.92Å
344	E	65.6	Low	76	Confident	139 Å²	139	79.6 Å²	79.6	65%	0.65	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-21.3	-174.9	-67.1	-174.1	168.3	0	0	112.7	Q341 E346	Q341-E344 PolarHBondContact O-N 2.89Å; E344-E346 PolarHBondContact O-N 2.84Å
345	R	71.9	Confident	76.4	Confident	108 Å²	108	78.7 Å²	78.7	41%	0.408	38%	0.383	S	S	.	.			trans	-70.8	129.3	179.1	-63.3	178.5	-166.3	156.2	15.6	110.8	K68 D339 Q341 H347	K68-R345 PolarHBondContact NZ-O 2.9Å; D339-R345 IonicContact OD2-CZ 3.55Å; D339-R345 IonicContact OD2-NH2 3.89Å; D339-R345 PolarHBondContact OD2-NH2 3.2Å; Q341-R345 PolarHBondContact O-N 2.99Å; R345-H347 WeakPolarHBondContact CB-NE2 3.48Å
346	E	79	Confident	77.3	Confident	162 Å²	162	77.8 Å²	77.8	76%	0.757	38%	0.377	S	S	*	.			trans	-93.8	117.1	165.4	-67.3	-167.4	160.8	0	0	107.9	E344	E344-E346 PolarHBondContact O-N 2.84Å
347	H	84.6	Confident	78.5	Confident	37 Å²	37	70.7 Å²	70.7	17%	0.171	34%	0.342	C	S	.	.			trans	-113.3	148.6	178.4	-72.3	-65.2	0	0	0	110.5	R345 E351 W352	R345-H347 WeakPolarHBondContact CB-NE2 3.48Å; H347-E351 VanDerWaalsContact CA-OE2 3.22Å; H347-E351 WeakPolarHBondContact CA-OE2 3.42Å; H347-E351 HydrophobicContact CB-CB 3.92Å; H347-E351 WeakPolarHBondContact CB-OE2 3.44Å; H347-E351 IonicContact CG-OE2 3.66Å; H347-E351 IonicContact ND1-OE2 3.72Å; H347-E351 PolarHBondContact ND1-OE2 2.96Å; H347-W352 HydrophobicContact CB-CD2 3.97Å; H347-W352 HydrophobicContact CB-CG 4.06Å; H347-W352 HydrophobicContact CB-CZ2 4.06Å; H347-W352 AromaticContact CD2-CH2 3.76Å; H347-W352 AromaticContact CD2-CZ2 3.75Å; H347-W352 PolarHBondContact O-NE1 2.89Å
348	A	91.8	Very high	79.8	Confident	47 Å²	47	74.3 Å²	74.3	39%	0.388	36%	0.356	S	S	.	.			trans	-63.8	162.1	167.4	0	0	0	0	0	110.5	E350 E351 W352	A348-E350 VanDerWaalsContact C-N 3.28Å; A348-E350 PolarHBondContact O-N 2.98Å; A348-E351 HydrophobicContact CB-CG 4.21Å; A348-E351 PolarHBondContact N-OE2 3.46Å; A348-E351 PolarHBondContact O-N 2.95Å; A348-W352 PolarHBondContact O-N 2.93Å
349	I	92.6	Very high	81.6	Confident	53 Å²	53	67.3 Å²	67.3	27%	0.272	33%	0.33	S	S	.	.	H	α-helix	trans	-60.2	-40.8	-179.7	-63.9	172.1	0	0	0	111	F61 Q64 W352 K353	F61-I349 HydrophobicContact CB-CG2 4.07Å; F61-I349 VanDerWaalsContact O-CG2 3.27Å; F61-I349 WeakPolarHBondContact O-CG2 3.19Å; Q64-I349 HydrophobicContact CG-CG1 3.8Å; I349-W352 PolarHBondContact O-N 3.06Å; I349-K353 WeakPolarHBondContact O-CB 3.38Å; I349-K353 PolarHBondContact O-N 3.01Å
350	E	92.8	Very high	83.2	Confident	118 Å²	118	65 Å²	65	55%	0.551	32%	0.318	S	S	*	.	H	α-helix	trans	-65.9	-38.9	178.6	-62.2	-55.4	152.9	0	0	112.2	A348 K353 E354	A348-E350 VanDerWaalsContact C-N 3.28Å; A348-E350 PolarHBondContact O-N 2.98Å; E350-K353 WeakPolarHBondContact O-CB 3.48Å; E350-K353 PolarHBondContact O-N 2.85Å; E350-E354 WeakPolarHBondContact O-CG 3.33Å; E350-E354 PolarHBondContact O-N 2.9Å
351	E	93	Very high	84.8	Confident	87 Å²	87	64.3 Å²	64.3	41%	0.407	30%	0.304	S	S	.	.	H	α-helix	trans	-64.9	-42.1	174.4	-66.6	175.5	168.5	0	0	111.4	H347 A348 K353 E354 L355	H347-E351 VanDerWaalsContact CA-OE2 3.22Å; H347-E351 WeakPolarHBondContact CA-OE2 3.42Å; H347-E351 HydrophobicContact CB-CB 3.92Å; H347-E351 WeakPolarHBondContact CB-OE2 3.44Å; H347-E351 IonicContact CG-OE2 3.66Å; H347-E351 IonicContact ND1-OE2 3.72Å; H347-E351 PolarHBondContact ND1-OE2 2.96Å; A348-E351 HydrophobicContact CB-CG 4.21Å; A348-E351 PolarHBondContact N-OE2 3.46Å; A348-E351 PolarHBondContact O-N 2.95Å; E351-K353 VanDerWaalsContact C-N 3.29Å; E351-K353 PolarHBondContact O-N 3.06Å; E351-E354 WeakPolarHBondContact O-CB 3.41Å; E351-E354 PolarHBondContact O-N 2.68Å; E351-L355 VanDerWaalsContact O-CG 3.29Å; E351-L355 WeakPolarHBondContact O-CG 2.98Å; E351-L355 PolarHBondContact O-N 3.43Å
