A0A061I0S1_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 (P49186), UniProt , Accession A0A061I0S1, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Mapk9, Length 423 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.2	Very low	58.7	Low	245 Å²	245	111.9 Å²	111.9	100%	1.207	61%	0.612	S	S	*	*				0	78.5	0	-80.2	173	170.6	0	0	108.6
2	S	35.9	Very low	61.8	Low	106 Å²	106	108.8 Å²	108.8	74%	0.741	61%	0.605	S	S	*	*			trans	-168	12	169	50.1	0	0	0	0	114.9
3	D	40.1	Very low	64.3	Low	141 Å²	141	104 Å²	104	75%	0.754	58%	0.58	S	S	*	*			trans	-95	8.6	-165.3	-79.4	-39.1	0	0	0	117.8
4	S	41.9	Very low	66.4	Low	114 Å²	114	106 Å²	106	80%	0.797	58%	0.582	S	S	*	*	S	Bend	trans	-101.2	5.9	-172.5	60.1	0	0	0	0	116.8
5	K	38.9	Very low	67.9	Low	194 Å²	194	99.4 Å²	99.4	84%	0.843	55%	0.546	S	S	*	.	S	Bend	trans	-94.3	-14.7	-174.5	-80.4	-172.2	177.4	179.9	0	116.7
6	S	48.9	Very low	68.6	Low	42 Å²	42	98.3 Å²	98.3	29%	0.294	55%	0.554	S	S	.	*	S	Bend	trans	-96	-16.3	-172.1	47.6	0	0	0	0	116.6	G8 Q9 K96	S6-G8 PolarHBondContact O-N 3.43Å; S6-Q9 PolarHBondContact O-N 3.45Å; S6-Q9 VanDerWaalsContact O-N 3.16Å; S6-K96 WeakPolarHBondContact OG-CD 3.22Å; S6-K96 WeakPolarHBondContact OG-CE 3.39Å; S6-K96 PolarHBondContact OG-NZ 2.69Å
7	D	54.6	Low	69.5	Low	128 Å²	128	102.6 Å²	102.6	68%	0.684	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-15.8	171	-81.5	24.1	0	0	0	112.3	Q9 K96	D7-Q9 VanDerWaalsContact C-N 3.26Å; D7-Q9 PolarHBondContact O-N 3.35Å; D7-K96 IonicContact OD1-NZ 2.96Å; D7-K96 PolarHBondContact OD1-NZ 2.91Å
8	G	72.3	Confident	70.6	Confident	45 Å²	45	98.4 Å²	98.4	46%	0.464	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.8	-11.4	175.8	0	0	0	0	0	115.3	S6 K24	S6-G8 PolarHBondContact O-N 3.43Å; G8-K24 WeakPolarHBondContact O-CD 3.08Å; G8-K24 WeakPolarHBondContact O-CE 3.48Å; G8-K24 PolarHBondContact O-NZ 2.89Å
9	Q	89.1	Confident	71.8	Confident	107 Å²	107	95.9 Å²	95.9	50%	0.5	54%	0.541	S	S	.	.	S	Bend	trans	-98.3	-24.4	-171.9	-65.7	-173.3	1.8	0	0	114.9	S6 D7 K24	S6-Q9 PolarHBondContact O-N 3.45Å; S6-Q9 VanDerWaalsContact O-N 3.16Å; D7-Q9 VanDerWaalsContact C-N 3.26Å; D7-Q9 PolarHBondContact O-N 3.35Å; Q9-K24 WeakPolarHBondContact O-CG 3.44Å; Q9-K24 PolarHBondContact O-N 2.82Å
10	F	95.3	Very high	73.1	Confident	40 Å²	40	91.1 Å²	91.1	18%	0.175	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	162.5	-177.5	-65.7	-92.5	0	0	0	111.6	T21 V22 L23 F92 T93 P94	F10-T21 HydrophobicContact CB-CG2 4.03Å; F10-V22 CarbonylContact C-O 3.58Å; F10-V22 VanDerWaalsContact CA-O 3.25Å; F10-V22 WeakPolarHBondContact CA-O 3.35Å; F10-V22 VanDerWaalsContact CD1-C 3.49Å; F10-L23 HydrophobicContact CD1-CD2 4.03Å; F10-L23 HydrophobicContact CD1-CG 4.29Å; F10-L23 HydrophobicContact CD2-CD2 4.45Å; F10-L23 HydrophobicContact CE1-CD2 3.48Å; F10-L23 VanDerWaalsContact CE1-CD2 3.48Å; F10-L23 HydrophobicContact CE1-CG 3.73Å; F10-L23 HydrophobicContact CE2-CD2 3.96Å; F10-L23 HydrophobicContact CG-CD2 4.48Å; F10-L23 HydrophobicContact CZ-CD2 3.44Å; F10-L23 VanDerWaalsContact CZ-CD2 3.44Å; F10-L23 HydrophobicContact CZ-CG 4.14Å; F10-F92 AromaticContact CE1-CD2 3.69Å; F10-F92 HydrophobicContact CE1-CD2 3.69Å; F10-F92 HydrophobicContact CE1-CE2 4.02Å; F10-F92 HydrophobicContact CZ-CD2 4.47Å; F10-T93 WeakPolarHBondContact CZ-O 3.39Å; F10-P94 HydrophobicContact CD1-CB 3.89Å; F10-P94 HydrophobicContact CE1-CB 4.05Å; F10-P94 HydrophobicContact CG-CB 4.28Å
11	Y	96.2	Very high	74.2	Confident	69 Å²	69	88.2 Å²	88.2	27%	0.271	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	154.4	166.6	78.2	-72.4	0	0	0	110	V13 T21 V22 K24 Y26 L29	Y11-V13 HydrophobicContact CD2-CG2 3.68Å; Y11-V13 HydrophobicContact CE2-CG2 3.18Å; Y11-T21 CarbonylContact O-C 3.48Å; Y11-T21 WeakPolarHBondContact O-CA 3.05Å; Y11-V22 HydrophobicContact CD1-CG2 4.06Å; Y11-V22 WeakPolarHBondContact CD1-O 2.89Å; Y11-V22 HydrophobicContact CE1-CG2 3.5Å; Y11-V22 VanDerWaalsContact CE1-CG2 3.5Å; Y11-V22 PolarHBondContact N-O 3.25Å; Y11-V22 PolarHBondContact O-N 2.89Å; Y11-K24 HydrophobicContact CD1-CG 4.08Å; Y11-Y26 VanDerWaalsContact CE1-O 3.3Å; Y11-Y26 WeakPolarHBondContact CE1-O 3.47Å; Y11-Y26 PolarHBondContact OH-O 3.18Å; Y11-L29 WeakPolarHBondContact OH-CD1 3.27Å
12	S	95.8	Very high	77.2	Confident	75 Å²	75	76.6 Å²	76.6	52%	0.524	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	138.6	-177.1	-64.3	0	0	0	0	111.8	F20 T21	S12-F20 CarbonylContact C-O 3.59Å; S12-F20 VanDerWaalsContact CA-O 3.26Å; S12-F20 WeakPolarHBondContact CA-O 3.39Å; S12-T21 PolarHBondContact OG-OG1 2.9Å
13	V	94.7	Very high	80.1	Confident	46 Å²	46	72.9 Å²	72.9	28%	0.279	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	139	174.7	-175.1	0	0	0	0	108.7	Y11 V15 F20	Y11-V13 HydrophobicContact CD2-CG2 3.68Å; Y11-V13 HydrophobicContact CE2-CG2 3.18Å; V13-V15 HydrophobicContact CG1-CG2 4.37Å; V13-F20 PolarHBondContact N-O 3.33Å; V13-F20 PolarHBondContact O-N 3.03Å
14	Q	93.7	Very high	82.8	Confident	132 Å²	132	71.4 Å²	71.4	62%	0.617	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	127	170.3	-65.7	-59.2	-12.7	0	0	110	S18 T19	Q14-S18 PolarHBondContact OE1-O 3.16Å; Q14-T19 VanDerWaalsContact CD-OG1 3.26Å; Q14-T19 PolarHBondContact NE2-OG1 3.37Å; Q14-T19 PolarHBondContact OE1-OG1 3.49Å
15	V	88.5	Confident	85.4	Confident	7 Å²	7	69.1 Å²	69.1	4%	0.042	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	110.3	178	-178.2	0	0	0	0	108.1	V13 D17 S18 F20 P31 I39 C41	V13-V15 HydrophobicContact CG1-CG2 4.37Å; V15-D17 PolarHBondContact O-N 2.88Å; V15-S18 CarbonylContact C-O 3.52Å; V15-S18 PolarHBondContact N-O 3.38Å; V15-S18 PolarHBondContact O-N 2.89Å; V15-S18 VanDerWaalsContact O-N 3.07Å; V15-F20 HydrophobicContact CB-CD2 3.74Å; V15-F20 HydrophobicContact CB-CE2 4.02Å; V15-F20 HydrophobicContact CB-CG 4.47Å; V15-F20 HydrophobicContact CG1-CE2 4.35Å; V15-F20 HydrophobicContact CG2-CB 4.18Å; V15-F20 HydrophobicContact CG2-CD2 3.8Å; V15-F20 HydrophobicContact CG2-CE2 4.41Å; V15-F20 HydrophobicContact CG2-CG 4.03Å; V15-P31 HydrophobicContact CG1-CB 3.69Å; V15-P31 HydrophobicContact CG1-CG 4.05Å; V15-I39 HydrophobicContact CG1-CG2 4.48Å; V15-C41 VanDerWaalsContact CG1-SG 3.58Å
16	A	80	Confident	88.2	Confident	82 Å²	82	59.9 Å²	59.9	68%	0.678	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	-127.4	-169.1	0	0	0	0	0	110.2	S18	A16-S18 VanDerWaalsContact C-N 3.31Å; A16-S18 PolarHBondContact O-N 3.27Å
17	D	84	Confident	90.5	Very high	172 Å²	172	62 Å²	62	92%	0.92	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	17.1	-179	-56.8	-34.9	0	0	0	113.5	V15	V15-D17 PolarHBondContact O-N 2.88Å
18	S	88.8	Confident	92.4	Very high	26 Å²	26	63.4 Å²	63.4	18%	0.182	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	145.4	-175.2	-170.5	0	0	0	0	113	Q14 V15 A16	Q14-S18 PolarHBondContact OE1-O 3.16Å; V15-S18 CarbonylContact C-O 3.52Å; V15-S18 PolarHBondContact N-O 3.38Å; V15-S18 PolarHBondContact O-N 2.89Å; V15-S18 VanDerWaalsContact O-N 3.07Å; A16-S18 VanDerWaalsContact C-N 3.31Å; A16-S18 PolarHBondContact O-N 3.27Å
19	T	93.9	Very high	93.5	Very high	51 Å²	51	62.5 Å²	62.5	31%	0.313	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	124.4	174.3	-52.3	0	0	0	0	110.7	Q14 K56	Q14-T19 VanDerWaalsContact CD-OG1 3.26Å; Q14-T19 PolarHBondContact NE2-OG1 3.37Å; Q14-T19 PolarHBondContact OE1-OG1 3.49Å; T19-K56 PolarHBondContact O-NZ 3.16Å
20	F	96.4	Very high	93.8	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	-97.8	114.5	171.4	-87	-116.7	0	0	0	109.3	S12 V13 V15 V22 L29 I39 C41 K56 Y105	S12-F20 CarbonylContact C-O 3.59Å; S12-F20 VanDerWaalsContact CA-O 3.26Å; S12-F20 WeakPolarHBondContact CA-O 3.39Å; V13-F20 PolarHBondContact N-O 3.33Å; V13-F20 PolarHBondContact O-N 3.03Å; V15-F20 HydrophobicContact CB-CD2 3.74Å; V15-F20 HydrophobicContact CB-CE2 4.02Å; V15-F20 HydrophobicContact CB-CG 4.47Å; V15-F20 HydrophobicContact CG1-CE2 4.35Å; V15-F20 HydrophobicContact CG2-CB 4.18Å; V15-F20 HydrophobicContact CG2-CD2 3.8Å; V15-F20 HydrophobicContact CG2-CE2 4.41Å; V15-F20 HydrophobicContact CG2-CG 4.03Å; F20-V22 HydrophobicContact CB-CG1 4.22Å; F20-V22 HydrophobicContact CD1-CG1 4.16Å; 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 3.87Å; F20-I39 HydrophobicContact CE2-CD1 4.44Å; F20-I39 HydrophobicContact CE2-CG2 3.7Å; F20-I39 HydrophobicContact CZ-CB 3.75Å; F20-I39 HydrophobicContact CZ-CG2 3.65Å; F20-C41 HydrophobicContact CE1-CB 4.24Å; F20-C41 VanDerWaalsContact CE1-SG 3.57Å; F20-K56 HydrophobicContact CD1-CB 4.47Å; F20-K56 HydrophobicContact CD2-CD 4.37Å; F20-K56 HydrophobicContact CE1-CB 3.77Å; F20-K56 HydrophobicContact CE2-CB 4.18Å; F20-K56 HydrophobicContact CE2-CD 4.24Å; F20-K56 HydrophobicContact CZ-CB 3.6Å; F20-K56 HydrophobicContact CZ-CD 4.49Å; F20-Y105 HydrophobicContact CD1-CD1 4.36Å; F20-Y105 AromaticContact CD1-CE1 3.72Å; F20-Y105 HydrophobicContact CD1-CE1 3.72Å; F20-Y105 HydrophobicContact CE1-CE1 4.14Å; F20-Y105 HydrophobicContact CG-CE1 4.21Å
21	T	96.6	Very high	93.6	Very high	31 Å²	31	65.9 Å²	65.9	19%	0.19	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	99.7	172.6	-55.9	0	0	0	0	108.5	F10 Y11 S12 P94 Y105	F10-T21 HydrophobicContact CB-CG2 4.03Å; Y11-T21 CarbonylContact O-C 3.48Å; Y11-T21 WeakPolarHBondContact O-CA 3.05Å; S12-T21 PolarHBondContact OG-OG1 2.9Å; T21-P94 HydrophobicContact CG2-CB 3.59Å; T21-P94 HydrophobicContact CG2-CG 4.17Å; T21-Y105 PolarHBondContact N-OH 3.35Å; T21-Y105 WeakPolarHBondContact O-CE2 3.48Å
22	V	96.7	Very high	93.3	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	159.8	-167.7	-59.8	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 3.35Å; F10-V22 VanDerWaalsContact CD1-C 3.49Å; Y11-V22 HydrophobicContact CD1-CG2 4.06Å; Y11-V22 WeakPolarHBondContact CD1-O 2.89Å; Y11-V22 HydrophobicContact CE1-CG2 3.5Å; Y11-V22 VanDerWaalsContact CE1-CG2 3.5Å; Y11-V22 PolarHBondContact N-O 3.25Å; Y11-V22 PolarHBondContact O-N 2.89Å; F20-V22 HydrophobicContact CB-CG1 4.22Å; F20-V22 HydrophobicContact CD1-CG1 4.16Å; V22-L29 HydrophobicContact CG1-CD2 4.08Å; V22-L29 HydrophobicContact CG2-CD1 4.01Å; V22-L29 HydrophobicContact CG2-CD2 4.03Å; V22-V54 HydrophobicContact CG1-CG1 4.4Å; 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 3.98Å; V22-Y105 HydrophobicContact CG1-CD1 4.05Å; V22-Y105 HydrophobicContact CG1-CE1 3.89Å
23	L	96.5	Very high	92.6	Very high	28 Å²	28	64.9 Å²	64.9	15%	0.147	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	139	173.5	-68.5	170	0	0	0	110.5	F10 R25 Y26 F92	F10-L23 HydrophobicContact CD1-CD2 4.03Å; F10-L23 HydrophobicContact CD1-CG 4.29Å; F10-L23 HydrophobicContact CD2-CD2 4.45Å; F10-L23 HydrophobicContact CE1-CD2 3.48Å; F10-L23 VanDerWaalsContact CE1-CD2 3.48Å; F10-L23 HydrophobicContact CE1-CG 3.73Å; F10-L23 HydrophobicContact CE2-CD2 3.96Å; F10-L23 HydrophobicContact CG-CD2 4.48Å; F10-L23 HydrophobicContact CZ-CD2 3.44Å; F10-L23 VanDerWaalsContact CZ-CD2 3.44Å; F10-L23 HydrophobicContact CZ-CG 4.14Å; L23-R25 HydrophobicContact CB-CG 3.97Å; L23-R25 PolarHBondContact O-N 3.31Å; L23-Y26 HydrophobicContact CB-CD2 3.91Å; L23-Y26 HydrophobicContact CB-CE2 4Å; L23-Y26 HydrophobicContact CD1-CE2 4.04Å; L23-Y26 HydrophobicContact CG-CE2 4.48Å; L23-Y26 PolarHBondContact O-N 3.19Å; L23-F92 HydrophobicContact CD1-CB 4.27Å; L23-F92 HydrophobicContact CD1-CD1 3.96Å; L23-F92 HydrophobicContact CD1-CE1 4.45Å; L23-F92 HydrophobicContact CD1-CG 4.01Å; L23-F92 HydrophobicContact CG-CD1 4.41Å; L23-F92 HydrophobicContact CG-CD2 4.29Å; L23-F92 HydrophobicContact CG-CE2 4.5Å; L23-F92 HydrophobicContact CG-CG 4.23Å