352	W	93.4	Very high	86.5	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.015	29%	0.292	C	S	.	.	H	α-helix	trans	-62.1	-39.6	172.4	-78.5	119.7	0	0	0	112.1	A67 K68 Y71 L342 H347 A348 I349 L355 I356	A67-W352 HydrophobicContact CB-CB 3.55Å; A67-W352 HydrophobicContact CB-CG 3.8Å; K68-W352 HydrophobicContact CB-CD2 4.5Å; K68-W352 HydrophobicContact CB-CH2 4.44Å; K68-W352 HydrophobicContact CB-CZ2 3.86Å; K68-W352 HydrophobicContact CD-CH2 4.44Å; K68-W352 HydrophobicContact CD-CZ2 3.82Å; K68-W352 HydrophobicContact CG-CH2 4.01Å; K68-W352 HydrophobicContact CG-CZ2 3.68Å; Y71-W352 HydrophobicContact CD1-CE3 4.19Å; Y71-W352 HydrophobicContact CD1-CH2 4.46Å; Y71-W352 AromaticContact CD1-CZ3 3.52Å; Y71-W352 HydrophobicContact CD1-CZ3 3.52Å; Y71-W352 HydrophobicContact CE1-CZ3 4.18Å; Y71-W352 AromaticContact CG-CE3 3.91Å; Y71-W352 HydrophobicContact CG-CE3 3.91Å; Y71-W352 AromaticContact CG-CZ3 3.73Å; Y71-W352 HydrophobicContact CG-CZ3 3.73Å; L342-W352 HydrophobicContact CD2-CZ3 4.47Å; H347-W352 HydrophobicContact CB-CD2 3.97Å; H347-W352 HydrophobicContact CB-CG 4.06Å; H347-W352 HydrophobicContact CB-CZ2 4.06Å; H347-W352 AromaticContact CD2-CH2 3.76Å; H347-W352 AromaticContact CD2-CZ2 3.75Å; H347-W352 PolarHBondContact O-NE1 2.89Å; A348-W352 PolarHBondContact O-N 2.93Å; I349-W352 PolarHBondContact O-N 3.06Å; W352-L355 HydrophobicContact CE3-CD1 3.85Å; W352-L355 HydrophobicContact CZ3-CD1 3.93Å; W352-L355 PolarHBondContact O-N 3.23Å; W352-I356 WeakPolarHBondContact O-CB 3.37Å; W352-I356 VanDerWaalsContact O-CG1 3.26Å; W352-I356 WeakPolarHBondContact O-CG1 3.31Å; W352-I356 PolarHBondContact O-N 3.12Å
353	K	94.6	Very high	87.9	Confident	22 Å²	22	62.1 Å²	62.1	10%	0.096	29%	0.293	C	S	.	.	H	α-helix	trans	-62.3	-44.2	178	-175.6	-179.6	170.7	-176.8	0	110.9	F61 L98 E99 F101 I349 E350 E351 I356 Y357	F61-K353 HydrophobicContact CD1-CB 3.8Å; F61-K353 HydrophobicContact CD1-CG 3.98Å; F61-K353 HydrophobicContact CD2-CD 4.45Å; F61-K353 HydrophobicContact CD2-CG 4.33Å; F61-K353 HydrophobicContact CE1-CB 3.96Å; F61-K353 HydrophobicContact CE1-CG 3.93Å; F61-K353 HydrophobicContact CE2-CG 4.28Å; F61-K353 HydrophobicContact CG-CB 4.36Å; F61-K353 HydrophobicContact CG-CD 4.42Å; F61-K353 HydrophobicContact CG-CG 4.2Å; F61-K353 HydrophobicContact CZ-CG 4.12Å; L98-K353 HydrophobicContact CD1-CG 4.12Å; L98-K353 WeakPolarHBondContact O-CE 3.49Å; L98-K353 PolarHBondContact O-NZ 2.82Å; E99-K353 PolarHBondContact O-NZ 2.74Å; F101-K353 HydrophobicContact CD1-CG 3.76Å; F101-K353 HydrophobicContact CE1-CG 4.35Å; F101-K353 WeakPolarHBondContact O-CE 3.4Å; F101-K353 PolarHBondContact O-NZ 3.05Å; I349-K353 WeakPolarHBondContact O-CB 3.38Å; I349-K353 PolarHBondContact O-N 3.01Å; E350-K353 WeakPolarHBondContact O-CB 3.48Å; E350-K353 PolarHBondContact O-N 2.85Å; E351-K353 VanDerWaalsContact C-N 3.29Å; E351-K353 PolarHBondContact O-N 3.06Å; K353-I356 PolarHBondContact O-N 3.12Å; K353-Y357 WeakPolarHBondContact O-CB 3.3Å; K353-Y357 PolarHBondContact O-N 3.15Å