24	K	96.1	Very high	91.7	Very high	111 Å²	111	67.8 Å²	67.8	48%	0.483	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-16.6	179.9	-76.7	179.4	178.4	176	0	115.5	G8 Q9 Y11 Y26	G8-K24 WeakPolarHBondContact O-CD 3.08Å; G8-K24 WeakPolarHBondContact O-CE 3.48Å; G8-K24 PolarHBondContact O-NZ 2.89Å; Q9-K24 WeakPolarHBondContact O-CG 3.44Å; Q9-K24 PolarHBondContact O-N 2.82Å; Y11-K24 HydrophobicContact CD1-CG 4.08Å; K24-Y26 VanDerWaalsContact C-N 3.3Å
25	R	96.6	Very high	90.6	Very high	66 Å²	66	63.9 Å²	63.9	25%	0.249	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-27.7	174	69.9	-175.3	-71.3	178.2	-10.5	113.2	L23 F44 D45 T46 V47	L23-R25 HydrophobicContact CB-CG 3.97Å; L23-R25 PolarHBondContact O-N 3.31Å; R25-F44 VanDerWaalsContact O-O 3.05Å; R25-D45 IonicContact CZ-OD1 2.61Å; R25-D45 IonicContact CZ-OD2 3.81Å; R25-D45 IonicContact NE-OD1 3.11Å; R25-D45 PolarHBondContact NE-OD1 2.86Å; R25-D45 IonicContact NE-OD2 3.73Å; R25-D45 PolarHBondContact NE-OD2 3.09Å; R25-D45 VanDerWaalsContact NH2-CG 3.31Å; R25-D45 IonicContact NH2-OD1 2.66Å; R25-D45 PolarHBondContact NH2-OD1 2.97Å; R25-D45 VanDerWaalsContact NH2-OD1 3.08Å; R25-D45 IonicContact NH2-OD2 3.39Å; R25-D45 PolarHBondContact NH2-OD2 3.45Å; R25-T46 WeakPolarHBondContact CA-OG1 3.2Å; R25-T46 PolarHBondContact O-N 2.96Å; R25-T46 PolarHBondContact O-OG1 2.88Å; R25-V47 HydrophobicContact CB-CG2 3.97Å
26	Y	97.7	Very high	89.7	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	106.7	178.5	-57.3	-57	0	0	0	108.5	Y11 L23 K24 L29 F44 D45 V52 V54 N90 F92 V107	Y11-Y26 VanDerWaalsContact CE1-O 3.3Å; Y11-Y26 WeakPolarHBondContact CE1-O 3.47Å; Y11-Y26 PolarHBondContact OH-O 3.18Å; L23-Y26 HydrophobicContact CB-CD2 3.91Å; L23-Y26 HydrophobicContact CB-CE2 4Å; L23-Y26 HydrophobicContact CD1-CE2 4.04Å; L23-Y26 HydrophobicContact CG-CE2 4.48Å; L23-Y26 PolarHBondContact O-N 3.19Å; K24-Y26 VanDerWaalsContact C-N 3.3Å; Y26-L29 WeakPolarHBondContact O-CD1 3.34Å; Y26-F44 WeakPolarHBondContact CA-O 3.39Å; Y26-D45 HydrophobicContact CD1-CB 4.06Å; Y26-D45 HydrophobicContact CE1-CB 3.95Å; Y26-D45 WeakPolarHBondContact CE1-OD2 3.03Å; Y26-V52 HydrophobicContact CD1-CG2 3.83Å; Y26-V52 HydrophobicContact CE1-CG2 4.04Å; Y26-V54 HydrophobicContact CG-CG2 4.42Å; Y26-N90 VanDerWaalsContact OH-CB 3.29Å; Y26-N90 WeakPolarHBondContact OH-CB 3.4Å; Y26-N90 PolarHBondContact OH-ND2 3.26Å; Y26-F92 AromaticContact CD2-CE1 3.91Å; Y26-F92 HydrophobicContact CD2-CE1 3.91Å; Y26-F92 HydrophobicContact CD2-CZ 4.21Å; 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 3.79Å; Y26-V107 HydrophobicContact CE1-CG2 4.3Å; Y26-V107 HydrophobicContact CE2-CG2 3.9Å
27	Q	96.6	Very high	89.4	Confident	87 Å²	87	66 Å²	66	41%	0.407	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	167.1	-176.1	-62	-174.1	-4.2	0	0	111	L29 A43 F44 T46	Q27-L29 PolarHBondContact O-N 3.37Å; Q27-A43 CarbonylContact O-C 3.6Å; Q27-A43 WeakPolarHBondContact O-CA 3.39Å; Q27-A43 WeakPolarHBondContact O-CB 3.08Å; Q27-F44 PolarHBondContact N-O 3.26Å; Q27-F44 PolarHBondContact O-N 2.98Å; Q27-T46 HydrophobicContact CB-CG2 4.5Å; Q27-T46 VanDerWaalsContact CD-CG2 3.43Å; Q27-T46 HydrophobicContact CG-CG2 3.89Å
28	Q	94.7	Very high	89.3	Confident	156 Å²	156	58 Å²	58	73%	0.729	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	56.9	44.1	173.4	-54.1	178.2	-0.7	0	0	113.6	K30	Q28-K30 PolarHBondContact O-N 2.92Å
29	L	96	Very high	89.3	Confident	26 Å²	26	58.1 Å²	58.1	14%	0.136	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	123.1	179.5	-89	71.2	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 4.08Å; V22-L29 HydrophobicContact CG2-CD1 4.01Å; V22-L29 HydrophobicContact CG2-CD2 4.03Å; Y26-L29 WeakPolarHBondContact O-CD1 3.34Å; Q27-L29 PolarHBondContact O-N 3.37Å; L29-C41 HydrophobicContact CB-CB 4.45Å; L29-C41 HydrophobicContact CD2-CB 4.44Å; L29-C41 HydrophobicContact CG-CB 4.26Å; L29-A42 CarbonylContact C-O 3.59Å; L29-A42 VanDerWaalsContact CA-O 3.3Å; L29-A42 WeakPolarHBondContact CA-O 3.22Å; L29-A43 HydrophobicContact CD1-CB 3.88Å; L29-A43 HydrophobicContact CG-CB 4.23Å
30	K	94.2	Very high	89.2	Confident	144 Å²	144	57.3 Å²	57.3	63%	0.626	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.5	125.3	175.4	-176.7	-177.9	178.1	-175.5	0	109.6	Q28 I32 C41 A42	Q28-K30 PolarHBondContact O-N 2.92Å; K30-I32 PolarHBondContact O-N 3.45Å; K30-C41 CarbonylContact O-C 3.17Å; K30-C41 WeakPolarHBondContact O-CA 3.49Å; K30-A42 PolarHBondContact N-O 3.34Å; K30-A42 PolarHBondContact O-N 3.31Å
31	P	92.4	Very high	89.2	Confident	75 Å²	75	57.3 Å²	57.3	49%	0.487	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	131.9	176.8	24.8	-31.4	0	0	0	110.7	V15	V15-P31 HydrophobicContact CG1-CB 3.69Å; V15-P31 HydrophobicContact CG1-CG 4.05Å
32	I	88.9	Confident	89.1	Confident	88 Å²	88	56.6 Å²	56.6	45%	0.451	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	-18.1	177.4	61.2	174	0	0	0	113.1	K30 V40 A42 A53 L110	K30-I32 PolarHBondContact O-N 3.45Å; I32-V40 HydrophobicContact CD1-CG1 3.85Å; I32-V40 HydrophobicContact CG1-CB 4.12Å; I32-V40 HydrophobicContact CG1-CG1 3.83Å; I32-V40 WeakPolarHBondContact CG1-O 3.3Å; I32-V40 PolarHBondContact N-O 2.92Å; I32-A42 HydrophobicContact CD1-CB 4.33Å; I32-A42 HydrophobicContact CG2-CB 3.73Å; I32-A53 HydrophobicContact CD1-CB 4.49Å; I32-L110 HydrophobicContact CD1-CD1 3.62Å
33	G	80.8	Confident	89.2	Confident	34 Å²	34	56.8 Å²	56.8	35%	0.351	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.5	151.6	178.2	0	0	0	0	0	112.5	V40	G33-V40 PolarHBondContact N-O 3.45Å; G33-V40 PolarHBondContact O-N 3.25Å
34	S	77.7	Confident	89.3	Confident	108 Å²	108	58.7 Å²	58.7	76%	0.755	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139	144.9	170.7	63.8	0	0	0	0	109
35	G	70.6	Confident	89.3	Confident	50 Å²	50	53.4 Å²	53.4	52%	0.515	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	-179.4	179.8	0	0	0	0	0	112.3	Q37 G38	G35-Q37 PolarHBondContact O-N 2.97Å; G35-G38 PolarHBondContact N-O 3.06Å; G35-G38 PolarHBondContact O-N 3.35Å; G35-G38 VanDerWaalsContact O-N 3.12Å; G35-G38 VanDerWaalsContact O-O 3.14Å
36	A	69.3	Low	89.3	Confident	96 Å²	96	53.2 Å²	53.2	79%	0.793	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-24.4	-177.2	0	0	0	0	0	113.8
37	Q	72.2	Confident	89.2	Confident	37 Å²	37	57.9 Å²	57.9	17%	0.173	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-15.9	-177	-61.1	179.5	-3.5	0	0	113.9	G35 L57 S58 D169	G35-Q37 PolarHBondContact O-N 2.97Å; Q37-L57 WeakPolarHBondContact O-CA 3.23Å; Q37-S58 PolarHBondContact O-N 2.91Å; Q37-D169 PolarHBondContact NE2-OD1 2.9Å; Q37-D169 PolarHBondContact NE2-OD2 3.47Å; Q37-D169 VanDerWaalsContact OE1-CG 3.28Å; Q37-D169 PolarHBondContact OE1-OD1 2.88Å; Q37-D169 VanDerWaalsContact OE1-OD1 3.11Å; Q37-D169 PolarHBondContact OE1-OD2 3.38Å
38	G	83.1	Confident	89.1	Confident	5 Å²	5	57.5 Å²	57.5	5%	0.052	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.8	175.9	-168	0	0	0	0	0	115	G35 K56 S58	G35-G38 PolarHBondContact N-O 3.06Å; G35-G38 PolarHBondContact O-N 3.35Å; G35-G38 VanDerWaalsContact O-N 3.12Å; G35-G38 VanDerWaalsContact O-O 3.14Å; G38-K56 CarbonylContact C-O 3.54Å; G38-K56 WeakPolarHBondContact CA-O 3.42Å; G38-S58 VanDerWaalsContact CA-OG 3.29Å; G38-S58 WeakPolarHBondContact CA-OG 3.36Å
39	I	89	Confident	89.2	Confident	28 Å²	28	52.3 Å²	52.3	14%	0.144	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	137.2	170.6	-59.6	167.3	0	0	0	107.4	V15 F20 K55 K56	V15-I39 HydrophobicContact CG1-CG2 4.48Å; F20-I39 HydrophobicContact CE2-CB 3.87Å; F20-I39 HydrophobicContact CE2-CD1 4.44Å; F20-I39 HydrophobicContact CE2-CG2 3.7Å; F20-I39 HydrophobicContact CZ-CB 3.75Å; F20-I39 HydrophobicContact CZ-CG2 3.65Å; I39-K55 CarbonylContact O-C 3.58Å; I39-K55 WeakPolarHBondContact O-CA 3.31Å; I39-K56 PolarHBondContact N-O 3.07Å; I39-K56 VanDerWaalsContact N-O 3.11Å; I39-K56 PolarHBondContact O-N 3.36Å
40	V	91.7	Very high	89.2	Confident	33 Å²	33	54.8 Å²	54.8	20%	0.2	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	129.3	-179.3	-169.1	0	0	0	0	109.6	I32 G33 A53 V54 K55	I32-V40 HydrophobicContact CD1-CG1 3.85Å; I32-V40 HydrophobicContact CG1-CB 4.12Å; I32-V40 HydrophobicContact CG1-CG1 3.83Å; I32-V40 WeakPolarHBondContact CG1-O 3.3Å; I32-V40 PolarHBondContact N-O 2.92Å; G33-V40 PolarHBondContact N-O 3.45Å; G33-V40 PolarHBondContact O-N 3.25Å; V40-A53 HydrophobicContact CG1-CB 4.15Å; V40-V54 WeakPolarHBondContact CA-O 3.28Å; V40-K55 HydrophobicContact CG2-CB 4.1Å; V40-K55 HydrophobicContact CG2-CD 4.48Å; V40-K55 HydrophobicContact CG2-CG 4.02Å
41	C	95	Very high	89.4	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	140.2	173.9	-65.8	0	0	0	0	110.6	V15 F20 L29 K30 A53 V54	V15-C41 VanDerWaalsContact CG1-SG 3.58Å; F20-C41 HydrophobicContact CE1-CB 4.24Å; F20-C41 VanDerWaalsContact CE1-SG 3.57Å; L29-C41 HydrophobicContact CB-CB 4.45Å; L29-C41 HydrophobicContact CD2-CB 4.44Å; L29-C41 HydrophobicContact CG-CB 4.26Å; K30-C41 CarbonylContact O-C 3.17Å; K30-C41 WeakPolarHBondContact O-CA 3.49Å; C41-A53 CarbonylContact O-C 3.57Å; C41-A53 WeakPolarHBondContact O-CA 3.38Å; C41-V54 PolarHBondContact N-O 3.49Å; C41-V54 PolarHBondContact O-N 3.36Å
42	A	96	Very high	89.6	Confident	17 Å²	17	48.9 Å²	48.9	14%	0.14	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	143.6	156.7	0	0	0	0	0	109.1	L29 K30 I32 V52 L110	L29-A42 CarbonylContact C-O 3.59Å; L29-A42 VanDerWaalsContact CA-O 3.3Å; L29-A42 WeakPolarHBondContact CA-O 3.22Å; K30-A42 PolarHBondContact N-O 3.34Å; K30-A42 PolarHBondContact O-N 3.31Å; I32-A42 HydrophobicContact CD1-CB 4.33Å; I32-A42 HydrophobicContact CG2-CB 3.73Å; A42-V52 CarbonylContact C-O 3.54Å; A42-V52 WeakPolarHBondContact CA-O 3.42Å; A42-L110 HydrophobicContact CB-CD1 4Å; A42-L110 HydrophobicContact CB-CD2 3.93Å
43	A	97.8	Very high	89.9	Confident	4 Å²	4	45.1 Å²	45.1	3%	0.033	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	157.9	172.8	0	0	0	0	0	110	Q27 L29 N51 V52 V54	Q27-A43 CarbonylContact O-C 3.6Å; Q27-A43 WeakPolarHBondContact O-CA 3.39Å; Q27-A43 WeakPolarHBondContact O-CB 3.08Å; L29-A43 HydrophobicContact CD1-CB 3.88Å; L29-A43 HydrophobicContact CG-CB 4.23Å; A43-N51 CarbonylContact O-C 3.5Å; A43-N51 WeakPolarHBondContact O-CA 3.39Å; A43-V52 HydrophobicContact CB-CG2 4.17Å; A43-V52 PolarHBondContact N-O 2.89Å; A43-V52 WeakPolarHBondContact O-CG2 2.86Å; A43-V52 PolarHBondContact O-N 2.77Å; A43-V54 HydrophobicContact CB-CG2 4Å
44	F	98.1	Very high	90.6	Very high	67 Å²	67	43.5 Å²	43.5	29%	0.294	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	122.9	169.4	-176.8	-106.3	0	0	0	109.5	R25 Y26 Q27 T46 N51	R25-F44 VanDerWaalsContact O-O 3.05Å; Y26-F44 WeakPolarHBondContact CA-O 3.39Å; Q27-F44 PolarHBondContact N-O 3.26Å; Q27-F44 PolarHBondContact O-N 2.98Å; F44-T46 HydrophobicContact CD1-CG2 3.88Å; F44-T46 HydrophobicContact CE1-CG2 4.09Å; F44-T46 PolarHBondContact O-N 3.23Å; F44-N51 WeakPolarHBondContact CD2-OD1 3.22Å