354	E	94.5	Very high	89.1	Confident	106 Å²	106	62.3 Å²	62.3	50%	0.495	29%	0.294	S	S	.	.	H	α-helix	trans	-59.1	-47.7	172.5	-77.6	176.5	-164.9	0	0	112.5	L98 E350 E351 Y357 K358	L98-E354 HydrophobicContact CD1-CG 4.06Å; L98-E354 HydrophobicContact CD2-CG 3.49Å; L98-E354 VanDerWaalsContact CD2-CG 3.49Å; L98-E354 HydrophobicContact CG-CG 4.38Å; E350-E354 WeakPolarHBondContact O-CG 3.33Å; E350-E354 PolarHBondContact O-N 2.9Å; E351-E354 WeakPolarHBondContact O-CB 3.41Å; E351-E354 PolarHBondContact O-N 2.68Å; E354-Y357 PolarHBondContact O-N 3.31Å; E354-K358 WeakPolarHBondContact O-CB 3.5Å; E354-K358 PolarHBondContact O-N 3.42Å
355	L	93.1	Very high	90	Very high	52 Å²	52	61.2 Å²	61.2	27%	0.272	29%	0.289	S	S	.	.	H	α-helix	trans	-61.7	-45.9	179.3	-72.5	172.9	0	0	0	112	Y71 E351 W352 K358 E359	Y71-L355 HydrophobicContact CD2-CB 3.89Å; Y71-L355 HydrophobicContact CE2-CB 3.68Å; E351-L355 VanDerWaalsContact O-CG 3.29Å; E351-L355 WeakPolarHBondContact O-CG 2.98Å; E351-L355 PolarHBondContact O-N 3.43Å; W352-L355 HydrophobicContact CE3-CD1 3.85Å; W352-L355 HydrophobicContact CZ3-CD1 3.93Å; W352-L355 PolarHBondContact O-N 3.23Å; L355-K358 PolarHBondContact O-N 2.92Å; L355-E359 WeakPolarHBondContact O-CG 3.37Å; L355-E359 PolarHBondContact O-N 3.49Å; L355-E359 VanDerWaalsContact O-N 3.11Å
356	I	93.5	Very high	90.4	Very high	1 Å²	1	61.5 Å²	61.5	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-64.9	-46.4	177.2	-65.6	167.1	0	0	0	109.8	F61 A67 A70 Y71 L74 F101 V104 W352 K353 K358 E359 V360	F61-I356 HydrophobicContact CD1-CD1 4.38Å; F61-I356 HydrophobicContact CE1-CB 4.24Å; F61-I356 HydrophobicContact CE1-CD1 3.59Å; F61-I356 HydrophobicContact CE1-CG1 4.46Å; F61-I356 HydrophobicContact CE1-CG2 4.46Å; F61-I356 HydrophobicContact CZ-CD1 4.43Å; F61-I356 HydrophobicContact CZ-CG2 4.38Å; A67-I356 WeakPolarHBondContact O-CD1 3.35Å; A70-I356 HydrophobicContact CB-CD1 3.97Å; Y71-I356 HydrophobicContact CD2-CG1 3.7Å; Y71-I356 HydrophobicContact CG-CG1 4.16Å; L74-I356 HydrophobicContact CD2-CG2 4.31Å; F101-I356 HydrophobicContact CE1-CB 4.24Å; F101-I356 HydrophobicContact CE1-CG2 4.01Å; F101-I356 HydrophobicContact CZ-CG2 3.81Å; V104-I356 HydrophobicContact CG2-CG2 4Å; W352-I356 WeakPolarHBondContact O-CB 3.37Å; W352-I356 VanDerWaalsContact O-CG1 3.26Å; W352-I356 WeakPolarHBondContact O-CG1 3.31Å; W352-I356 PolarHBondContact O-N 3.12Å; K353-I356 PolarHBondContact O-N 3.12Å; I356-K358 VanDerWaalsContact C-N 3.29Å; I356-K358 PolarHBondContact O-N 2.98Å; I356-E359 PolarHBondContact O-N 3.42Å; I356-V360 HydrophobicContact CG2-CG2 4.32Å; I356-V360 VanDerWaalsContact O-CG2 3.31Å; I356-V360 WeakPolarHBondContact O-CG2 3.47Å; I356-V360 PolarHBondContact O-N 2.65Å
357	Y	95	Very high	90.3	Very high	39 Å²	39	56.8 Å²	56.8	15%	0.153	27%	0.274	C	S	.	.	H	α-helix	trans	-57.6	-44.8	179.9	-175.1	-109.1	0	0	0	111.4	T93 K96 L98 F101 K353 E354 V360 M361	T93-Y357 HydrophobicContact CG2-CE2 4.37Å; K96-Y357 PolarHBondContact O-OH 3.24Å; L98-Y357 HydrophobicContact CB-CD1 4.22Å; L98-Y357 HydrophobicContact CB-CE1 4.27Å; L98-Y357 HydrophobicContact CD1-CD1 4.05Å; L98-Y357 HydrophobicContact CD1-CG 3.92Å; F101-Y357 HydrophobicContact CB-CD2 3.9Å; F101-Y357 HydrophobicContact CB-CE2 4.28Å; F101-Y357 AromaticContact CD1-CD2 3.68Å; F101-Y357 HydrophobicContact CD1-CD2 3.68Å; F101-Y357 HydrophobicContact CD1-CG 4.06Å; F101-Y357 AromaticContact CD2-CD2 3.86Å; F101-Y357 HydrophobicContact CD2-CD2 3.86Å; F101-Y357 HydrophobicContact CD2-CE2 4.44Å; F101-Y357 HydrophobicContact CE1-CD2 4.04Å; F101-Y357 