45	D	97.7	Very high	91.4	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	104.8	174	-174.3	-16.1	0	0	0	109.9	R25 Y26 V47 L48 G49 I50 V52	R25-D45 IonicContact CZ-OD1 2.61Å; R25-D45 IonicContact CZ-OD2 3.81Å; R25-D45 IonicContact NE-OD1 3.11Å; R25-D45 PolarHBondContact NE-OD1 2.86Å; R25-D45 IonicContact NE-OD2 3.73Å; R25-D45 PolarHBondContact NE-OD2 3.09Å; R25-D45 VanDerWaalsContact NH2-CG 3.31Å; R25-D45 IonicContact NH2-OD1 2.66Å; R25-D45 PolarHBondContact NH2-OD1 2.97Å; R25-D45 VanDerWaalsContact NH2-OD1 3.08Å; R25-D45 IonicContact NH2-OD2 3.39Å; R25-D45 PolarHBondContact NH2-OD2 3.45Å; Y26-D45 HydrophobicContact CD1-CB 4.06Å; Y26-D45 HydrophobicContact CE1-CB 3.95Å; Y26-D45 WeakPolarHBondContact CE1-OD2 3.03Å; D45-V47 PolarHBondContact O-N 2.88Å; D45-V47 PolarHBondContact OD1-N 2.87Å; D45-L48 HydrophobicContact CB-CB 4.29Å; D45-L48 PolarHBondContact O-N 2.87Å; D45-L48 PolarHBondContact OD1-N 3.06Å; D45-L48 WeakPolarHBondContact OD2-CD1 3.4Å; D45-L48 WeakPolarHBondContact OD2-CG 3.35Å; D45-G49 WeakPolarHBondContact O-CA 3.31Å; D45-G49 PolarHBondContact O-N 3.24Å; D45-I50 PolarHBondContact N-O 3.02Å; D45-V52 HydrophobicContact CB-CG1 3.92Å; D45-V52 HydrophobicContact CB-CG2 4.18Å
46	T	96.7	Very high	92.5	Very high	61 Å²	61	37.9 Å²	37.9	37%	0.374	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-16.2	-176.3	58.3	0	0	0	0	114.6	R25 Q27 F44	R25-T46 WeakPolarHBondContact CA-OG1 3.2Å; R25-T46 PolarHBondContact O-N 2.96Å; R25-T46 PolarHBondContact O-OG1 2.88Å; Q27-T46 HydrophobicContact CB-CG2 4.5Å; Q27-T46 VanDerWaalsContact CD-CG2 3.43Å; Q27-T46 HydrophobicContact CG-CG2 3.89Å; F44-T46 HydrophobicContact CD1-CG2 3.88Å; F44-T46 HydrophobicContact CE1-CG2 4.09Å; F44-T46 PolarHBondContact O-N 3.23Å
47	V	95.1	Very high	93.6	Very high	99 Å²	99	33.8 Å²	33.8	60%	0.6	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-38.8	177.8	173.4	0	0	0	0	110.9	R25 D45	R25-V47 HydrophobicContact CB-CG2 3.97Å; D45-V47 PolarHBondContact O-N 2.88Å; D45-V47 PolarHBondContact OD1-N 2.87Å
48	L	94.3	Very high	94.1	Very high	79 Å²	79	34.6 Å²	34.6	41%	0.414	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-19.1	178.2	-65.5	179.7	0	0	0	113	D45 I50	D45-L48 HydrophobicContact CB-CB 4.29Å; D45-L48 PolarHBondContact O-N 2.87Å; D45-L48 PolarHBondContact OD1-N 3.06Å; D45-L48 WeakPolarHBondContact OD2-CD1 3.4Å; D45-L48 WeakPolarHBondContact OD2-CG 3.35Å; L48-I50 VanDerWaalsContact C-N 3.28Å; L48-I50 HydrophobicContact CB-CD1 4.1Å; L48-I50 HydrophobicContact CB-CG1 3.76Å; L48-I50 HydrophobicContact CD1-CD1 4.05Å; L48-I50 HydrophobicContact CD1-CG1 4.39Å; L48-I50 PolarHBondContact O-N 3.03Å
49	G	96.4	Very high	94.3	Very high	47 Å²	47	43.3 Å²	43.3	49%	0.485	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.8	22.1	-176.8	0	0	0	0	0	113.8	D45	D45-G49 WeakPolarHBondContact O-CA 3.31Å; D45-G49 PolarHBondContact O-N 3.24Å
50	I	96.5	Very high	94.4	Very high	78 Å²	78	42.2 Å²	42.2	40%	0.4	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	158	-176.3	66.8	179	0	0	0	111.3	D45 L48 V52 L89	D45-I50 PolarHBondContact N-O 3.02Å; L48-I50 VanDerWaalsContact C-N 3.28Å; L48-I50 HydrophobicContact CB-CD1 4.1Å; L48-I50 HydrophobicContact CB-CG1 3.76Å; L48-I50 HydrophobicContact CD1-CD1 4.05Å; L48-I50 HydrophobicContact CD1-CG1 4.39Å; L48-I50 PolarHBondContact O-N 3.03Å; I50-V52 HydrophobicContact CD1-CG1 4.4Å; I50-V52 HydrophobicContact CG1-CG1 4.07Å; I50-L89 HydrophobicContact CD1-CD1 4.32Å
51	N	97.1	Very high	94.4	Very high	94 Å²	94	42.2 Å²	42.2	50%	0.503	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	141.5	168.2	-66.7	-43.2	0	0	0	110.7	A43 F44 L110	A43-N51 CarbonylContact O-C 3.5Å; A43-N51 WeakPolarHBondContact O-CA 3.39Å; F44-N51 WeakPolarHBondContact CD2-OD1 3.22Å; N51-L110 HydrophobicContact CB-CB 4.17Å; N51-L110 HydrophobicContact CB-CD2 3.63Å
52	V	97.5	Very high	94.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	157.3	-177.5	-62.1	0	0	0	0	110.9	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 3.54Å; A42-V52 WeakPolarHBondContact CA-O 3.42Å; A43-V52 HydrophobicContact CB-CG2 4.17Å; A43-V52 PolarHBondContact N-O 2.89Å; A43-V52 WeakPolarHBondContact O-CG2 2.86Å; A43-V52 PolarHBondContact O-N 2.77Å; D45-V52 HydrophobicContact CB-CG1 3.92Å; D45-V52 HydrophobicContact CB-CG2 4.18Å; I50-V52 HydrophobicContact CD1-CG1 4.4Å; I50-V52 HydrophobicContact CG1-CG1 4.07Å; V52-V54 HydrophobicContact CG2-CG2 4.2Å; V52-L89 HydrophobicContact CG1-CD1 3.74Å; V52-V107 HydrophobicContact CB-CG1 3.81Å; V52-V107 HydrophobicContact CG1-CG1 4.23Å; V52-V107 HydrophobicContact CG2-CG1 3.85Å; V52-M108 CarbonylContact C-O 3.6Å; V52-M108 WeakPolarHBondContact CA-O 3.43Å; V52-M108 WeakPolarHBondContact CB-O 3.41Å
53	A	96	Very high	93.8	Very high	9 Å²	9	49.2 Å²	49.2	7%	0.074	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	124.9	169.1	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 3.57Å; C41-A53 WeakPolarHBondContact O-CA 3.38Å; A53-V107 CarbonylContact O-C 3.59Å; A53-V107 WeakPolarHBondContact O-CA 3.43Å; A53-M108 PolarHBondContact N-O 3.33Å; A53-M108 PolarHBondContact O-N 3.39Å; A53-L110 HydrophobicContact CB-CD1 4.04Å
54	V	95.7	Very high	93.4	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	107.8	178	-175.6	0	0	0	0	108.9	V22 Y26 V40 C41 A43 V52 Y105 L106 V107	V22-V54 HydrophobicContact CG1-CG1 4.4Å; Y26-V54 HydrophobicContact CG-CG2 4.42Å; V40-V54 WeakPolarHBondContact CA-O 3.28Å; C41-V54 PolarHBondContact N-O 3.49Å; C41-V54 PolarHBondContact O-N 3.36Å; 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 3.58Å; V54-L106 WeakPolarHBondContact CA-O 3.47Å; V54-V107 HydrophobicContact CG2-CG1 4.45Å; V54-V107 HydrophobicContact CG2-CG2 4.33Å
55	K	93.6	Very high	92.7	Very high	17 Å²	17	54.9 Å²	54.9	7%	0.074	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	117.8	176.3	-179.9	177.7	-178	-175.2	0	109.9	I39 V40 L57 E73 Y105 L106 M108	I39-K55 CarbonylContact O-C 3.58Å; I39-K55 WeakPolarHBondContact O-CA 3.31Å; V40-K55 HydrophobicContact CG2-CB 4.1Å; V40-K55 HydrophobicContact CG2-CD 4.48Å; V40-K55 HydrophobicContact CG2-CG 4.02Å; K55-L57 HydrophobicContact CD-CD2 4.23Å; K55-L57 HydrophobicContact CG-CD2 4.28Å; K55-E73 IonicContact NZ-OE1 3.98Å; K55-E73 PolarHBondContact NZ-OE1 2.94Å; K55-E73 IonicContact NZ-OE2 2.67Å; K55-E73 PolarHBondContact NZ-OE2 3.03Å; K55-Y105 CarbonylContact O-C 3.59Å; K55-Y105 WeakPolarHBondContact O-CA 3.42Å; K55-L106 HydrophobicContact CB-CB 4.39Å; K55-L106 PolarHBondContact N-O 2.96Å; K55-L106 PolarHBondContact O-N 3.46Å; K55-M108 HydrophobicContact CB-CE 3.89Å; K55-M108 HydrophobicContact CD-CE 4.37Å
56	K	94.3	Very high	92.2	Very high	24 Å²	24	57.5 Å²	57.5	10%	0.104	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	120.1	167.7	-175.1	-176.6	-174.5	178.9	0	109	T19 F20 G38 I39 D103 Y105	T19-K56 PolarHBondContact O-NZ 3.16Å; F20-K56 HydrophobicContact CD1-CB 4.47Å; F20-K56 HydrophobicContact CD2-CD 4.37Å; F20-K56 HydrophobicContact CE1-CB 3.77Å; F20-K56 HydrophobicContact CE2-CB 4.18Å; F20-K56 HydrophobicContact CE2-CD 4.24Å; F20-K56 HydrophobicContact CZ-CB 3.6Å; F20-K56 HydrophobicContact CZ-CD 4.49Å; G38-K56 CarbonylContact C-O 3.54Å; G38-K56 WeakPolarHBondContact CA-O 3.42Å; I39-K56 PolarHBondContact N-O 3.07Å; I39-K56 VanDerWaalsContact N-O 3.11Å; I39-K56 PolarHBondContact O-N 3.36Å; K56-D103 WeakPolarHBondContact CE-OD1 3.32Å; K56-D103 IonicContact NZ-OD1 3.81Å; K56-D103 PolarHBondContact NZ-OD1 2.93Å; K56-D103 IonicContact NZ-OD2 3.71Å; K56-Y105 HydrophobicContact CB-CD1 3.94Å; K56-Y105 HydrophobicContact CB-CE1 3.64Å; K56-Y105 HydrophobicContact CD-CE1 3.89Å; K56-Y105 WeakPolarHBondContact CD-OH 3.35Å; K56-Y105 VanDerWaalsContact CE-OH 3.31Å; K56-Y105 WeakPolarHBondContact CE-OH 3.29Å; K56-Y105 HydrophobicContact CG-CD1 4.2Å; K56-Y105 HydrophobicContact CG-CE1 3.63Å
57	L	91.3	Very high	91.9	Very high	9 Å²	9	54.6 Å²	54.6	5%	0.047	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	130	176.4	-61.1	-170.7	0	0	0	111	Q37 K55 R59 P60 A70 V104 L106	Q37-L57 WeakPolarHBondContact O-CA 3.23Å; K55-L57 HydrophobicContact CD-CD2 4.23Å; K55-L57 HydrophobicContact CG-CD2 4.28Å; L57-R59 PolarHBondContact O-N 3.05Å; L57-P60 HydrophobicContact CB-CB 4.47Å; L57-P60 HydrophobicContact CB-CG 4.36Å; L57-A70 HydrophobicContact CD1-CB 3.85Å; L57-V104 HydrophobicContact CB-CB 4.4Å; L57-V104 HydrophobicContact CD1-CB 3.97Å; L57-V104 HydrophobicContact CD1-CG1 4.01Å; L57-V104 HydrophobicContact CG-CB 4.22Å; L57-V104 HydrophobicContact CG-CG1 4.44Å; L57-V104 PolarHBondContact N-O 3.33Å; L57-L106 HydrophobicContact CD1-CD1 4.46Å; L57-L106 HydrophobicContact CD2-CD1 3.95Å; L57-L106 HydrophobicContact CG-CD1 4.4Å
58	S	84	Confident	91.5	Very high	54 Å²	54	52 Å²	52	38%	0.378	27%	0.268	S	S	.	.	S	Bend	trans	-82	108.5	179.9	-75.5	0	0	0	0	111.1	Q37 G38	Q37-S58 PolarHBondContact O-N 2.91Å; G38-S58 VanDerWaalsContact CA-OG 3.29Å; G38-S58 WeakPolarHBondContact CA-OG 3.36Å
59	R	86.5	Confident	91	Very high	189 Å²	189	51.2 Å²	51.2	71%	0.713	26%	0.26	S	S	*	.			trans	46	56.4	173.7	-55.4	-178.9	-175.2	166.2	1.7	113.4	L57 F61 Q62	L57-R59 PolarHBondContact O-N 3.05Å; R59-F61 PolarHBondContact O-N 3.01Å; R59-Q62 HydrophobicContact CB-CB 4.1Å; R59-Q62 WeakPolarHBondContact O-CB 3.26Å; R59-Q62 PolarHBondContact O-N 2.85Å
60	P	90.6	Very high	90.7	Very high	5 Å²	5	49.3 Å²	49.3	3%	0.032	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-27	-175.1	23.6	-33.8	0	0	0	113.1	L57 H66 A67 A70 V104	L57-P60 HydrophobicContact CB-CB 4.47Å; L57-P60 HydrophobicContact CB-CG 4.36Å; P60-H66 CarbonylContact O-C 3.11Å; P60-H66 WeakPolarHBondContact O-CB 3.38Å; P60-A67 WeakPolarHBondContact O-CA 3.33Å; P60-A67 PolarHBondContact O-N 3.38Å; P60-A70 HydrophobicContact CB-CB 3.65Å; P60-V104 HydrophobicContact CG-CG2 4.49Å
61	F	92.6	Very high	90.3	Very high	32 Å²	32	46.4 Å²	46.4	14%	0.14	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	12.1	-177.9	-44.6	-61.5	0	0	0	114.5	R59 N63 F101 V104 I349 K353 I356	R59-F61 PolarHBondContact O-N 3.01Å; F61-N63 VanDerWaalsContact C-N 3.28Å; F61-N63 PolarHBondContact O-N 2.79Å; F61-F101 HydrophobicContact CE1-CE1 4.09Å; F61-F101 AromaticContact CE2-CD1 3.96Å; F61-F101 HydrophobicContact CE2-CD1 3.96Å; F61-F101 AromaticContact CE2-CE1 3.86Å; F61-F101 HydrophobicContact CE2-CE1 3.86Å; F61-F101 HydrophobicContact CE2-CG 4.44Å; F61-F101 HydrophobicContact CE2-CZ 4.24Å; F61-F101 AromaticContact CZ-CD1 3.75Å; F61-F101 HydrophobicContact CZ-CD1 3.75Å; F61-F101 AromaticContact CZ-CE1 3.23Å; F61-F101 HydrophobicContact CZ-CE1 3.23Å; F61-F101 AromaticContact CZ-CZ 3.69Å; F61-F101 HydrophobicContact CZ-CZ 3.69Å; F61-V104 HydrophobicContact CZ-CG2 4.47Å; F61-I349 HydrophobicContact CB-CG2 4.06Å; F61-I349 VanDerWaalsContact O-CG2 3.27Å; F61-I349 WeakPolarHBondContact O-CG2 3.15Å; F61-K353 HydrophobicContact CD1-CB 3.86Å; F61-K353 HydrophobicContact CD1-CG 4.01Å; F61-K353 HydrophobicContact CD2-CG 4.35Å; F61-K353 HydrophobicContact CE1-CB 3.98Å; F61-K353 HydrophobicContact CE1-CG 3.95Å; F61-K353 HydrophobicContact CE2-CG 4.29Å; F61-K353 HydrophobicContact CG-CB 4.41Å; F61-K353 HydrophobicContact CG-CG 4.24Å; F61-K353 HydrophobicContact CZ-CG 4.13Å; F61-I356 HydrophobicContact CD1-CD1 4.4Å; F61-I356 HydrophobicContact CE1-CB 4.25Å; F61-I356 HydrophobicContact CE1-CD1 3.59Å; F61-I356 HydrophobicContact CE1-CG1 4.48Å; F61-I356 HydrophobicContact CE1-CG2 4.49Å; F61-I356 HydrophobicContact CZ-CD1 4.41Å; F61-I356 HydrophobicContact CZ-CG2 4.37Å
62	Q	89.2	Confident	89.8	Confident	113 Å²	113	42.1 Å²	42.1	53%	0.528	20%	0.201	S	C	.	.	S	Bend	trans	-62.7	-34.6	-176.8	177.6	177.4	-1.7	0	0	113.1	R59	R59-Q62 HydrophobicContact CB-CB 4.1Å; R59-Q62 WeakPolarHBondContact O-CB 3.26Å; R59-Q62 PolarHBondContact O-N 2.85Å
63	N	89.2	Confident	89.3	Confident	51 Å²	51	42.4 Å²	42.4	27%	0.273	20%	0.202	S	C	.	.	S	Bend	trans	-156.3	170.2	174.5	60.9	50.8	0	0	0	109.9	F61 T65 H66 A67	F61-N63 VanDerWaalsContact C-N 3.28Å; F61-N63 PolarHBondContact O-N 2.79Å; N63-T65 PolarHBondContact O-N 3.07Å; N63-T65 WeakPolarHBondContact OD1-CA 3.15Å; N63-T65 WeakPolarHBondContact OD1-CB 3.36Å; N63-T65 PolarHBondContact OD1-N 3.45Å; N63-H66 PolarHBondContact ND2-CE1 3.4Å; N63-H66 PolarHBondContact ND2-ND1 2.87Å; N63-H66 PolarHBondContact O-N 2.86Å; N63-H66 PolarHBondContact OD1-N 2.95Å; N63-A67 PolarHBondContact O-N 2.89Å
64	Q	88.8	Confident	89	Confident	99 Å²	99	42 Å²	42	46%	0.463	20%	0.199	S	C	.	.	H	α-helix	trans	-58.9	-34.4	-178.6	-65.6	178.8	9.6	0	0	113	A67 K68 I349	Q64-A67 PolarHBondContact O-N 2.94Å; Q64-K68 WeakPolarHBondContact O-CB 3.25Å; Q64-K68 PolarHBondContact O-N 2.74Å; Q64-I349 HydrophobicContact CG-CG1 3.84Å
65	T	84.3	Confident	88.6	Confident	91 Å²	91	42.7 Å²	42.7	56%	0.558	20%	0.203	S	C	*	.	H	α-helix	trans	-67.3	-43.7	179.2	-52.4	0	0	0	0	112	N63 R69	N63-T65 PolarHBondContact O-N 3.07Å; N63-T65 WeakPolarHBondContact OD1-CA 3.15Å; N63-T65 WeakPolarHBondContact OD1-CB 3.36Å; N63-T65 PolarHBondContact OD1-N 3.45Å; T65-R69 WeakPolarHBondContact O-CB 3.32Å; T65-R69 PolarHBondContact O-N 2.85Å
66	H	85.8	Confident	88.2	Confident	57 Å²	57	42 Å²	42	26%	0.264	20%	0.2	S	C	.	.	H	α-helix	trans	-65.3	-42.2	175	-67.1	147.9	0	0	0	111.3	P60 N63 R69 A70	P60-H66 CarbonylContact O-C 3.11Å; P60-H66 WeakPolarHBondContact O-CB 3.38Å; N63-H66 PolarHBondContact ND2-CE1 3.4Å; N63-H66 PolarHBondContact ND2-ND1 2.87Å; N63-H66 PolarHBondContact O-N 2.86Å; N63-H66 PolarHBondContact OD1-N 2.95Å; H66-R69 PolarHBondContact O-N 3.18Å; H66-A70 WeakPolarHBondContact O-CB 3.31Å; H66-A70 PolarHBondContact O-N 3.27Å
67	A	90.1	Very high	87.9	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66.9	-46.5	-177.3	0	0	0	0	0	111.1	P60 N63 Q64 R69 A70 Y71 W352 I356	P60-A67 WeakPolarHBondContact O-CA 3.33Å; P60-A67 PolarHBondContact O-N 3.38Å; N63-A67 PolarHBondContact O-N 2.89Å; Q64-A67 PolarHBondContact O-N 2.94Å; A67-R69 VanDerWaalsContact C-N 3.31Å; A67-R69 PolarHBondContact O-N 3.49Å; A67-A70 PolarHBondContact O-N 3.3Å; A67-Y71 WeakPolarHBondContact O-CB 3.37Å; A67-Y71 PolarHBondContact O-N 3.19Å; A67-W352 HydrophobicContact CB-CB 3.57Å; A67-W352 HydrophobicContact CB-CG 3.81Å; A67-I356 WeakPolarHBondContact O-CD1 3.49Å
68	K	87.2	Confident	87.6	Confident	43 Å²	43	42.9 Å²	42.9	19%	0.187	20%	0.204	C	C	.	.	H	α-helix	trans	-60.7	-38.1	174.6	-172.3	165.7	-173.1	159.2	0	112.5	Q64 R72 E343 R345 W352	Q64-K68 WeakPolarHBondContact O-CB 3.25Å; Q64-K68 PolarHBondContact O-N 2.74Å; K68-R72 VanDerWaalsContact O-CB 3.24Å; K68-R72 WeakPolarHBondContact O-CB 3.24Å; K68-R72 PolarHBondContact O-N 3.08Å; K68-R72 VanDerWaalsContact O-N 3.08Å; K68-E343 VanDerWaalsContact CE-O 3.28Å; K68-E343 WeakPolarHBondContact CE-O 3.4Å; K68-E343 PolarHBondContact NZ-O 3.05Å; K68-R345 PolarHBondContact NZ-O 3.15Å; K68-W352 HydrophobicContact CB-CH2 4.44Å; K68-W352 HydrophobicContact CB-CZ2 3.88Å; K68-W352 HydrophobicContact CD-CH2 4.39Å; K68-W352 HydrophobicContact CD-CZ2 3.79Å; K68-W352 HydrophobicContact CG-CH2 3.99Å; K68-W352 HydrophobicContact CG-CZ2 3.68Å
69	R	84.9	Confident	87.6	Confident	64 Å²	64	42.5 Å²	42.5	24%	0.242	20%	0.201	C	C	.	.	H	α-helix	trans	-64.9	-48.1	174.9	176.5	176	-63.7	157.4	4.5	111.5	T65 H66 A67 R72 E73 G171 L172	T65-R69 WeakPolarHBondContact O-CB 3.32Å; T65-R69 PolarHBondContact O-N 2.85Å; H66-R69 PolarHBondContact O-N 3.18Å; A67-R69 VanDerWaalsContact C-N 3.31Å; A67-R69 PolarHBondContact O-N 3.49Å; R69-R72 PolarHBondContact O-N 3.48Å; R69-E73 WeakPolarHBondContact O-CB 3.49Å; R69-E73 PolarHBondContact O-N 2.85Å; R69-G171 WeakPolarHBondContact CG-O 3.41Å; R69-G171 PolarHBondContact NE-O 3.19Å; R69-L172 VanDerWaalsContact NH2-CD2 3.26Å
70	A	88.6	Confident	87.5	Confident	7 Å²	7	33.8 Å²	33.8	6%	0.058	17%	0.168	C	C	.	.	H	α-helix	trans	-62.6	-45.3	-179.5	0	0	0	0	0	111.8	L57 P60 H66 A67 R72 E73 L74 I356	L57-A70 HydrophobicContact CD1-CB 3.85Å; P60-A70 HydrophobicContact CB-CB 3.65Å; H66-A70 WeakPolarHBondContact O-CB 3.31Å; H66-A70 PolarHBondContact O-N 3.27Å; A67-A70 PolarHBondContact O-N 3.3Å; A70-R72 VanDerWaalsContact C-N 3.35Å; A70-R72 PolarHBondContact O-N 3.07Å; A70-E73 PolarHBondContact O-N 3.08Å; A70-L74 WeakPolarHBondContact O-CB 3.46Å; A70-L74 PolarHBondContact O-N 2.92Å; A70-I356 HydrophobicContact CB-CD1 3.99Å
71	Y	89.8	Confident	87.4	Confident	16 Å²	16	38 Å²	38	6%	0.063	19%	0.191	C	C	.	.	H	α-helix	trans	-59.7	-46.7	176.1	-179.6	-100.8	0	0	0	111.5	A67 L74 V75 L342 W352 L355 I356 E359	A67-Y71 WeakPolarHBondContact O-CB 3.37Å; A67-Y71 PolarHBondContact O-N 3.19Å; Y71-L74 PolarHBondContact O-N 3.23Å; Y71-V75 HydrophobicContact CD1-CG2 4.12Å; Y71-V75 HydrophobicContact CD2-CG2 4.37Å; Y71-V75 HydrophobicContact CE1-CG2 3.63Å; Y71-V75 HydrophobicContact CE2-CG2 3.9Å; Y71-V75 HydrophobicContact CG-CG2 4.47Å; Y71-V75 WeakPolarHBondContact O-CG2 3.41Å; Y71-V75 PolarHBondContact O-N 3.27Å; Y71-L342 HydrophobicContact CE1-CD2 4.03Å; Y71-W352 HydrophobicContact CD1-CE3 4.14Å; Y71-W352 HydrophobicContact CD1-CH2 4.4Å; Y71-W352 AromaticContact CD1-CZ3 3.47Å; Y71-W352 HydrophobicContact CD1-CZ3 3.47Å; Y71-W352 VanDerWaalsContact CD1-CZ3 3.47Å; Y71-W352 HydrophobicContact CE1-CZ3 4.06Å; Y71-W352 AromaticContact CG-CE3 3.94Å; Y71-W352 HydrophobicContact CG-CE3 3.94Å; Y71-W352 AromaticContact CG-CZ3 3.77Å; Y71-W352 HydrophobicContact CG-CZ3 3.77Å; Y71-L355 HydrophobicContact CD2-CB 3.94Å; Y71-L355 HydrophobicContact CE2-CB 3.74Å; Y71-I356 HydrophobicContact CD2-CG1 3.74Å; Y71-I356 HydrophobicContact CG-CG1 4.17Å; Y71-E359 HydrophobicContact CD2-CG 4.39Å; Y71-E359 HydrophobicContact CE2-CG 3.64Å
72	R	86.3	Confident	87.4	Confident	4 Å²	4	37 Å²	37	2%	0.015	19%	0.186	C	C	.	.	H	α-helix	trans	-61.2	-47.4	178	177.9	-179.3	-51.7	-144.1	-11.6	112.8	K68 R69 A70 L74 V75 L76 A173 R174 E343	K68-R72 VanDerWaalsContact O-CB 3.24Å; K68-R72 WeakPolarHBondContact O-CB 3.24Å; K68-R72 PolarHBondContact O-N 3.08Å; K68-R72 VanDerWaalsContact O-N 3.08Å; R69-R72 PolarHBondContact O-N 3.48Å; A70-R72 VanDerWaalsContact C-N 3.35Å; A70-R72 PolarHBondContact O-N 3.07Å; R72-L74 VanDerWaalsContact C-N 3.26Å; R72-L74 PolarHBondContact O-N 3.05Å; R72-V75 PolarHBondContact O-N 2.96Å; R72-L76 HydrophobicContact CG-CD1 3.68Å; R72-L76 HydrophobicContact CG-CG 4.14Å; R72-L76 VanDerWaalsContact O-CB 3.32Å; R72-L76 WeakPolarHBondContact O-CB 3.48Å; R72-L76 VanDerWaalsContact O-CG 3.24Å; R72-L76 WeakPolarHBondContact O-CG 3.29Å; R72-L76 PolarHBondContact O-N 3.25Å; R72-A173 WeakPolarHBondContact CD-O 3.48Å; R72-A173 PolarHBondContact NH1-O 2.9Å; R72-R174 VanDerWaalsContact NH1-CZ 3.3Å; R72-E343 IonicContact CZ-OE1 3.96Å; R72-E343 IonicContact NH1-OE1 3.51Å; R72-E343 PolarHBondContact NH1-OE1 3.36Å; R72-E343 IonicContact NH2-OE1 3.07Å; R72-E343 PolarHBondContact NH2-OE1 3.27Å
73	E	86.7	Confident	87.6	Confident	6 Å²	6	36.4 Å²	36.4	3%	0.028	18%	0.182	C	C	.	.	H	α-helix	trans	-56.9	-45.1	177.8	-175.5	174.4	179.3	0	0	110.4	K55 R69 A70 L77 L106	K55-E73 IonicContact NZ-OE1 3.98Å; K55-E73 PolarHBondContact NZ-OE1 2.94Å; K55-E73 IonicContact NZ-OE2 2.67Å; K55-E73 PolarHBondContact NZ-OE2 3.03Å; R69-E73 WeakPolarHBondContact O-CB 3.49Å; R69-E73 PolarHBondContact O-N 2.85Å; A70-E73 PolarHBondContact O-N 3.08Å; E73-L77 HydrophobicContact CG-CD1 3.86Å; E73-L77 HydrophobicContact CG-CG 4.48Å; E73-L77 VanDerWaalsContact O-CB 3.25Å; E73-L77 WeakPolarHBondContact O-CB 3.5Å; E73-L77 WeakPolarHBondContact O-CG 3.27Å; E73-L77 PolarHBondContact O-N 2.99Å; E73-L106 HydrophobicContact CG-CD1 4.33Å
74	L	89.2	Confident	88	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.01	17%	0.17	C	C	.	.	H	α-helix	trans	-61.8	-50.5	177	179.6	57.6	0	0	0	112.7	A70 Y71 R72 L76 L77 K78 L88 V91 L106 I356 E359 V360	A70-L74 WeakPolarHBondContact O-CB 3.46Å; A70-L74 PolarHBondContact O-N 2.92Å; Y71-L74 PolarHBondContact O-N 3.23Å; R72-L74 VanDerWaalsContact C-N 3.26Å; R72-L74 PolarHBondContact O-N 3.05Å; L74-L76 PolarHBondContact O-N 2.96Å; L74-L77 PolarHBondContact O-N 3.03Å; L74-K78 HydrophobicContact CD1-CD 4.13Å; L74-K78 HydrophobicContact CD1-CG 4.37Å; L74-K78 HydrophobicContact CG-CD 4.29Å; L74-K78 WeakPolarHBondContact O-CG 2.98Å; L74-K78 PolarHBondContact O-N 2.96Å; L74-L88 HydrophobicContact CD1-CD2 4.16Å; L74-V91 HydrophobicContact CD1-CB 4.21Å; L74-V91 HydrophobicContact CD1-CG1 4.11Å; L74-V91 HydrophobicContact CD1-CG2 3.93Å; L74-L106 HydrophobicContact CD1-CD2 3.98Å; L74-I356 HydrophobicContact CD2-CG2 4.31Å; L74-E359 HydrophobicContact CD2-CB 3.54Å; L74-E359 HydrophobicContact CD2-CG 4.49Å; L74-E359 HydrophobicContact CG-CB 4.3Å; L74-V360 HydrophobicContact CD2-CG2 3.98Å
75	V	86.9	Confident	88.3	Confident	14 Å²	14	29.5 Å²	29.5	9%	0.085	15%	0.148	C	C	.	.	H	α-helix	trans	-61.8	-45.1	-179.7	171.4	0	0	0	0	111.1	Y71 R72 K78 C79 Y338	Y71-V75 HydrophobicContact CD1-CG2 4.12Å; Y71-V75 HydrophobicContact CD2-CG2 4.37Å; Y71-V75 HydrophobicContact CE1-CG2 3.63Å; Y71-V75 HydrophobicContact CE2-CG2 3.9Å; Y71-V75 HydrophobicContact CG-CG2 4.47Å; Y71-V75 WeakPolarHBondContact O-CG2 3.41Å; Y71-V75 PolarHBondContact O-N 3.27Å; R72-V75 PolarHBondContact O-N 2.96Å; V75-K78 PolarHBondContact O-N 3.4Å; V75-C79 PolarHBondContact O-N 3.18Å; V75-C79 PolarHBondContact O-SG 3.3Å; V75-Y338 HydrophobicContact CG1-CD2 4.25Å; V75-Y338 HydrophobicContact CG1-CE2 3.97Å
76	L	85.6	Confident	88.7	Confident	3 Å²	3	25.4 Å²	25.4	2%	0.016	12%	0.123	C	C	.	.	H	α-helix	trans	-64.6	-43.4	179.9	-69.6	-177.4	0	0	0	111.8	R72 L74 K78 C79 V80 I147 F170 A173 Y338	R72-L76 HydrophobicContact CG-CD1 3.68Å; R72-L76 HydrophobicContact CG-CG 4.14Å; R72-L76 VanDerWaalsContact O-CB 3.32Å; R72-L76 WeakPolarHBondContact O-CB 3.48Å; R72-L76 VanDerWaalsContact O-CG 3.24Å; R72-L76 WeakPolarHBondContact O-CG 3.29Å; R72-L76 PolarHBondContact O-N 3.25Å; L74-L76 PolarHBondContact O-N 2.96Å; L76-K78 PolarHBondContact O-N 3.08Å; L76-C79 PolarHBondContact O-N 2.84Å; L76-V80 WeakPolarHBondContact O-CB 3.44Å; L76-V80 WeakPolarHBondContact O-CG2 3.48Å; L76-V80 PolarHBondContact O-N 3.12Å; L76-I147 HydrophobicContact CD1-CG2 4.35Å; L76-I147 HydrophobicContact CD2-CD1 3.39Å; L76-I147 HydrophobicContact CD2-CG1 4.01Å; L76-F170 HydrophobicContact CB-CB 4.09Å; L76-F170 HydrophobicContact CB-CD2 4.25Å; L76-F170 HydrophobicContact CB-CG 4.32Å; L76-F170 HydrophobicContact CD1-CB 3.49Å; L76-F170 VanDerWaalsContact CD1-CB 3.49Å; L76-F170 HydrophobicContact CD1-CG 4.26Å; L76-F170 HydrophobicContact CG-CB 4.43Å; L76-A173 HydrophobicContact CD1-CB 4.16Å; L76-Y338 HydrophobicContact CD2-CD2 3.3Å; L76-Y338 HydrophobicContact CD2-CE2 3.56Å; L76-Y338 HydrophobicContact CD2-CG 3.83Å; L76-Y338 HydrophobicContact CG-CD2 4.3Å; L76-Y338 HydrophobicContact CG-CE2 4.08Å
77	L	88.4	Confident	89	Confident	8 Å²	8	24.1 Å²	24.1	4%	0.042	12%	0.12	C	C	.	.	H	α-helix	trans	-63.9	-27.6	175.9	-77.5	174.1	0	0	0	113.4	E73 L74 I86 L88 L106 F170	E73-L77 HydrophobicContact CG-CD1 3.86Å; E73-L77 HydrophobicContact CG-CG 4.48Å; E73-L77 VanDerWaalsContact O-CB 3.25Å; E73-L77 WeakPolarHBondContact O-CB 3.5Å; E73-L77 WeakPolarHBondContact O-CG 3.27Å; E73-L77 PolarHBondContact O-N 2.99Å; L74-L77 PolarHBondContact O-N 3.03Å; L77-I86 HydrophobicContact CD2-CG2 3.7Å; L77-L88 HydrophobicContact CB-CB 4.14Å; L77-L88 HydrophobicContact CB-CD2 4.39Å; L77-L88 HydrophobicContact CD1-CD1 4.45Å; L77-L106 HydrophobicContact CD1-CD1 3.94Å; L77-F170 HydrophobicContact CD2-CD2 4.17Å; L77-F170 HydrophobicContact CD2-CE2 3.99Å; L77-F170 HydrophobicContact CG-CD2 4.4Å