HydrophobicContact CE1-CG 4.32Å; F101-Y357 HydrophobicContact CE2-CD2 4.24Å; F101-Y357 AromaticContact CG-CD2 3.55Å; F101-Y357 HydrophobicContact CG-CD2 3.55Å; F101-Y357 HydrophobicContact CG-CE2 4.29Å; F101-Y357 HydrophobicContact CG-CG 4.37Å; F101-Y357 HydrophobicContact CZ-CD2 4.3Å; K353-Y357 WeakPolarHBondContact O-CB 3.3Å; K353-Y357 PolarHBondContact O-N 3.15Å; E354-Y357 PolarHBondContact O-N 3.31Å; Y357-V360 PolarHBondContact O-N 3.36Å; Y357-M361 HydrophobicContact CD1-CG 4.13Å; Y357-M361 HydrophobicContact CD2-CG 4.43Å; Y357-M361 HydrophobicContact CE1-CG 3.77Å; Y357-M361 HydrophobicContact CE1-SD 4.46Å; Y357-M361 HydrophobicContact CE2-CE 3.97Å; Y357-M361 HydrophobicContact CE2-CG 4.1Å; Y357-M361 HydrophobicContact CE2-SD 4.15Å; Y357-M361 HydrophobicContact CG-CG 4.45Å; Y357-M361 VanDerWaalsContact O-CG 3.31Å; Y357-M361 WeakPolarHBondContact O-CG 3.31Å; Y357-M361 PolarHBondContact O-N 3.15Å
358	K	93.3	Very high	89.6	Confident	123 Å²	123	62 Å²	62	54%	0.535	30%	0.297	S	S	.	.	H	α-helix	trans	-58.8	-48.4	175.6	-175.4	-178.9	176.7	-176.5	0	112.2	E354 L355 I356 V360 M361 D362	E354-K358 WeakPolarHBondContact O-CB 3.5Å; E354-K358 PolarHBondContact O-N 3.42Å; L355-K358 PolarHBondContact O-N 2.92Å; I356-K358 VanDerWaalsContact C-N 3.29Å; I356-K358 PolarHBondContact O-N 2.98Å; K358-V360 VanDerWaalsContact C-N 3.29Å; K358-V360 PolarHBondContact O-N 2.84Å; K358-M361 PolarHBondContact O-N 2.8Å; K358-D362 WeakPolarHBondContact O-CB 3.48Å; K358-D362 PolarHBondContact O-N 3.28Å
359	E	91.7	Very high	88.2	Confident	35 Å²	35	65 Å²	65	16%	0.164	31%	0.306	C	S	.	.	H	α-helix	trans	-60.8	-37.8	178.5	-73.3	-63.2	153.2	0	0	112.7	Y71 L74 K78 L355 I356 W363	Y71-E359 HydrophobicContact CE2-CG 3.7Å; L74-E359 HydrophobicContact CD2-CB 3.55Å; L74-E359 HydrophobicContact CD2-CG 4.49Å; L74-E359 HydrophobicContact CG-CB 4.28Å; K78-E359 IonicContact NZ-OE2 2.86Å; K78-E359 PolarHBondContact NZ-OE2 3.19Å; L355-E359 WeakPolarHBondContact O-CG 3.37Å; L355-E359 PolarHBondContact O-N 3.49Å; L355-E359 VanDerWaalsContact O-N 3.11Å; I356-E359 PolarHBondContact O-N 3.42Å; E359-W363 PolarHBondContact O-N 2.98Å
360	V	94	Very high	86.2	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-66.5	-48.1	176	177.7	0	0	0	0	110.7	L74 V91 T93 F101 V104 I356 Y357 K358 W363 E364	L74-V360 HydrophobicContact CD2-CG2 4.01Å; V91-V360 HydrophobicContact CG2-CB 4.47Å; V91-V360 HydrophobicContact CG2-CG1 4.21Å; V91-V360 HydrophobicContact CG2-CG2 3.84Å; T93-V360 HydrophobicContact CG2-CG1 3.97Å; F101-V360 HydrophobicContact CZ-CG2 4.43Å; V104-V360 HydrophobicContact CG1-CG2 4.25Å; I356-V360 HydrophobicContact CG2-CG2 4.32Å; I356-V360 VanDerWaalsContact O-CG2 3.31Å; I356-V360 WeakPolarHBondContact O-CG2 3.47Å; I356-V360 PolarHBondContact O-N 2.65Å; Y357-V360 PolarHBondContact O-N 3.36Å; K358-V360 VanDerWaalsContact C-N 3.29Å; K358-V360 PolarHBondContact O-N 2.84Å; V360-W363 PolarHBondContact O-N 3.3Å; V360-E364 PolarHBondContact O-N 3.4Å
361	M	92.8	Very high	83.7	Confident	50 Å²	50	64 Å²	64	25%	0.246	32%	0.322	C	S	.	.	H	α-helix	trans	-64.5	-42.8	179.3	-66.9	-61.7	102	0	0	112.2	T93 Y357 K358 W363 E364 E365	T93-M361 HydrophobicContact CG2-CE 3.47Å; T93-M361 VanDerWaalsContact CG2-CE 3.47Å; Y357-M361 HydrophobicContact CD1-CG 4.13Å; Y357-M361 HydrophobicContact CD2-CG 4.43Å; Y357-M361 HydrophobicContact CE1-CG 3.77Å; Y357-M361 HydrophobicContact CE1-SD 4.46Å; Y357-M361 HydrophobicContact CE2-CE 3.97Å; Y357-M361 HydrophobicContact CE2-CG 4.1Å; Y357-M361 HydrophobicContact CE2-SD 4.15Å; Y357-M361 HydrophobicContact CG-CG 4.45Å; Y357-M361 VanDerWaalsContact O-CG 3.31Å; Y357-M361 WeakPolarHBondContact O-CG 3.31Å; Y357-M361 PolarHBondContact O-N 3.15Å; K358-M361 PolarHBondContact O-N 2.8Å; M361-W363 PolarHBondContact O-N 3.27Å; M361-E364 PolarHBondContact O-N 2.77Å; M361-E365 PolarHBondContact O-N 3.46Å
362	D	90.4	Very high	81.2	Confident	49 Å²	49	67.3 Å²	67.3	26%	0.262	34%	0.335	S	S	.	.	H	α-helix	trans	-59.1	-37.4	176.8	-75.6	-1.5	0	0	0	111.1	K358 R366	K358-D362 WeakPolarHBondContact O-CB 3.48Å; K358-D362 PolarHBondContact O-N 3.28Å; D362-R366 VanDerWaalsContact O-CG 3.32Å; D362-R366 WeakPolarHBondContact O-CG 3.47Å; D362-R366 PolarHBondContact O-N 3.26Å
363	W	89.1	Confident	78.7	Confident	44 Å²	44	73.7 Å²	73.7	17%	0.167	37%	0.37	C	S	.	.	H	α-helix	trans	-69.9	-44.7	175.7	-175.9	-79.9	0	0	0	112.5	K78 L88 N90 V91 E359 V360 M361 E365 R366 S367	K78-W363 HydrophobicContact CB-CZ3 4.28Å; K78-W363 HydrophobicContact CD-CE3 4.13Å; K78-W363 HydrophobicContact CD-CZ3 4.39Å; K78-W363 HydrophobicContact CG-CE3 4.2Å; K78-W363 HydrophobicContact CG-CZ3 3.94Å; L88-W363 HydrophobicContact CB-CH2 4.37Å; L88-W363 HydrophobicContact CD2-CE3 4.26Å; L88-W363 HydrophobicContact CD2-CH2 4.02Å; L88-W363 HydrophobicContact CD2-CZ2 4.34Å; L88-W363 HydrophobicContact CD2-CZ3 3.98Å; L88-W363 HydrophobicContact CG-CH2 4.22Å; L88-W363 HydrophobicContact CG-CZ2 4.33Å; N90-W363 PolarHBondContact OD1-NE1 3.05Å; N90-W363 VanDerWaalsContact OD1-NE1 3.16Å; V91-W363 HydrophobicContact CG1-CB 3.46Å; V91-W363 VanDerWaalsContact CG1-CB 3.46Å; V91-W363 VanDerWaalsContact CG1-CD1 3.46Å; V91-W363 HydrophobicContact CG1-CD2 3.74Å; V91-W363 HydrophobicContact CG1-CE3 4.43Å; V91-W363 HydrophobicContact CG1-CG 3.25Å; E359-W363 PolarHBondContact O-N 2.98Å; V360-W363 PolarHBondContact O-N 3.3Å; M361-W363 PolarHBondContact O-N 3.27Å; W363-E365 VanDerWaalsContact C-N 3.27Å; W363-E365 PolarHBondContact O-N 2.66Å; W363-R366 PolarHBondContact O-N 3.15Å; W363-S367 PolarHBondContact NE1-OG 3.47Å; W363-S367 WeakPolarHBondContact O-CB 3.41Å; W363-S367 PolarHBondContact O-N 3.1Å; W363-S367 PolarHBondContact O-OG 3.49Å
364	E	84.3	Confident	75.8	Confident	33 Å²	33	78.8 Å²	78.8	15%	0.154	39%	0.394	C	S	.	.	H	α-helix	trans	-60.6	-38.3	177.3	-74.5	-168.2	-176.9	0	0	111.9	F92 T93 V360 M361 S367 K368	F92-E364 WeakPolarHBondContact CA-OE1 3.41Å; F92-E364 WeakPolarHBondContact CB-OE1 3.48Å; T93-E364 PolarHBondContact N-OE1 3.45Å; V360-E364 PolarHBondContact O-N 3.4Å; M361-E364 PolarHBondContact O-N 2.77Å; E364-S367 PolarHBondContact O-N 2.72Å; E364-K368 VanDerWaalsContact O-CG 3.29Å; E364-K368 WeakPolarHBondContact O-CG 3.44Å; E364-K368 PolarHBondContact O-N 3.45Å; E364-K368 IonicContact OE2-NZ 2.96Å
365	E	83.5	Confident	72.8	Confident	116 Å²	116	77.9 Å²	77.9	54%	0.542	40%	0.397	S	S	.	.	H	α-helix	trans	-65.8	-45.7	176.7	-172.7	171.5	-164.9	0	0	111.9	M361 W363 S367 K368 N369	M361-E365 PolarHBondContact O-N 3.46Å; W363-E365 VanDerWaalsContact C-N 3.27Å; W363-E365 PolarHBondContact O-N 2.66Å; E365-S367 VanDerWaalsContact C-N 3.29Å; E365-S367 PolarHBondContact O-N 2.95Å; E365-K368 PolarHBondContact O-N 3.37Å; E365-N369 PolarHBondContact O-N 3.34Å; E365-N369 PolarHBondContact O-ND2 3.19Å