78	K	85.8	Confident	89.1	Confident	43 Å²	43	24.9 Å²	24.9	19%	0.187	12%	0.124	C	C	.	.	H	α-helix	trans	-77.1	-36.7	174.5	-73.8	177.3	63.7	168	0	112.7	L74 V75 L76 L88 E359 W363	L74-K78 HydrophobicContact CD1-CD 4.13Å; L74-K78 HydrophobicContact CD1-CG 4.37Å; L74-K78 HydrophobicContact CG-CD 4.29Å; L74-K78 WeakPolarHBondContact O-CG 2.98Å; L74-K78 PolarHBondContact O-N 2.96Å; V75-K78 PolarHBondContact O-N 3.4Å; L76-K78 PolarHBondContact O-N 3.08Å; K78-L88 HydrophobicContact CG-CD2 3.82Å; K78-E359 PolarHBondContact NZ-O 3.11Å; K78-E359 IonicContact NZ-OE2 3.44Å; K78-E359 PolarHBondContact NZ-OE2 3.49Å; K78-W363 HydrophobicContact CB-CZ3 4.42Å; K78-W363 HydrophobicContact CD-CE3 4Å; K78-W363 HydrophobicContact CD-CZ3 4.41Å; K78-W363 HydrophobicContact CG-CE3 3.85Å; K78-W363 HydrophobicContact CG-CZ3 3.77Å
79	C	82.5	Confident	89.4	Confident	46 Å²	46	25 Å²	25	31%	0.311	13%	0.127	S	C	.	.	H	α-helix	trans	-86.2	-35.1	-173.7	-66.1	0	0	0	0	112.8	V75 L76 P335	V75-C79 PolarHBondContact O-N 3.18Å; V75-C79 PolarHBondContact O-SG 3.3Å; L76-C79 PolarHBondContact O-N 2.84Å; C79-P335 HydrophobicContact CB-CB 4.45Å; C79-P335 WeakPolarHBondContact O-CB 3.33Å
80	V	85.2	Confident	89.9	Confident	6 Å²	6	22.5 Å²	22.5	4%	0.036	12%	0.118	C	C	.	.			trans	-82.9	123.6	-171.5	-178.4	0	0	0	0	111.2	L76 I85 L142 I147 P335	L76-V80 WeakPolarHBondContact O-CB 3.44Å; L76-V80 WeakPolarHBondContact O-CG2 3.48Å; L76-V80 PolarHBondContact O-N 3.12Å; V80-I85 HydrophobicContact CB-CG2 4.35Å; 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 3.54Å; V80-L142 HydrophobicContact CG1-CD2 4.34Å; V80-L142 HydrophobicContact CG2-CD2 4.3Å; V80-I147 HydrophobicContact CG2-CD1 4.1Å; V80-P335 HydrophobicContact CG2-CG 4.16Å
81	N	87.3	Confident	90.2	Very high	94 Å²	94	22.2 Å²	22.2	50%	0.503	12%	0.116	S	C	.	.			trans	-131.8	95.4	177.8	-177.3	29.2	0	0	0	110.6	H141	N81-H141 PolarHBondContact O-CE1 3.19Å; N81-H141 PolarHBondContact O-NE2 3.38Å
82	H	93	Very high	90.5	Very high	10 Å²	10	21.4 Å²	21.4	5%	0.046	11%	0.113	C	C	.	.			trans	-149.1	143.1	177.5	-174.1	-101.8	0	0	0	110.3	N84 I85 H141 E329	H82-N84 PolarHBondContact CE1-OD1 3.22Å; H82-N84 PolarHBondContact ND1-N 3.31Å; H82-N84 PolarHBondContact O-N 2.94Å; H82-I85 HydrophobicContact CB-CB 4.21Å; H82-I85 HydrophobicContact CB-CD1 3.95Å; H82-I85 HydrophobicContact CB-CG1 4.2Å; H82-I85 PolarHBondContact O-N 2.68Å; H82-H141 HydrophobicContact CB-CB 4.24Å; H82-H141 AromaticContact CD2-CG 3.86Å; H82-H141 AromaticContact CD2-ND1 3.73Å; H82-H141 AromaticContact CG-CG 3.78Å; H82-E329 PolarHBondContact NE2-O 2.94Å; H82-E329 VanDerWaalsContact NE2-O 3.16Å
83	K	94.7	Very high	90.9	Very high	101 Å²	101	21.4 Å²	21.4	44%	0.439	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-25.3	-176.2	64.2	177.3	175	-174.6	0	114.5	I85 K166 E329	K83-I85 VanDerWaalsContact C-N 3.34Å; K83-K166 WeakPolarHBondContact O-CE 3.39Å; K83-K166 VanDerWaalsContact O-CG 3.22Å; K83-K166 WeakPolarHBondContact O-CG 3.44Å; K83-K166 PolarHBondContact O-NZ 2.93Å; K83-E329 WeakPolarHBondContact CE-OE1 3.3Å; K83-E329 WeakPolarHBondContact CE-OE2 3.31Å; K83-E329 IonicContact NZ-OE1 3.94Å; K83-E329 PolarHBondContact NZ-OE1 2.95Å; K83-E329 IonicContact NZ-OE2 3.87Å; K83-E329 PolarHBondContact NZ-OE2 3.2Å
84	N	96.7	Very high	91.3	Very high	4 Å²	4	22.2 Å²	22.2	2%	0.021	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	14.7	174.6	-53	116.1	0	0	0	114.1	H82 Q134 L165 K166 I167	H82-N84 PolarHBondContact CE1-OD1 3.22Å; H82-N84 PolarHBondContact ND1-N 3.31Å; H82-N84 PolarHBondContact O-N 2.94Å; N84-Q134 VanDerWaalsContact CB-O 3.25Å; N84-Q134 WeakPolarHBondContact CB-O 3.45Å; N84-Q134 WeakPolarHBondContact ND2-CB 3.27Å; N84-Q134 WeakPolarHBondContact ND2-CG 3.43Å; N84-Q134 PolarHBondContact ND2-OE1 2.8Å; N84-L165 VanDerWaalsContact CA-O 3.3Å; N84-L165 WeakPolarHBondContact CA-O 3.29Å; N84-L165 PolarHBondContact ND2-O 2.85Å; N84-K166 WeakPolarHBondContact O-CA 3.47Å; N84-I167 PolarHBondContact O-N 2.79Å
85	I	94.3	Very high	91.6	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.126	C	C	.	.	B	Isolated β-bridge	trans	-123.3	141.9	172.3	-66.4	171.7	0	0	0	107.6	V80 H82 K83 S87 H141 L142 K166 F170	V80-I85 HydrophobicContact CB-CG2 4.35Å; 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 3.54Å; H82-I85 HydrophobicContact CB-CB 4.21Å; H82-I85 HydrophobicContact CB-CD1 3.95Å; H82-I85 HydrophobicContact CB-CG1 4.2Å; H82-I85 PolarHBondContact O-N 2.68Å; K83-I85 VanDerWaalsContact C-N 3.34Å; I85-S87 PolarHBondContact O-N 3.29Å; I85-H141 HydrophobicContact CD1-CB 4.26Å; I85-L142 HydrophobicContact CD1-CD1 4.39Å; I85-L142 HydrophobicContact CD1-CD2 3.71Å; I85-L142 HydrophobicContact CD1-CG 3.69Å; I85-K166 PolarHBondContact O-NZ 2.99Å; I85-F170 HydrophobicContact CG2-CE2 3.81Å; I85-F170 HydrophobicContact CG2-CZ 3.43Å; I85-F170 VanDerWaalsContact CG2-CZ 3.43Å
86	I	93.7	Very high	91.6	Very high	5 Å²	5	27.4 Å²	27.4	3%	0.026	14%	0.141	C	C	.	.	P	Polyproline II helix	trans	-64.8	130.7	177.8	-164.6	74.4	0	0	0	110.9	L77 M108 E109 M111 K166 I167 L168 F170	L77-I86 HydrophobicContact CD2-CG2 3.7Å; I86-M108 HydrophobicContact CD1-CB 4.26Å; I86-M108 HydrophobicContact CG1-CB 3.86Å; I86-M108 HydrophobicContact CG1-CG 4.06Å; I86-M108 HydrophobicContact CG1-SD 3.87Å; I86-M108 HydrophobicContact CG2-SD 4.31Å; I86-E109 HydrophobicContact CD1-CG 3.39Å; I86-E109 HydrophobicContact CG1-CG 4.45Å; I86-M111 HydrophobicContact CD1-CG 4.42Å; I86-K166 HydrophobicContact CD1-CD 4.33Å; I86-I167 WeakPolarHBondContact CG2-O 3.4Å; I86-I167 PolarHBondContact N-O 3.32Å; I86-L168 HydrophobicContact CB-CD2 3.65Å; I86-L168 HydrophobicContact CD1-CD2 3.89Å; I86-L168 HydrophobicContact CG1-CD2 3.7Å; I86-L168 HydrophobicContact CG2-CD2 3.79Å; I86-F170 HydrophobicContact CG2-CE2 4.48Å
87	S	91.5	Very high	92	Very high	30 Å²	30	29.8 Å²	29.8	21%	0.21	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-95.8	139.7	-179.9	-55.1	0	0	0	0	111.6	I85 L89 E109	I85-S87 PolarHBondContact O-N 3.29Å; S87-L89 PolarHBondContact O-N 2.86Å; S87-E109 PolarHBondContact N-OE1 3.29Å
88	L	92.7	Very high	92.3	Very high	16 Å²	16	31.4 Å²	31.4	8%	0.084	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	117.6	170.3	-169.1	67.9	0	0	0	109.9	L74 L77 K78 N90 V91 L106 W363	L74-L88 HydrophobicContact CD1-CD2 4.16Å; L77-L88 HydrophobicContact CB-CB 4.14Å; L77-L88 HydrophobicContact CB-CD2 4.39Å; L77-L88 HydrophobicContact CD1-CD1 4.45Å; K78-L88 HydrophobicContact CG-CD2 3.82Å; L88-N90 WeakPolarHBondContact CD1-O 3.3Å; L88-V91 HydrophobicContact CD2-CB 4.3Å; L88-V91 HydrophobicContact CD2-CG1 4.21Å; L88-L106 HydrophobicContact CD1-CB 4.11Å; L88-L106 HydrophobicContact CD1-CD2 4.16Å; L88-W363 HydrophobicContact CB-CH2 4.48Å; L88-W363 HydrophobicContact CD2-CE3 4.44Å; L88-W363 HydrophobicContact CD2-CH2 4.13Å; L88-W363 HydrophobicContact CD2-CZ2 4.32Å; L88-W363 HydrophobicContact CD2-CZ3 4.21Å; L88-W363 HydrophobicContact CG-CH2 4.38Å; L88-W363 HydrophobicContact CG-CZ2 4.34Å
89	L	93.3	Very high	92.6	Very high	45 Å²	45	36.2 Å²	36.2	24%	0.236	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	-36.6	175.5	-60.1	-178.7	0	0	0	111.8	I50 V52 S87 V107 E109	I50-L89 HydrophobicContact CD1-CD1 4.32Å; V52-L89 HydrophobicContact CG1-CD1 3.74Å; S87-L89 PolarHBondContact O-N 2.86Å; L89-V107 HydrophobicContact CB-CG1 4.39Å; L89-V107 PolarHBondContact N-O 3.05Å; L89-E109 HydrophobicContact CD1-CB 4.45Å
90	N	94.9	Very high	93.2	Very high	13 Å²	13	39.3 Å²	39.3	7%	0.07	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	156.7	176.8	-162.2	17.3	0	0	0	111.2	Y26 L88 V107 W363	Y26-N90 VanDerWaalsContact OH-CB 3.29Å; Y26-N90 WeakPolarHBondContact OH-CB 3.4Å; Y26-N90 PolarHBondContact OH-ND2 3.26Å; L88-N90 WeakPolarHBondContact CD1-O 3.3Å; N90-V107 HydrophobicContact CB-CB 3.85Å; N90-V107 HydrophobicContact CB-CG2 4Å; N90-V107 PolarHBondContact N-O 3.46Å; N90-V107 WeakPolarHBondContact O-CB 3.29Å; N90-V107 PolarHBondContact O-N 3.02Å; N90-W363 PolarHBondContact OD1-NE1 3.17Å
91	V	95.4	Very high	93.6	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	140	166	54.9	0	0	0	0	108.6	L74 L88 V104 Y105 L106 V360 W363	L74-V91 HydrophobicContact CD1-CB 4.21Å; L74-V91 HydrophobicContact CD1-CG1 4.11Å; L74-V91 HydrophobicContact CD1-CG2 3.93Å; L88-V91 HydrophobicContact CD2-CB 4.3Å; L88-V91 HydrophobicContact CD2-CG1 4.21Å; V91-V104 HydrophobicContact CG2-CG1 4.1Å; V91-Y105 VanDerWaalsContact CA-O 3.29Å; V91-Y105 WeakPolarHBondContact CA-O 3.48Å; V91-Y105 WeakPolarHBondContact CG2-O 3.29Å; V91-L106 HydrophobicContact CB-CD2 4.17Å; V91-L106 HydrophobicContact CG2-CD2 3.74Å; V91-V360 HydrophobicContact CG2-CB 4.46Å; V91-V360 HydrophobicContact CG2-CG1 4.2Å; V91-V360 HydrophobicContact CG2-CG2 3.83Å; V91-W363 HydrophobicContact CG1-CB 3.49Å; V91-W363 VanDerWaalsContact CG1-CB 3.49Å; V91-W363 VanDerWaalsContact CG1-CD1 3.42Å; V91-W363 HydrophobicContact CG1-CD2 3.83Å; V91-W363 HydrophobicContact CG1-CG 3.27Å
92	F	95.7	Very high	93.9	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	165.3	-179.9	65.5	-92.8	0	0	0	112.3	F10 V22 L23 Y26 Y105 V107 E364	F10-F92 AromaticContact CE1-CD2 3.69Å; F10-F92 HydrophobicContact CE1-CD2 3.69Å; F10-F92 HydrophobicContact CE1-CE2 4.02Å; F10-F92 HydrophobicContact CZ-CD2 4.47Å; 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 3.98Å; L23-F92 HydrophobicContact CD1-CB 4.27Å; L23-F92 HydrophobicContact CD1-CD1 3.96Å; L23-F92 HydrophobicContact CD1-CE1 4.45Å; L23-F92 HydrophobicContact CD1-CG 4.01Å; L23-F92 HydrophobicContact CG-CD1 4.41Å; L23-F92 HydrophobicContact CG-CD2 4.29Å; L23-F92 HydrophobicContact CG-CE2 4.5Å; L23-F92 HydrophobicContact CG-CG 4.23Å; Y26-F92 AromaticContact CD2-CE1 3.91Å; Y26-F92 HydrophobicContact CD2-CE1 3.91Å; Y26-F92 HydrophobicContact CD2-CZ 4.21Å; 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 HydrophobicContact CD2-CD2 4.01Å; F92-Y105 HydrophobicContact CD2-CG 4.2Å; F92-Y105 HydrophobicContact CE1-CG 4.39Å; F92-Y105 HydrophobicContact CE2-CD1 4.27Å; F92-Y105 AromaticContact CE2-CD2 3.53Å; F92-Y105 HydrophobicContact CE2-CD2 3.53Å; F92-Y105 HydrophobicContact CE2-CE2 4.32Å; F92-Y105 AromaticContact CE2-CG 3.5Å; F92-Y105 HydrophobicContact CE2-CG 3.5Å; F92-Y105 VanDerWaalsContact CE2-CG 3.5Å; F92-Y105 HydrophobicContact CZ-CD1 4.12Å; F92-Y105 HydrophobicContact CZ-CD2 4.16Å; F92-Y105 AromaticContact CZ-CG 3.62Å; F92-Y105 HydrophobicContact CZ-CG 3.62Å; F92-Y105 PolarHBondContact N-O 2.61Å; F92-Y105 VanDerWaalsContact N-O 3.08Å; F92-Y105 PolarHBondContact O-N 2.62Å; F92-V107 HydrophobicContact CD1-CG2 4.13Å; F92-V107 HydrophobicContact CE1-CG2 3.65Å; F92-E364 WeakPolarHBondContact CA-OE1 3.15Å; F92-E364 WeakPolarHBondContact CB-OE1 3.28Å
93	T	96.2	Very high	93.9	Very high	4 Å²	4	41.5 Å²	41.5	3%	0.025	21%	0.205	C	C	.	.			trans	-132.3	141.7	167.4	-179.9	0	0	0	0	109.9	F10 Q95 F101 D103 Y357 V360 M361	F10-T93 WeakPolarHBondContact CZ-O 3.39Å; T93-Q95 PolarHBondContact O-N 2.66Å; T93-Q95 PolarHBondContact OG1-N 3.22Å; T93-Q95 PolarHBondContact OG1-OE1 3.34Å; T93-F101 HydrophobicContact CG2-CD2 4Å; T93-F101 HydrophobicContact CG2-CE2 3.97Å; T93-F101 WeakPolarHBondContact OG1-CD2 3.45Å; T93-D103 WeakPolarHBondContact CB-O 3.24Å; T93-D103 PolarHBondContact OG1-O 3.33Å; T93-Y357 HydrophobicContact CG2-CE2 4.39Å; T93-V360 HydrophobicContact CG2-CG1 4.03Å; T93-M361 HydrophobicContact CG2-CE 3.42Å; T93-M361 VanDerWaalsContact CG2-CE 3.42Å
94	P	94.6	Very high	94	Very high	22 Å²	22	36.8 Å²	36.8	14%	0.143	18%	0.184	C	C	.	.	S	Bend	trans	-75.8	-13.6	175.1	31.2	-35.1	0	0	0	113	F10 T21 D103 Y105	F10-P94 HydrophobicContact CD1-CB 3.89Å; F10-P94 HydrophobicContact CE1-CB 4.05Å; F10-P94 HydrophobicContact CG-CB 4.28Å; T21-P94 HydrophobicContact CG2-CB 3.59Å; T21-P94 HydrophobicContact CG2-CG 4.17Å; P94-D103 HydrophobicContact CG-CB 4.42Å; P94-Y105 HydrophobicContact CG-CE2 4.06Å
95	Q	94.3	Very high	93.9	Very high	35 Å²	35	36.6 Å²	36.6	16%	0.164	18%	0.183	C	C	.	.			trans	-88.1	140.1	-176.8	-65.9	99.4	17.6	0	0	112.3	T93 E100 D103	T93-Q95 PolarHBondContact O-N 2.66Å; T93-Q95 PolarHBondContact OG1-N 3.22Å; T93-Q95 PolarHBondContact OG1-OE1 3.34Å; Q95-E100 HydrophobicContact CB-CB 4.06Å; Q95-E100 HydrophobicContact CG-CB 4.23Å; Q95-E100 WeakPolarHBondContact CG-O 3.45Å; Q95-D103 PolarHBondContact NE2-OD2 3.19Å
96	K	88.4	Confident	93.9	Very high	91 Å²	91	36.6 Å²	36.6	40%	0.396	18%	0.183	S	C	.	.	S	Bend	trans	-91.7	-25.2	-169.5	-57	-179.1	-161	178.3	0	113.6	S6 D7 Y357	S6-K96 WeakPolarHBondContact OG-CD 3.22Å; S6-K96 WeakPolarHBondContact OG-CE 3.39Å; S6-K96 PolarHBondContact OG-NZ 2.69Å; D7-K96 IonicContact OD1-NZ 2.96Å; D7-K96 PolarHBondContact OD1-NZ 2.91Å; K96-Y357 PolarHBondContact O-OH 3.36Å
97	T	93.7	Very high	94	Very high	52 Å²	52	36.4 Å²	36.4	32%	0.319	18%	0.182	S	C	.	.	S	Bend	trans	-122.8	158.6	-178.1	84.7	0	0	0	0	111.1	E99 E100 F101	T97-E99 WeakPolarHBondContact CB-OE2 3.37Å; T97-E99 PolarHBondContact O-N 3.4Å; T97-E99 PolarHBondContact OG1-N 2.92Å; T97-E99 PolarHBondContact OG1-OE2 2.89Å; T97-E100 PolarHBondContact O-N 3.35Å; T97-E100 PolarHBondContact OG1-N 3.39Å; T97-F101 PolarHBondContact O-N 3.34Å
98	L	93.9	Very high	94.2	Very high	42 Å²	42	35.7 Å²	35.7	22%	0.22	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-34.7	176.9	175.9	65.7	0	0	0	111.8	E100 F101 K353 E354 Y357	L98-E100 VanDerWaalsContact C-N 3.35Å; L98-E100 PolarHBondContact O-N 3.29Å; L98-F101 WeakPolarHBondContact O-CB 3.33Å; L98-F101 PolarHBondContact O-N 3.04Å; L98-K353 HydrophobicContact CD1-CD 4.49Å; L98-K353 HydrophobicContact CD1-CG 4.12Å; L98-K353 WeakPolarHBondContact O-CE 3.34Å; L98-K353 PolarHBondContact O-NZ 3.1Å; L98-E354 HydrophobicContact CD1-CG 4.05Å; L98-E354 HydrophobicContact CD2-CG 3.48Å; L98-E354 VanDerWaalsContact CD2-CG 3.48Å; L98-E354 HydrophobicContact CG-CG 4.37Å; L98-Y357 HydrophobicContact CB-CD1 4.23Å; L98-Y357 HydrophobicContact CB-CE1 4.28Å; L98-Y357 HydrophobicContact CD1-CD1 4.07Å; L98-Y357 HydrophobicContact CD1-CG 3.92Å
99	E	93.3	Very high	94.2	Very high	144 Å²	144	36.5 Å²	36.5	67%	0.673	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-43.6	180	-59.3	73.3	-157.3	0	0	110.7	T97 K353	T97-E99 WeakPolarHBondContact CB-OE2 3.37Å; T97-E99 PolarHBondContact O-N 3.4Å; T97-E99 PolarHBondContact OG1-N 2.92Å; T97-E99 PolarHBondContact OG1-OE2 2.89Å; E99-K353 PolarHBondContact O-NZ 3.48Å; E99-K353 VanDerWaalsContact O-NZ 3.16Å
100	E	93.4	Very high	94.3	Very high	112 Å²	112	36.1 Å²	36.1	52%	0.523	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-20.5	179.8	-65.9	179.9	167.9	0	0	113.7	Q95 T97 L98 Q102	Q95-E100 HydrophobicContact CB-CB 4.06Å; Q95-E100 HydrophobicContact CG-CB 4.23Å; Q95-E100 WeakPolarHBondContact CG-O 3.45Å; T97-E100 PolarHBondContact O-N 3.35Å; T97-E100 PolarHBondContact OG1-N 3.39Å; L98-E100 VanDerWaalsContact C-N 3.35Å; L98-E100 PolarHBondContact O-N 3.29Å; E100-Q102 WeakPolarHBondContact O-CG 3.49Å; E100-Q102 PolarHBondContact O-N 3.47Å
101	F	95	Very high	94.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.179	C	C	.	.			trans	-55.7	119.5	-173.1	177.7	-133.3	0	0	0	112.5	F61 T93 T97 L98 V104 K353 I356 Y357 V360	F61-F101 HydrophobicContact CE1-CE1 4.09Å; F61-F101 AromaticContact CE2-CD1 3.96Å; F61-F101 HydrophobicContact CE2-CD1 3.96Å; F61-F101 AromaticContact CE2-CE1 3.86Å; F61-F101 HydrophobicContact CE2-CE1 3.86Å; F61-F101 HydrophobicContact CE2-CG 4.44Å; F61-F101 HydrophobicContact CE2-CZ 4.24Å; F61-F101 AromaticContact CZ-CD1 3.75Å; F61-F101 HydrophobicContact CZ-CD1 3.75Å; F61-F101 AromaticContact CZ-CE1 3.23Å; F61-F101 HydrophobicContact CZ-CE1 3.23Å; F61-F101 AromaticContact CZ-CZ 3.69Å; F61-F101 HydrophobicContact CZ-CZ 3.69Å; T93-F101 HydrophobicContact CG2-CD2 4Å; T93-F101 HydrophobicContact CG2-CE2 3.97Å; T93-F101 WeakPolarHBondContact OG1-CD2 3.45Å; T97-F101 PolarHBondContact O-N 3.34Å; L98-F101 WeakPolarHBondContact O-CB 3.33Å; L98-F101 PolarHBondContact O-N 3.04Å; F101-V104 HydrophobicContact CE2-CG2 3.64Å; F101-V104 HydrophobicContact CZ-CG2 3.43Å; F101-V104 VanDerWaalsContact CZ-CG2 3.43Å; F101-K353 HydrophobicContact CD1-CG 3.77Å; F101-K353 HydrophobicContact CE1-CG 4.34Å; F101-K353 WeakPolarHBondContact O-CE 3.49Å; F101-K353 PolarHBondContact O-NZ 3.32Å; F101-I356 HydrophobicContact CE1-CB 4.26Å; F101-I356 HydrophobicContact CE1-CG2 4.03Å; F101-I356 HydrophobicContact CZ-CG2 3.82Å; F101-Y357 HydrophobicContact CB-CD2 3.89Å; F101-Y357 HydrophobicContact CB-CE2 4.25Å; F101-Y357 AromaticContact CD1-CD2 3.67Å; F101-Y357 HydrophobicContact CD1-CD2 3.67Å; F101-Y357 HydrophobicContact CD1-CG 4.06Å; F101-Y357 AromaticContact CD2-CD2 3.87Å; F101-Y357 HydrophobicContact CD2-CD2 3.87Å; F101-Y357 HydrophobicContact CD2-CE2 4.45Å; F101-Y357 HydrophobicContact CE1-CD2 4.05Å; F101-Y357 HydrophobicContact CE1-CG 4.33Å; F101-Y357 HydrophobicContact CE2-CD2 4.26Å; F101-Y357 AromaticContact CG-CD2 3.55Å; F101-Y357 HydrophobicContact CG-CD2 3.55Å; F101-Y357 HydrophobicContact CG-CE2 4.28Å; F101-Y357 HydrophobicContact CG-CG 4.37Å; F101-Y357 HydrophobicContact CZ-CD2 4.33Å; F101-V360 HydrophobicContact CZ-CG2 4.49Å
102	Q	93.1	Very high	94.1	Very high	125 Å²	125	41.4 Å²	41.4	58%	0.584	21%	0.205	S	C	*	.			trans	-141.5	-34.8	-179.6	-72.3	-172.8	13.3	0	0	112.9	E100	E100-Q102 WeakPolarHBondContact O-CG 3.49Å; E100-Q102 PolarHBondContact O-N 3.47Å
103	D	94	Very high	93.8	Very high	31 Å²	31	42.6 Å²	42.6	17%	0.166	22%	0.215	C	C	.	.			trans	-107	133.9	-174.7	-61	-61.6	0	0	0	111.1	K56 T93 P94 Q95 Y105	K56-D103 WeakPolarHBondContact CE-OD1 3.32Å; K56-D103 IonicContact NZ-OD1 3.81Å; K56-D103 PolarHBondContact NZ-OD1 2.93Å; K56-D103 IonicContact NZ-OD2 3.71Å; T93-D103 WeakPolarHBondContact CB-O 3.24Å; T93-D103 PolarHBondContact OG1-O 3.33Å; P94-D103 HydrophobicContact CG-CB 4.42Å; Q95-D103 PolarHBondContact NE2-OD2 3.19Å; D103-Y105 HydrophobicContact CB-CD2 4.39Å; D103-Y105 HydrophobicContact CB-CE2 3.7Å
104	V	95.1	Very high	93.6	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.006	23%	0.226	C	C	.	.			trans	-120.6	128	172.1	-178.9	0	0	0	0	108.2	L57 P60 F61 V91 F101 L106 I356 V360	L57-V104 HydrophobicContact CB-CB 4.4Å; L57-V104 HydrophobicContact CD1-CB 3.97Å; L57-V104 HydrophobicContact CD1-CG1 4.01Å; L57-V104 HydrophobicContact CG-CB 4.22Å; L57-V104 HydrophobicContact CG-CG1 4.44Å; L57-V104 PolarHBondContact N-O 3.33Å; P60-V104 HydrophobicContact CG-CG2 4.49Å; F61-V104 HydrophobicContact CZ-CG2 4.47Å; V91-V104 HydrophobicContact CG2-CG1 4.1Å; F101-V104 HydrophobicContact CE2-CG2 3.64Å; F101-V104 HydrophobicContact CZ-CG2 3.43Å; F101-V104 VanDerWaalsContact CZ-CG2 3.43Å; V104-L106 HydrophobicContact CG1-CD2 4.16Å; V104-I356 HydrophobicContact CG2-CG2 4Å; V104-V360 HydrophobicContact CG1-CG2 4.29Å
105	Y	95.6	Very high	93.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	123.5	176.5	-67.2	-93.2	0	0	0	109.9	F20 T21 V22 V54 K55 K56 V91 F92 P94 D103	F20-Y105 HydrophobicContact CD1-CD1 4.36Å; F20-Y105 AromaticContact CD1-CE1 3.72Å; F20-Y105 HydrophobicContact CD1-CE1 3.72Å; F20-Y105 HydrophobicContact CE1-CE1 4.14Å; F20-Y105 HydrophobicContact CG-CE1 4.21Å; T21-Y105 PolarHBondContact N-OH 3.35Å; T21-Y105 WeakPolarHBondContact O-CE2 3.48Å; V22-Y105 HydrophobicContact CG1-CD1 4.05Å; V22-Y105 HydrophobicContact CG1-CE1 3.89Å; V54-Y105 HydrophobicContact CG1-CD1 3.96Å; K55-Y105 CarbonylContact O-C 3.59Å; K55-Y105 WeakPolarHBondContact O-CA 3.42Å; K56-Y105 HydrophobicContact CB-CD1 3.94Å; K56-Y105 HydrophobicContact CB-CE1 3.64Å; K56-Y105 HydrophobicContact CD-CE1 3.89Å; K56-Y105 WeakPolarHBondContact CD-OH 3.35Å; K56-Y105 VanDerWaalsContact CE-OH 3.31Å; K56-Y105 WeakPolarHBondContact CE-OH 3.29Å; 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 3.48Å; V91-Y105 WeakPolarHBondContact CG2-O 3.29Å; F92-Y105 HydrophobicContact CD2-CD2 4.01Å; F92-Y105 HydrophobicContact CD2-CG 4.2Å; F92-Y105 HydrophobicContact CE1-CG 4.39Å; F92-Y105 HydrophobicContact CE2-CD1 4.27Å; F92-Y105 AromaticContact CE2-CD2 3.53Å; F92-Y105 HydrophobicContact CE2-CD2 3.53Å; F92-Y105 HydrophobicContact CE2-CE2 4.32Å; F92-Y105 AromaticContact CE2-CG 3.5Å; F92-Y105 HydrophobicContact CE2-CG 3.5Å; F92-Y105 VanDerWaalsContact CE2-CG 3.5Å; F92-Y105 HydrophobicContact CZ-CD1 4.12Å; F92-Y105 HydrophobicContact CZ-CD2 4.16Å; F92-Y105 AromaticContact CZ-CG 3.62Å; F92-Y105 HydrophobicContact CZ-CG 3.62Å; F92-Y105 PolarHBondContact N-O 2.61Å; F92-Y105 VanDerWaalsContact N-O 3.08Å; F92-Y105 PolarHBondContact O-N 2.62Å; P94-Y105 HydrophobicContact CG-CE2 4.06Å; D103-Y105 HydrophobicContact CB-CD2 4.39Å; D103-Y105 HydrophobicContact CB-CE2 3.7Å
106	L	94.6	Very high	93.4	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	127	174	-53.8	176.8	0	0	0	108.6	V54 K55 L57 E73 L74 L77 L88 V91 V104	V54-L106 CarbonylContact C-O 3.58Å; V54-L106 WeakPolarHBondContact CA-O 3.47Å; K55-L106 HydrophobicContact CB-CB 4.39Å; K55-L106 PolarHBondContact N-O 2.96Å; K55-L106 PolarHBondContact O-N 3.46Å; L57-L106 HydrophobicContact CD1-CD1 4.46Å; L57-L106 HydrophobicContact CD2-CD1 3.95Å; L57-L106 HydrophobicContact CG-CD1 4.4Å; E73-L106 HydrophobicContact CG-CD1 4.33Å; L74-L106 HydrophobicContact CD1-CD2 3.98Å; L77-L106 HydrophobicContact CD1-CD1 3.94Å; L88-L106 HydrophobicContact CD1-CB 4.11Å; L88-L106 HydrophobicContact CD1-CD2 4.16Å; V91-L106 HydrophobicContact CB-CD2 4.17Å; V91-L106 HydrophobicContact CG2-CD2 3.74Å; V104-L106 HydrophobicContact CG1-CD2 4.16Å
107	V	95.9	Very high	93.4	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	124.1	178.1	-172.7	0	0	0	0	108.5	Y26 V52 A53 V54 L89 N90 F92	Y26-V107 HydrophobicContact CE1-CG1 3.79Å; Y26-V107 HydrophobicContact CE1-CG2 4.3Å; Y26-V107 HydrophobicContact CE2-CG2 3.9Å; V52-V107 HydrophobicContact CB-CG1 3.81Å; V52-V107 HydrophobicContact CG1-CG1 4.23Å; V52-V107 HydrophobicContact CG2-CG1 3.85Å; A53-V107 CarbonylContact O-C 3.59Å; A53-V107 WeakPolarHBondContact O-CA 3.43Å; V54-V107 HydrophobicContact CG2-CG1 4.45Å; V54-V107 HydrophobicContact CG2-CG2 4.33Å; L89-V107 HydrophobicContact CB-CG1 4.39Å; L89-V107 PolarHBondContact N-O 3.05Å; N90-V107 HydrophobicContact CB-CB 3.85Å; N90-V107 HydrophobicContact CB-CG2 4Å; N90-V107 PolarHBondContact N-O 3.46Å; N90-V107 WeakPolarHBondContact O-CB 3.29Å; N90-V107 PolarHBondContact O-N 3.02Å; F92-V107 HydrophobicContact CD1-CG2 4.13Å; F92-V107 HydrophobicContact CE1-CG2 3.65Å
108	M	94.7	Very high	93.3	Very high	16 Å²	16	43.5 Å²	43.5	8%	0.079	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	168	-176.8	-62.7	167	-67	0	0	109.2	V52 A53 K55 I86	V52-M108 CarbonylContact C-O 3.6Å; V52-M108 WeakPolarHBondContact CA-O 3.43Å; V52-M108 WeakPolarHBondContact CB-O 3.41Å; A53-M108 PolarHBondContact N-O 3.33Å; A53-M108 PolarHBondContact O-N 3.39Å; K55-M108 HydrophobicContact CB-CE 3.89Å; K55-M108 HydrophobicContact CD-CE 4.37Å; I86-M108 HydrophobicContact CD1-CB 4.26Å; I86-M108 HydrophobicContact CG1-CB 3.86Å; I86-M108 HydrophobicContact CG1-CG 4.06Å; I86-M108 HydrophobicContact CG1-SD 3.87Å; I86-M108 HydrophobicContact CG2-SD 4.31Å