366	R	81.7	Confident	69.7	Low	114 Å²	114	80.3 Å²	80.3	43%	0.43	42%	0.418	S	S	.	.	H	α-helix	trans	-59.2	-41.6	174.6	-71.6	176	-166.9	-166.5	2.3	112.2	D362 W363 N369 G370 V371	D362-R366 VanDerWaalsContact O-CG 3.32Å; D362-R366 WeakPolarHBondContact O-CG 3.47Å; D362-R366 PolarHBondContact O-N 3.26Å; W363-R366 PolarHBondContact O-N 3.15Å; R366-N369 PolarHBondContact O-N 3.27Å; R366-G370 PolarHBondContact O-N 3.04Å; R366-V371 PolarHBondContact O-N 3.44Å
367	S	76.3	Confident	66.8	Low	62 Å²	62	88.2 Å²	88.2	43%	0.434	46%	0.461	S	S	.	.	H	α-helix	trans	-65.7	-38.3	178.8	-62.1	0	0	0	0	112.3	W363 E364 E365 G370	W363-S367 PolarHBondContact NE1-OG 3.47Å; W363-S367 WeakPolarHBondContact O-CB 3.41Å; W363-S367 PolarHBondContact O-N 3.1Å; W363-S367 PolarHBondContact O-OG 3.49Å; E364-S367 PolarHBondContact O-N 2.72Å; E365-S367 VanDerWaalsContact C-N 3.29Å; E365-S367 PolarHBondContact O-N 2.95Å; S367-G370 PolarHBondContact O-N 3.37Å
368	K	69.9	Low	63.8	Low	147 Å²	147	90.1 Å²	90.1	64%	0.639	48%	0.484	S	S	*	.	H	α-helix	trans	-68	-36.5	175.2	-74.2	165.8	-171.5	158.3	0	112.1	E364 E365 G370	E364-K368 VanDerWaalsContact O-CG 3.29Å; E364-K368 WeakPolarHBondContact O-CG 3.44Å; E364-K368 PolarHBondContact O-N 3.45Å; E364-K368 IonicContact OE2-NZ 2.96Å; E365-K368 PolarHBondContact O-N 3.37Å; K368-G370 PolarHBondContact O-N 3.12Å
369	N	62.2	Low	60.8	Low	110 Å²	110	89 Å²	89	59%	0.588	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	2	-179.6	-67.9	-21.8	0	0	0	113.6	E365 R366 V371	E365-N369 PolarHBondContact O-N 3.34Å; E365-N369 PolarHBondContact O-ND2 3.19Å; R366-N369 PolarHBondContact O-N 3.27Å; N369-V371 HydrophobicContact CB-CG2 4.15Å; N369-V371 PolarHBondContact O-N 3.31Å
370	G	51.8	Low	58	Low	59 Å²	59	93.5 Å²	93.5	61%	0.608	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.2	18.1	176.3	0	0	0	0	0	114	R366 S367 K368 K372	R366-G370 PolarHBondContact O-N 3.04Å; S367-G370 PolarHBondContact O-N 3.37Å; K368-G370 PolarHBondContact O-N 3.12Å; G370-K372 VanDerWaalsContact C-N 3.34Å; G370-K372 PolarHBondContact O-N 3.36Å
371	V	40.4	Very low	54.9	Low	90 Å²	90	99 Å²	99	55%	0.545	57%	0.566	S	S	.	*			trans	-77.2	89.8	176.5	-173.8	0	0	0	0	107.4	R366 N369 D373	R366-V371 PolarHBondContact O-N 3.44Å; N369-V371 HydrophobicContact CB-CG2 4.15Å; N369-V371 PolarHBondContact O-N 3.31Å; V371-D373 PolarHBondContact O-N 3.49Å
372	K	40.5	Very low	52.2	Low	158 Å²	158	101.5 Å²	101.5	69%	0.687	59%	0.589	S	S	*	*			trans	-74.4	104.7	171.5	-76.4	-172.8	173.3	-168.5	0	109.2	G370 Q374	G370-K372 VanDerWaalsContact C-N 3.34Å; G370-K372 PolarHBondContact O-N 3.36Å; K372-Q374 HydrophobicContact CB-CB 4.46Å; K372-Q374 PolarHBondContact O-N 3.23Å
373	D	40.8	Very low	49.3	Very low	138 Å²	138	108.8 Å²	108.8	74%	0.738	62%	0.618	S	S	*	*			trans	-76.7	72.1	151.6	-70.9	-33	0	0	0	107.6	V371	V371-D373 PolarHBondContact O-N 3.49Å
374	Q	33.6	Very low	46.6	Very low	129 Å²	129	111.1 Å²	111.1	60%	0.603	65%	0.647	S	S	*	*			trans	-106.9	127.8	165.7	-86.3	-173.3	-12.9	0	0	108.2	K372 S376	K372-Q374 HydrophobicContact CB-CB 4.46Å; K372-Q374 PolarHBondContact O-N 3.23Å; Q374-S376 PolarHBondContact O-N 3.25Å
375	P	31.7	Very low	44.1	Very low	87 Å²	87	115.9 Å²	115.9	57%	0.565	68%	0.678	S	S	*	*			trans	-64.8	124.6	162.4	-8	24.2	0	0	0	107.4	N81 D377	N81-P375 WeakPolarHBondContact ND2-CG 3.36Å; P375-D377 PolarHBondContact O-N 3.05Å
376	S	27.9	Very low	41.6	Very low	103 Å²	103	116.1 Å²	116.1	72%	0.72	69%	0.69	S	S	*	*			trans	-67	108.8	168.2	54.3	0	0	0	0	108.9	Q374 A378	Q374-S376 PolarHBondContact O-N 3.25Å; S376-A378 PolarHBondContact O-N 3.4Å