109	E	93.2	Very high	93.1	Very high	33 Å²	33	41.7 Å²	41.7	15%	0.154	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	142.9	168.1	63.2	-166.2	123.7	0	0	111.5	I86 S87 L89 M111 K166	I86-E109 HydrophobicContact CD1-CG 3.39Å; I86-E109 HydrophobicContact CG1-CG 4.45Å; S87-E109 PolarHBondContact N-OE1 3.29Å; L89-E109 HydrophobicContact CD1-CB 4.45Å; E109-M111 HydrophobicContact CG-SD 4.35Å; E109-K166 HydrophobicContact CG-CD 4.27Å; E109-K166 WeakPolarHBondContact OE1-CD 3.3Å; E109-K166 WeakPolarHBondContact OE1-CE 3.46Å; E109-K166 IonicContact OE1-NZ 3.38Å; E109-K166 PolarHBondContact OE1-NZ 3.08Å; E109-K166 WeakPolarHBondContact OE2-CD 3.41Å; E109-K166 WeakPolarHBondContact OE2-CE 3.47Å; E109-K166 IonicContact OE2-NZ 2.71Å; E109-K166 PolarHBondContact OE2-NZ 3.43Å
110	L	94.7	Very high	92.8	Very high	37 Å²	37	42 Å²	42	19%	0.194	21%	0.213	C	C	.	.			trans	-82	136.1	172.8	-171.8	65.1	0	0	0	109.9	I32 A42 N51 A53 K160	I32-L110 HydrophobicContact CD1-CD1 3.62Å; A42-L110 HydrophobicContact CB-CD1 4Å; A42-L110 HydrophobicContact CB-CD2 3.93Å; N51-L110 HydrophobicContact CB-CB 4.17Å; N51-L110 HydrophobicContact CB-CD2 3.63Å; A53-L110 HydrophobicContact CB-CD1 4.04Å; L110-K160 WeakPolarHBondContact O-CE 3.43Å
111	M	94.6	Very high	92.6	Very high	21 Å²	21	42.1 Å²	42.1	10%	0.103	22%	0.215	C	C	.	.			trans	-116.4	157.1	174.4	-58.2	-68.5	-73.1	0	0	108.8	I86 E109 V158 K160 K166	I86-M111 HydrophobicContact CD1-CG 4.42Å; E109-M111 HydrophobicContact CG-SD 4.35Å; M111-V158 HydrophobicContact CB-CB 3.7Å; M111-V158 HydrophobicContact CB-CG1 4.44Å; M111-V158 HydrophobicContact CB-CG2 3.95Å; M111-V158 HydrophobicContact CE-CG2 4.25Å; M111-V158 HydrophobicContact CG-CB 3.92Å; M111-V158 HydrophobicContact CG-CG2 3.55Å; M111-K160 HydrophobicContact CE-CD 4.41Å; M111-K160 HydrophobicContact CE-CG 3.81Å; M111-K160 HydrophobicContact SD-CD 4.08Å; M111-K160 VanDerWaalsContact SD-CE 3.56Å; M111-K160 HydrophobicContact SD-CG 3.81Å; M111-K166 HydrophobicContact CE-CB 4.2Å; M111-K166 HydrophobicContact CE-CD 4.05Å; M111-K166 HydrophobicContact CE-CG 4.25Å; M111-K166 HydrophobicContact SD-CD 3.92Å
112	D	91.7	Very high	92.1	Very high	103 Å²	103	51.2 Å²	51.2	55%	0.551	26%	0.258	S	S	*	.	S	Bend	trans	-80.7	-37.8	-169.6	-60.5	-37	0	0	0	112.4	V159 K160 S161	D112-V159 PolarHBondContact N-O 3.33Å; D112-K160 WeakPolarHBondContact OD2-CA 3.42Å; D112-K160 WeakPolarHBondContact OD2-CB 3.43Å; D112-S161 PolarHBondContact OD2-N 2.99Å
113	A	90.8	Very high	92	Very high	25 Å²	25	46.1 Å²	46.1	21%	0.207	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	163.1	-174.5	0	0	0	0	0	111.7	Q117 V158 V159	A113-Q117 VanDerWaalsContact CA-OE1 3.23Å; A113-Q117 HydrophobicContact CB-CB 4.38Å; A113-V158 CarbonylContact O-C 3.58Å; A113-V158 VanDerWaalsContact O-CA 3.26Å; A113-V158 WeakPolarHBondContact O-CA 3.27Å; A113-V158 WeakPolarHBondContact O-CB 3.43Å; A113-V159 HydrophobicContact CB-CG2 4.02Å; A113-V159 PolarHBondContact N-O 2.83Å; A113-V159 VanDerWaalsContact N-O 3.14Å; A113-V159 PolarHBondContact O-N 3.27Å
114	N	91.4	Very high	92	Very high	50 Å²	50	47.7 Å²	47.7	27%	0.267	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	165.9	161.6	64.9	50.6	0	0	0	110.7	C116 Q117 I157 V158	N114-C116 PolarHBondContact O-N 3.3Å; N114-C116 WeakPolarHBondContact OD1-CB 3.41Å; N114-C116 PolarHBondContact OD1-N 3.02Å; N114-Q117 PolarHBondContact O-N 3.43Å; N114-Q117 VanDerWaalsContact O-N 3.11Å; N114-I157 CarbonylContact C-O 3.57Å; N114-I157 VanDerWaalsContact CA-O 3.24Å; N114-I157 WeakPolarHBondContact CA-O 3.45Å; N114-I157 WeakPolarHBondContact CB-O 3.4Å; N114-V158 HydrophobicContact CB-CG1 4.17Å
115	L	93.1	Very high	92	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-67.9	-17.2	-174.9	-158.3	73.3	0	0	0	112.8	Q117 V118 I119 L131 M135 P154 I157 V159 I214 L218	L115-Q117 PolarHBondContact O-N 2.85Å; L115-V118 HydrophobicContact CD1-CB 3.88Å; L115-V118 HydrophobicContact CD1-CG1 3.97Å; L115-V118 HydrophobicContact CD1-CG2 4.15Å; L115-V118 HydrophobicContact CG-CB 4.41Å; L115-V118 PolarHBondContact O-N 3.29Å; L115-I119 WeakPolarHBondContact O-CD1 3.3Å; L115-I119 VanDerWaalsContact O-CG1 3.31Å; L115-I119 WeakPolarHBondContact O-CG1 3.49Å; L115-I119 PolarHBondContact O-N 2.78Å; L115-L131 HydrophobicContact CD1-CD1 4.31Å; L115-M135 HydrophobicContact CD2-CE 4.23Å; L115-M135 HydrophobicContact CD2-SD 4.48Å; L115-P154 HydrophobicContact CB-CB 3.97Å; L115-P154 WeakPolarHBondContact CB-O 3.45Å; L115-P154 PolarHBondContact N-O 2.73Å; L115-P154 VanDerWaalsContact N-O 3.16Å; L115-I157 HydrophobicContact CB-CB 4.08Å; L115-I157 HydrophobicContact CB-CG2 4.16Å; L115-I157 HydrophobicContact CD2-CB 4.38Å; L115-I157 HydrophobicContact CD2-CD1 4.26Å; L115-I157 HydrophobicContact CD2-CG2 4.17Å; L115-I157 PolarHBondContact N-O 3.06Å; L115-V159 HydrophobicContact CD1-CG1 4.16Å; L115-I214 HydrophobicContact CD2-CG2 3.35Å; L115-L218 HydrophobicContact CD1-CD2 4.47Å; L115-L218 HydrophobicContact CG-CD2 4.44Å
116	C	90.7	Very high	91.9	Very high	49 Å²	49	54 Å²	54	33%	0.331	27%	0.272	S	S	.	.	H	α-helix	trans	-59.6	-36.5	172	-53.2	0	0	0	0	111.7	N114 H120 S155	N114-C116 PolarHBondContact O-N 3.3Å; N114-C116 WeakPolarHBondContact OD1-CB 3.41Å; N114-C116 PolarHBondContact OD1-N 3.02Å; C116-H120 PolarHBondContact O-CD2 3.25Å; C116-H120 VanDerWaalsContact O-CD2 3.25Å; C116-S155 PolarHBondContact SG-N 3.34Å
117	Q	89.4	Confident	91.9	Very high	112 Å²	112	59.6 Å²	59.6	52%	0.523	29%	0.293	S	S	.	.	H	α-helix	trans	-73.4	-36.5	177.9	-64.8	169	-65.7	0	0	111	A113 N114 L115 H120	A113-Q117 VanDerWaalsContact CA-OE1 3.23Å; A113-Q117 HydrophobicContact CB-CB 4.38Å; N114-Q117 PolarHBondContact O-N 3.43Å; N114-Q117 VanDerWaalsContact O-N 3.11Å; L115-Q117 PolarHBondContact O-N 2.85Å; Q117-H120 PolarHBondContact O-N 3.47Å
118	V	91.2	Very high	91.9	Very high	11 Å²	11	59.8 Å²	59.8	7%	0.067	29%	0.294	C	S	.	.	H	α-helix	trans	-67.9	-34.4	179.5	179.9	0	0	0	0	112.3	L115 H120 M121 L123 L131 V159 L218	L115-V118 HydrophobicContact CD1-CB 3.88Å; L115-V118 HydrophobicContact CD1-CG1 3.97Å; L115-V118 HydrophobicContact CD1-CG2 4.15Å; L115-V118 HydrophobicContact CG-CB 4.41Å; L115-V118 PolarHBondContact O-N 3.29Å; V118-H120 PolarHBondContact O-N 2.66Å; V118-H120 VanDerWaalsContact O-N 3.12Å; V118-M121 WeakPolarHBondContact O-CB 3.17Å; V118-M121 PolarHBondContact O-N 3.2Å; V118-L123 HydrophobicContact CG1-CD1 3.83Å; V118-L123 HydrophobicContact CG1-CD2 4.16Å; V118-L123 HydrophobicContact CG1-CG 4.37Å; V118-L131 HydrophobicContact CG1-CD1 4.1Å; V118-V159 HydrophobicContact CG2-CG2 3.5Å; V118-V159 VanDerWaalsContact CG2-CG2 3.5Å; V118-L218 HydrophobicContact CG1-CD2 4.29Å
119	I	90.2	Very high	92.1	Very high	5 Å²	5	59.1 Å²	59.1	3%	0.026	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-26.3	177.8	-78.2	159.1	0	0	0	113.1	L115 P154 E217 L218	L115-I119 WeakPolarHBondContact O-CD1 3.3Å; L115-I119 VanDerWaalsContact O-CG1 3.31Å; L115-I119 WeakPolarHBondContact O-CG1 3.49Å; L115-I119 PolarHBondContact O-N 2.78Å; I119-P154 HydrophobicContact CD1-CB 3.59Å; I119-P154 HydrophobicContact CD1-CG 3.45Å; I119-P154 VanDerWaalsContact CD1-CG 3.45Å; I119-E217 HydrophobicContact CD1-CG 3.75Å; I119-E217 HydrophobicContact CG1-CG 4.08Å; I119-E217 HydrophobicContact CG2-CG 3.64Å; I119-L218 HydrophobicContact CG1-CD2 3.66Å; I119-L218 HydrophobicContact CG1-CG 4.18Å
120	H	86.5	Confident	92.3	Very high	150 Å²	150	60.4 Å²	60.4	69%	0.694	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	3.1	178.8	-58.9	-52.6	0	0	0	113.5	C116 Q117 V118	C116-H120 PolarHBondContact O-CD2 3.25Å; C116-H120 VanDerWaalsContact O-CD2 3.25Å; Q117-H120 PolarHBondContact O-N 3.47Å; V118-H120 PolarHBondContact O-N 2.66Å; V118-H120 VanDerWaalsContact O-N 3.12Å
121	M	88.8	Confident	92.4	Very high	114 Å²	114	58.8 Å²	58.8	56%	0.562	29%	0.287	S	S	*	.	S	Bend	trans	-96.1	150.1	176.3	-58.4	177.6	67	0	0	110.5	V118 L123	V118-M121 WeakPolarHBondContact O-CB 3.17Å; V118-M121 PolarHBondContact O-N 3.2Å; M121-L123 PolarHBondContact O-N 2.81Å
122	E	84.9	Confident	92.6	Very high	191 Å²	191	57.8 Å²	57.8	89%	0.893	28%	0.282	S	S	*	.			trans	-73.5	113.9	168.3	-66.6	-179	170.8	0	0	109.2
123	L	91.1	Very high	92.9	Very high	18 Å²	18	53 Å²	53	9%	0.094	26%	0.256	C	S	.	.			trans	-109.2	126.7	176.4	-65.2	-178.7	0	0	0	109.7	V118 M121 R127 M128 L131 L218 P281	V118-L123 HydrophobicContact CG1-CD1 3.83Å; V118-L123 HydrophobicContact CG1-CD2 4.16Å; V118-L123 HydrophobicContact CG1-CG 4.37Å; M121-L123 PolarHBondContact O-N 2.81Å; L123-R127 HydrophobicContact CD2-CB 4.2Å; L123-M128 HydrophobicContact CB-CB 4.49Å; L123-L131 HydrophobicContact CD1-CD1 4.02Å; L123-L218 HydrophobicContact CD1-CD2 3.86Å; L123-P281 WeakPolarHBondContact O-CG 3.48Å
124	D	93.5	Very high	93.3	Very high	64 Å²	64	52 Å²	52	34%	0.342	25%	0.247	S	C	.	.			trans	-66.8	170.1	165	60.7	40.6	0	0	0	111.8	E126 R127 M128	D124-E126 PolarHBondContact O-N 2.86Å; D124-E126 WeakPolarHBondContact OD1-CA 3.36Å; D124-E126 WeakPolarHBondContact OD1-CB 3.17Å; D124-E126 PolarHBondContact OD1-N 2.91Å; D124-R127 WeakPolarHBondContact OD1-CB 3.49Å; D124-R127 WeakPolarHBondContact OD1-CG 3.36Å; D124-R127 PolarHBondContact OD1-N 3.32Å; D124-R127 IonicContact OD2-NE 3.08Å; D124-M128 WeakPolarHBondContact O-CB 3.44Å; D124-M128 PolarHBondContact O-N 2.86Å; D124-M128 VanDerWaalsContact O-N 3.07Å
125	H	95.1	Very high	93.6	Very high	7 Å²	7	49.7 Å²	49.7	3%	0.032	23%	0.234	C	C	.	.	H	α-helix	trans	-62.1	-29.9	177.3	-77.1	-64.3	0	0	0	113.3	S129 P281 D287 K290 T291 Y320	H125-S129 VanDerWaalsContact O-CB 3.22Å; H125-S129 WeakPolarHBondContact O-CB 3.37Å; H125-S129 PolarHBondContact O-N 2.82Å; H125-S129 PolarHBondContact O-OG 2.75Å; H125-P281 PolarHBondContact CD2-O 3.39Å; H125-P281 PolarHBondContact NE2-O 2.71Å; H125-P281 VanDerWaalsContact NE2-O 3.11Å; H125-D287 IonicContact CD2-OD1 2.68Å; H125-D287 PolarHBondContact NE2-O 3.08Å; H125-K290 HydrophobicContact CB-CB 4.05Å; H125-K290 HydrophobicContact CB-CG 4.31Å; H125-T291 PolarHBondContact CE1-N 3.31Å; H125-T291 PolarHBondContact NE2-OG1 2.8Å; H125-Y320 HydrophobicContact CB-CE2 4.33Å; H125-Y320 AromaticContact ND1-CE2 3.49Å; H125-Y320 WeakPolarHBondContact ND1-CE2 3.38Å; H125-Y320 AromaticContact ND1-CZ 3.62Å; H125-Y320 PolarHBondContact ND1-OH 2.93Å
126	E	94.6	Very high	93.9	Very high	127 Å²	127	49.7 Å²	49.7	59%	0.593	23%	0.234	S	C	*	.	H	α-helix	trans	-66.5	-55.5	-178	-167.1	177.6	161.2	0	0	110	D124 M128 S129 Y130 W324	D124-E126 PolarHBondContact O-N 2.86Å; D124-E126 WeakPolarHBondContact OD1-CA 3.36Å; D124-E126 WeakPolarHBondContact OD1-CB 3.17Å; D124-E126 PolarHBondContact OD1-N 2.91Å; E126-M128 PolarHBondContact O-N 2.74Å; E126-S129 PolarHBondContact O-N 2.89Å; E126-S129 PolarHBondContact O-OG 2.9Å; E126-Y130 VanDerWaalsContact O-CB 3.29Å; E126-Y130 WeakPolarHBondContact O-CB 3.39Å; E126-Y130 PolarHBondContact O-N 3.17Å; E126-W324 HydrophobicContact CB-CZ2 4.43Å; E126-W324 HydrophobicContact CG-CH2 3.55Å; E126-W324 HydrophobicContact CG-CZ2 3.36Å