377	D	32.9	Very low	39.4	Very low	167 Å²	167	116 Å²	116	89%	0.893	71%	0.706	S	S	*	*			trans	-66.7	91.4	153.2	-80.2	-28.5	0	0	0	107	P375 A379	P375-D377 PolarHBondContact O-N 3.05Å; D377-A379 PolarHBondContact O-N 2.67Å
378	A	31.6	Very low	37.2	Very low	78 Å²	78	121.9 Å²	121.9	65%	0.645	73%	0.727	S	S	*	*			trans	-69.7	111	173.6	0	0	0	0	0	108.3	S376 V380	S376-A378 PolarHBondContact O-N 3.4Å; A378-V380 PolarHBondContact O-N 3.29Å
379	A	29.1	Very low	35.4	Very low	100 Å²	100	120.4 Å²	120.4	83%	0.826	74%	0.735	S	S	*	*			trans	-47.7	108.5	166.2	0	0	0	0	0	110.9	D377 S381	D377-A379 PolarHBondContact O-N 2.67Å; A379-S381 PolarHBondContact O-N 2.86Å
380	V	34.4	Very low	34	Very low	130 Å²	130	120.1 Å²	120.1	79%	0.788	74%	0.742	S	S	*	*			trans	-90.4	93.5	164.1	-178.4	0	0	0	0	107.8	A378	A378-V380 PolarHBondContact O-N 3.29Å
381	S	28	Very low	33	Very low	116 Å²	116	122.4 Å²	122.4	81%	0.811	75%	0.748	S	S	*	*			trans	-81.1	111.6	158.8	174	0	0	0	0	108.4	A379	A379-S381 PolarHBondContact O-N 2.86Å
382	S	35.8	Very low	32.7	Very low	102 Å²	102	125.9 Å²	125.9	71%	0.713	76%	0.762	S	S	*	*			trans	-145.5	119.7	158.5	59.3	0	0	0	0	111.1
383	K	29.3	Very low	32.4	Very low	201 Å²	201	124.9 Å²	124.9	87%	0.874	76%	0.764	S	S	*	*			trans	-59.2	165.1	176	-73.3	168.2	168.3	174.8	0	114
384	A	33.1	Very low	31.7	Very low	94 Å²	94	125.2 Å²	125.2	78%	0.777	77%	0.766	S	S	*	*			trans	98.3	129.4	158.9	0	0	0	0	0	114.2
385	T	31.6	Very low	31.6	Very low	133 Å²	133	127.4 Å²	127.4	82%	0.816	78%	0.78	S	S	*	*			cis	-165.7	161.6	1.1	-17.4	0	0	0	0	106.4
386	P	30.7	Very low	31.4	Very low	121 Å²	121	128 Å²	128	79%	0.786	79%	0.786	S	S	*	*			trans	-100.2	145.2	-163.6	35.6	-26.3	0	0	0	115
387	S	34.9	Very low	31.4	Very low	110 Å²	110	128.2 Å²	128.2	77%	0.769	79%	0.788	S	S	*	*			trans	-161.5	99.1	160.2	57.4	0	0	0	0	108.9
388	Q	30.3	Very low	31	Very low	186 Å²	186	128.4 Å²	128.4	87%	0.869	79%	0.786	S	S	*	*				89.7	111.7	92.8	-85.4	-167	-0.5	0	0	115.1
389	S	32	Very low	30.9	Very low	116 Å²	116	130 Å²	130	81%	0.811	79%	0.792	S	S	*	*			trans	67.2	133.9	155.7	68.3	0	0	0	0	117.6
390	S	34.4	Very low	30.9	Very low	104 Å²	104	131.4 Å²	131.4	73%	0.727	79%	0.791	S	S	*	*			cis	-156.4	126.3	26.9	42.3	0	0	0	0	108.5
391	S	29.2	Very low	30.6	Very low	107 Å²	107	134 Å²	134	75%	0.748	79%	0.794	S	S	*	*				61.1	104.1	101.3	-41.4	0	0	0	0	114.2
392	I	35.4	Very low	30.6	Very low	163 Å²	163	136.8 Å²	136.8	84%	0.836	79%	0.794	S	S	*	*				-173.2	102.1	127.1	-86.3	148.7	0	0	0	109
393	N	32.8	Very low	30.3	Very low	138 Å²	138	138.5 Å²	138.5	74%	0.738	80%	0.8	S	S	*	*			trans	25.3	120.7	138.3	-56.4	-12.3	0	0	0	121.5
394	D	27.3	Very low	30.3	Very low	145 Å²	145	136.4 Å²	136.4	78%	0.775	80%	0.798	S	S	*	*				26	119.6	120.5	-63.4	-40	0	0	0	118.4
395	I	31.1	Very low	30	Very low	174 Å²	174	136.8 Å²	136.8	89%	0.892	80%	0.801	S	S	*	*				-148.3	113.3	125.3	-89	141.4	0	0	0	107.9
396	S	26.9	Very low	29.9	Very low	100 Å²	100	135.7 Å²	135.7	70%	0.699	80%	0.799	S	S	*	*			trans	-79	167.7	165.7	48.2	0	0	0	0	111
397	S	28.2	Very low	29.7	Very low	108 Å²	108	137.6 Å²	137.6	76%	0.755	80%	0.802	S	S	*	*			trans	98.4	81.1	169.2	76.1	0	0	0	0	117.3
398	M	25.9	Very low	29.7	Very low	171 Å²	171	138.9 Å²	138.9	84%	0.842	81%	0.805	S	S	*	*			trans	-95.9	109.7	143.3	-68.6	-163	90	0	0	108
399	S	28.6	Very low	29.5	Very low	111 Å²	111	137.1 Å²	137.1	78%	0.776	80%	0.802	S	S	*	*			trans	-109.6	104.7	163	-61.6	0	0	0	0	107	E401	S399-E401 PolarHBondContact O-N 2.69Å
400	T	28.8	Very low	29.6	Very low	130 Å²	130	137.1 Å²	137.1	80%	0.798	80%	0.802	S	S	*	*			trans	-84.5	103.7	167.5	45.6	0	0	0	0	108.6
401	E	28.2	Very low	29.3	Very low	184 Å²	184	137 Å²	137	86%	0.86	80%	0.802	S	S	*	*			trans	-79.3	132.1	164.6	-81.5	-171.4	154.7	0	0	110.5	S399	S399-E401 PolarHBondContact O-N 2.69Å
402	H	27.9	Very low	29.7	Very low	174 Å²	174	140.2 Å²	140.2	81%	0.806	81%	0.809	S	S	*	*			trans	-55.7	135.8	167.6	-82.4	-94	0	0	0	111.3
403	T	29.7	Very low	29.5	Very low	138 Å²	138	140 Å²	140	85%	0.847	81%	0.81	S	S	*	*			trans	-133.4	114.6	155.7	-43.3	0	0	0	0	109.9
404	L	29.8	Very low	29.6	Very low	158 Å²	158	137.5 Å²	137.5	83%	0.827	81%	0.808	S	S	*	*			trans	-67	137	174.6	-76.8	135.6	0	0	0	110.2
405	A	26	Very low	29.8	Very low	101 Å²	101	135.3 Å²	135.3	84%	0.835	80%	0.804	S	S	*	*			trans	-70.9	130.9	161.8	0	0	0	0	0	109.1
406	S	30.9	Very low	30	Very low	111 Å²	111	134.1 Å²	134.1	78%	0.776	81%	0.805	S	S	*	*			trans	-112.1	115.5	168.2	57.8	0	0	0	0	109.1
407	D	26.4	Very low	30.4	Very low	160 Å²	160	132.7 Å²	132.7	86%	0.856	81%	0.806	S	S	*	*			trans	-62.8	136.7	164.2	-66.4	-47.9	0	0	0	110.2
408	T	33.9	Very low	30.7	Very low	137 Å²	137	133.8 Å²	133.8	84%	0.84	81%	0.811	S	S	*	*			trans	-138.9	112.8	149.7	37.2	0	0	0	0	109.7
409	D	26.6	Very low	31.3	Very low	150 Å²	150	133.5 Å²	133.5	80%	0.802	81%	0.812	S	S	*	*			trans	-75.5	137.1	170.1	-160.3	0.2	0	0	0	109.3
410	S	34.3	Very low	31.8	Very low	116 Å²	116	137 Å²	137	81%	0.811	82%	0.816	S	S	*	*			trans	-157.1	97	157.9	43.2	0	0	0	0	110
411	S	27.6	Very low	31.9	Very low	102 Å²	102	134.2 Å²	134.2	71%	0.713	81%	0.813	S	S	*	*			trans	-71.3	140.7	157.7	45.7	0	0	0	0	109.8
412	L	37.2	Very low	32.4	Very low	174 Å²	174	131.8 Å²	131.8	91%	0.911	82%	0.815	S	S	*	*			trans	-160.6	131.4	147.9	-103	162.5	0	0	0	109.5
413	D	32.1	Very low	33.1	Very low	159 Å²	159	139 Å²	139	85%	0.85	84%	0.835	S	S	*	*			trans	-62.8	167	-172.1	-74.5	-58.8	0	0	0	116.7
414	A	34	Very low	33.3	Very low	84 Å²	84	139 Å²	139	69%	0.694	83%	0.834	S	S	*	*			trans	114.5	91.1	132.8	0	0	0	0	0	118.2
415	S	31	Very low	33.5	Very low	100 Å²	100	138 Å²	138	70%	0.699	84%	0.835	S	S	*	*				63.6	137.1	118.2	59.7	0	0	0	0	123
416	T	37	Very low	33.9	Very low	148 Å²	148	140.1 Å²	140.1	91%	0.908	84%	0.835	S	S	*	*			trans	76.5	131.6	162.7	70.7	0	0	0	0	115.6
417	G	34.1	Very low	34.1	Very low	70 Å²	70	141.8 Å²	141.8	72%	0.722	84%	0.838	S	S	*	*			cis	171.6	158.8	5.8	0	0	0	0	0	106.1
418	P	35.4	Very low	34.5	Very low	131 Å²	131	140.6 Å²	140.6	85%	0.851	84%	0.837	S	S	*	*			trans	-93.7	148.5	-159.3	35.6	-32.3	0	0	0	114.2
419	L	38.7	Very low	34.6	Very low	166 Å²	166	140.9 Å²	140.9	87%	0.869	84%	0.837	S	S	*	*			trans	-132.9	113	164.5	-84.8	169.1	0	0	0	111.4
420	E	37.3	Very low	35.2	Very low	184 Å²	184	140.2 Å²	140.2	86%	0.86	84%	0.839	S	S	*	*			trans	5	123.5	145.5	-62.1	177	147.3	0	0	119.8
421	G	31.3	Very low	35.2	Very low	71 Å²	71	142.1 Å²	142.1	73%	0.732	84%	0.841	S	S	*	*				61	114.1	112.2	0	0	0	0	0	120.4
422	C	38.6	Very low	35.9	Very low	134 Å²	134	145.4 Å²	145.4	91%	0.905	85%	0.852	S	S	*	*			trans	-165.8	124.3	131.3	-102.4	0	0	0	0	112.3
423	R	43.6	Very low	35.7	Very low	324 Å²	324	142.8 Å²	142.8	100%	1.223	85%	0.847	S	S	*	*			trans	84.7	0	173.2	-67.9	-171.4	175.7	-171.9	-0.8	119.1

Retrieved 423 of 423 residues in 85.5 ms (Link to these results)

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