127	R	94.9	Very high	94.2	Very high	119 Å²	119	47.3 Å²	47.3	45%	0.449	22%	0.219	S	C	.	.	H	α-helix	trans	-61.3	-45.3	177	-67.2	174.2	179.9	174.4	1.7	111.7	L123 D124 Y130 L131	L123-R127 HydrophobicContact CD2-CB 4.2Å; D124-R127 WeakPolarHBondContact OD1-CB 3.49Å; D124-R127 WeakPolarHBondContact OD1-CG 3.36Å; D124-R127 PolarHBondContact OD1-N 3.32Å; D124-R127 IonicContact OD2-NE 3.08Å; R127-Y130 PolarHBondContact O-N 3.19Å; R127-L131 VanDerWaalsContact O-CG 3.3Å; R127-L131 WeakPolarHBondContact O-CG 3.28Å; R127-L131 PolarHBondContact O-N 2.79Å
128	M	95.9	Very high	94.5	Very high	3 Å²	3	42 Å²	42	2%	0.015	19%	0.194	C	C	.	.	H	α-helix	trans	-62.2	-47.8	179.9	-172.6	-171.1	-59.4	0	0	111.7	L123 D124 E126 Y130 L131 L132 V219 Y320	L123-M128 HydrophobicContact CB-CB 4.49Å; D124-M128 WeakPolarHBondContact O-CB 3.44Å; D124-M128 PolarHBondContact O-N 2.86Å; D124-M128 VanDerWaalsContact O-N 3.07Å; E126-M128 PolarHBondContact O-N 2.74Å; M128-Y130 VanDerWaalsContact C-N 3.32Å; M128-Y130 PolarHBondContact O-N 2.91Å; M128-L131 PolarHBondContact O-N 3.2Å; M128-L132 HydrophobicContact CG-CD1 4.23Å; M128-L132 WeakPolarHBondContact O-CD1 3.35Å; M128-L132 VanDerWaalsContact O-CG 3.3Å; M128-L132 WeakPolarHBondContact O-CG 3.35Å; M128-L132 PolarHBondContact O-N 3.36Å; M128-L132 VanDerWaalsContact O-N 3.1Å; M128-V219 HydrophobicContact CE-CG2 3.89Å; M128-V219 HydrophobicContact SD-CG2 3.73Å; M128-Y320 PolarHBondContact SD-OH 2.95Å
129	S	97.3	Very high	94.7	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.014	19%	0.191	C	C	.	.	H	α-helix	trans	-66.3	-34	177.9	60.4	0	0	0	0	112.4	H125 E126 L132 Y133 Y320 W324	H125-S129 VanDerWaalsContact O-CB 3.22Å; H125-S129 WeakPolarHBondContact O-CB 3.37Å; H125-S129 PolarHBondContact O-N 2.82Å; H125-S129 PolarHBondContact O-OG 2.75Å; E126-S129 PolarHBondContact O-N 2.89Å; E126-S129 PolarHBondContact O-OG 2.9Å; S129-L132 PolarHBondContact O-N 2.86Å; S129-Y133 VanDerWaalsContact O-CB 3.31Å; S129-Y133 WeakPolarHBondContact O-CB 3.42Å; S129-Y133 PolarHBondContact O-N 2.93Å; S129-Y320 VanDerWaalsContact CB-O 3.32Å; S129-Y320 WeakPolarHBondContact CB-O 3.1Å; S129-W324 PolarHBondContact OG-NE1 3.45Å
130	Y	97.8	Very high	95	Very high	60 Å²	60	43.4 Å²	43.4	24%	0.235	20%	0.199	C	C	.	.	H	α-helix	trans	-69.4	-39.9	176.7	-173.9	-125.8	0	0	0	112.8	E126 R127 M128 Y133 Q134 C163 W324	E126-Y130 VanDerWaalsContact O-CB 3.29Å; E126-Y130 WeakPolarHBondContact O-CB 3.39Å; E126-Y130 PolarHBondContact O-N 3.17Å; R127-Y130 PolarHBondContact O-N 3.19Å; M128-Y130 VanDerWaalsContact C-N 3.32Å; M128-Y130 PolarHBondContact O-N 2.91Å; Y130-Y133 HydrophobicContact CD2-CD1 4.1Å; Y130-Y133 HydrophobicContact CE2-CD1 4.18Å; Y130-Y133 PolarHBondContact O-N 3.22Å; Y130-Q134 VanDerWaalsContact CD1-NE2 3.25Å; Y130-Q134 HydrophobicContact CE2-CG 4.23Å; Y130-Q134 WeakPolarHBondContact O-CG 3.21Å; Y130-Q134 PolarHBondContact O-N 3.12Å; Y130-Q134 PolarHBondContact O-NE2 3.39Å; Y130-C163 HydrophobicContact CD1-CB 4.11Å; Y130-C163 HydrophobicContact CE1-CB 4.35Å; Y130-W324 HydrophobicContact CD2-CB 4.5Å; Y130-W324 AromaticContact CD2-CD2 3.71Å; Y130-W324 HydrophobicContact CD2-CD2 3.71Å; Y130-W324 AromaticContact CD2-CE3 3.83Å; Y130-W324 HydrophobicContact CD2-CE3 3.83Å; Y130-W324 HydrophobicContact CD2-CG 4.01Å; Y130-W324 HydrophobicContact CD2-CZ3 4.32Å; Y130-W324 HydrophobicContact CE2-CE3 4.33Å; Y130-W324 HydrophobicContact CG-CD2 4.38Å; Y130-W324 HydrophobicContact CG-CZ2 4.48Å
131	L	97.6	Very high	95.3	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.021	17%	0.167	C	C	.	.	H	α-helix	trans	-63.1	-43.5	172.9	-69.2	171.9	0	0	0	111.2	L115 V118 L123 R127 M128 Q134 M135 V159 L165	L115-L131 HydrophobicContact CD1-CD1 4.31Å; V118-L131 HydrophobicContact CG1-CD1 4.1Å; L123-L131 HydrophobicContact CD1-CD1 4.02Å; R127-L131 VanDerWaalsContact O-CG 3.3Å; R127-L131 WeakPolarHBondContact O-CG 3.28Å; R127-L131 PolarHBondContact O-N 2.79Å; M128-L131 PolarHBondContact O-N 3.2Å; L131-Q134 PolarHBondContact O-N 2.89Å; L131-M135 HydrophobicContact CB-CE 4.24Å; L131-M135 WeakPolarHBondContact O-CG 3.18Å; L131-M135 PolarHBondContact O-N 3.1Å; L131-V159 HydrophobicContact CD2-CG1 3.91Å; L131-L165 HydrophobicContact CB-CD1 4.25Å; L131-L165 HydrophobicContact CD2-CB 4.15Å; L131-L165 HydrophobicContact CD2-CD1 3.89Å
132	L	98.2	Very high	95.4	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63.9	-42.5	176.2	-69.4	165	0	0	0	112.4	M128 S129 M135 L136 V211 M215 Y320 I321	M128-L132 HydrophobicContact CG-CD1 4.23Å; M128-L132 WeakPolarHBondContact O-CD1 3.35Å; M128-L132 VanDerWaalsContact O-CG 3.3Å; M128-L132 WeakPolarHBondContact O-CG 3.35Å; M128-L132 PolarHBondContact O-N 3.36Å; M128-L132 VanDerWaalsContact O-N 3.1Å; S129-L132 PolarHBondContact O-N 2.86Å; L132-M135 HydrophobicContact CD2-CE 3.78Å; L132-M135 HydrophobicContact CG-CE 4.25Å; L132-M135 PolarHBondContact O-N 2.89Å; L132-L136 WeakPolarHBondContact O-CB 3.34Å; L132-L136 VanDerWaalsContact O-CG 3.25Å; L132-L136 WeakPolarHBondContact O-CG 3.21Å; L132-L136 PolarHBondContact O-N 2.83Å; L132-V211 HydrophobicContact CD2-CG1 3.78Å; L132-M215 HydrophobicContact CD1-CB 4.38Å; L132-M215 HydrophobicContact CD1-CE 4.02Å; L132-M215 HydrophobicContact CD1-CG 3.8Å; L132-M215 HydrophobicContact CD1-SD 3.64Å; L132-M215 HydrophobicContact CD2-CB 3.82Å; L132-M215 HydrophobicContact CD2-CG 4.18Å; L132-M215 HydrophobicContact CD2-SD 4.41Å; L132-Y320 HydrophobicContact CD1-CD1 4.42Å; L132-Y320 HydrophobicContact CD1-CE1 4.01Å; L132-I321 HydrophobicContact CB-CD1 3.6Å; L132-I321 HydrophobicContact CD1-CD1 4.26Å
133	Y	98.6	Very high	95.7	Very high	1 Å²	1	23.1 Å²	23.1	0%	0.004	10%	0.103	C	C	.	.	H	α-helix	trans	-55.8	-51.8	173.8	167.4	-107.9	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 3.42Å; S129-Y133 PolarHBondContact O-N 2.93Å; Y130-Y133 HydrophobicContact CD2-CD1 4.1Å; Y130-Y133 HydrophobicContact CE2-CD1 4.18Å; Y130-Y133 PolarHBondContact O-N 3.22Å; Y133-M135 VanDerWaalsContact C-N 3.35Å; Y133-M135 PolarHBondContact O-N 2.89Å; Y133-L136 PolarHBondContact O-N 3.46Å; Y133-L136 VanDerWaalsContact O-N 3.12Å; Y133-C137 WeakPolarHBondContact CE2-SG 3.25Å; Y133-C137 PolarHBondContact O-N 3.1Å; Y133-C137 PolarHBondContact O-SG 2.85Å; Y133-L316 HydrophobicContact CD2-CD2 3.87Å; Y133-L316 HydrophobicContact CE2-CD2 4.08Å; Y133-I321 HydrophobicContact CD2-CG2 4Å; Y133-I321 HydrophobicContact CG-CG2 4.47Å; Y133-W324 HydrophobicContact CD1-CB 3.54Å; Y133-W324 HydrophobicContact CD1-CG 4.31Å; Y133-W324 HydrophobicContact CD2-CB 3.79Å; Y133-W324 HydrophobicContact CE1-CB 3.93Å; Y133-W324 WeakPolarHBondContact CE1-O 3.49Å; Y133-W324 HydrophobicContact CE2-CB 4.18Å; Y133-W324 WeakPolarHBondContact CE2-O 3.12Å; Y133-W324 HydrophobicContact CG-CB 3.45Å; Y133-W324 VanDerWaalsContact CG-CB 3.45Å; Y133-W324 HydrophobicContact CG-CG 4.22Å; Y133-W324 PolarHBondContact OH-O 3.15Å; Y133-D326 PolarHBondContact OH-N 3.44Å; Y133-E329 WeakPolarHBondContact CE1-OE2 3.33Å; Y133-E329 VanDerWaalsContact CZ-OE2 3.31Å; Y133-E329 WeakPolarHBondContact OH-CB 3.48Å; Y133-E329 VanDerWaalsContact OH-CD 3.31Å; Y133-E329 PolarHBondContact OH-OE2 2.88Å
134	Q	98.3	Very high	95.7	Very high	4 Å²	4	25.1 Å²	25.1	2%	0.019	12%	0.119	C	C	.	.	H	α-helix	trans	-61.9	-39.8	178.8	-72.7	177.6	87.9	0	0	112.9	N84 Y130 L131 C137 G138 C163 L165	N84-Q134 VanDerWaalsContact CB-O 3.25Å; N84-Q134 WeakPolarHBondContact CB-O 3.45Å; N84-Q134 WeakPolarHBondContact ND2-CB 3.27Å; N84-Q134 WeakPolarHBondContact ND2-CG 3.43Å; N84-Q134 PolarHBondContact ND2-OE1 2.8Å; Y130-Q134 VanDerWaalsContact CD1-NE2 3.25Å; Y130-Q134 HydrophobicContact CE2-CG 4.23Å; Y130-Q134 WeakPolarHBondContact O-CG 3.21Å; Y130-Q134 PolarHBondContact O-N 3.12Å; Y130-Q134 PolarHBondContact O-NE2 3.39Å; L131-Q134 PolarHBondContact O-N 2.89Å; Q134-C137 PolarHBondContact O-N 2.77Å; Q134-G138 PolarHBondContact O-N 3.22Å; Q134-C163 PolarHBondContact NE2-O 3.06Å; Q134-L165 HydrophobicContact CB-CB 3.98Å; Q134-L165 HydrophobicContact CB-CD2 4.28Å
135	M	97.9	Very high	95.3	Very high	2 Å²	2	22.3 Å²	22.3	1%	0.01	10%	0.104	C	C	.	.	H	α-helix	trans	-58.7	-48.1	172.4	-75.7	-174.7	-102.1	0	0	111.1	L115 L131 L132 Y133 G138 I139 I157 L165 I214	L115-M135 HydrophobicContact CD2-CE 4.23Å; L115-M135 HydrophobicContact CD2-SD 4.48Å; L131-M135 HydrophobicContact CB-CE 4.24Å; L131-M135 WeakPolarHBondContact O-CG 3.18Å; L131-M135 PolarHBondContact O-N 3.1Å; L132-M135 HydrophobicContact CD2-CE 3.78Å; L132-M135 HydrophobicContact CG-CE 4.25Å; L132-M135 PolarHBondContact O-N 2.89Å; Y133-M135 VanDerWaalsContact C-N 3.35Å; Y133-M135 PolarHBondContact O-N 2.89Å; M135-G138 PolarHBondContact O-N 3.02Å; M135-I139 WeakPolarHBondContact O-CB 3.33Å; M135-I139 WeakPolarHBondContact O-CD1 3.3Å; M135-I139 WeakPolarHBondContact O-CG1 3.03Å; M135-I139 PolarHBondContact O-N 3.21Å; M135-I157 HydrophobicContact CG-CD1 4.18Å; M135-I157 HydrophobicContact SD-CD1 3.61Å; M135-L165 HydrophobicContact CE-CD1 4.2Å; M135-L165 HydrophobicContact CG-CD1 3.59Å; M135-L165 HydrophobicContact CG-CD2 3.77Å; M135-L165 HydrophobicContact CG-CG 4.38Å; M135-L165 HydrophobicContact SD-CD1 4.39Å; M135-I214 HydrophobicContact CE-CG2 4.13Å; M135-I214 HydrophobicContact SD-CG2 4.17Å
136	L	98.4	Very high	94.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-64.6	-39.5	-179.7	-70.4	166.3	0	0	0	112.2	L132 Y133 I139 K140 I208 M301 V312 A315 L316 I321	L132-L136 WeakPolarHBondContact O-CB 3.34Å; L132-L136 VanDerWaalsContact O-CG 3.25Å; L132-L136 WeakPolarHBondContact O-CG 3.21Å; L132-L136 PolarHBondContact O-N 2.83Å; Y133-L136 PolarHBondContact O-N 3.46Å; Y133-L136 VanDerWaalsContact O-N 3.12Å; L136-I139 PolarHBondContact O-N 3.31Å; L136-K140 VanDerWaalsContact O-CB 3.29Å; L136-K140 WeakPolarHBondContact O-CB 3.36Å; L136-K140 PolarHBondContact O-N 2.8Å; L136-I208 HydrophobicContact CD2-CD1 3.47Å; L136-I208 VanDerWaalsContact CD2-CD1 3.47Å; L136-M301 HydrophobicContact CD1-CE 4.36Å; L136-M301 HydrophobicContact CD2-CE 4.32Å; L136-V312 HydrophobicContact CD2-CG1 4.24Å; L136-A315 HydrophobicContact CD1-CB 3.92Å; L136-A315 HydrophobicContact CD2-CB 3.91Å; L136-L316 HydrophobicContact CB-CD2 3.59Å; L136-L316 HydrophobicContact CB-CG 3.9Å; L136-L316 HydrophobicContact CD1-CD2 4.37Å; L136-I321 HydrophobicContact CD1-CG1 4.24Å; L136-I321 HydrophobicContact CD1-CG2 4.07Å
137	C	97.7	Very high	94.4	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62.7	-46.4	173.9	-68.9	0	0	0	0	111.7	Y133 Q134 I139 K140 H141	Y133-C137 WeakPolarHBondContact CE2-SG 3.25Å; Y133-C137 PolarHBondContact O-N 3.1Å; Y133-C137 PolarHBondContact O-SG 2.85Å; Q134-C137 PolarHBondContact O-N 2.77Å; C137-I139 PolarHBondContact O-N 3.03Å; C137-K140 PolarHBondContact O-N 2.83Å; C137-H141 PolarHBondContact O-N 3.2Å
138	G	95.9	Very high	94.2	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-59.6	-44.7	175.4	0	0	0	0	0	112.6	Q134 M135 H141 L142	Q134-G138 PolarHBondContact O-N 3.22Å; M135-G138 PolarHBondContact O-N 3.02Å; G138-H141 PolarHBondContact O-N 3.05Å; G138-L142 WeakPolarHBondContact O-CG 3.48Å; G138-L142 PolarHBondContact O-N 3.47Å; G138-L142 VanDerWaalsContact O-N 3.12Å
139	I	95.3	Very high	93.8	Very high	1 Å²	1	11.6 Å²	11.6	1%	0.005	7%	0.066	C	C	.	.	H	α-helix	trans	-63.4	-45.7	177	-69	165.2	0	0	0	111.1	M135 L136 C137 H141 L142 H143 L152 I167 D207 V211 V312	M135-I139 WeakPolarHBondContact O-CB 3.33Å; M135-I139 WeakPolarHBondContact O-CD1 3.3Å; M135-I139 WeakPolarHBondContact O-CG1 3.03Å; M135-I139 PolarHBondContact O-N 3.21Å; L136-I139 PolarHBondContact O-N 3.31Å; C137-I139 PolarHBondContact O-N 3.03Å; I139-H141 VanDerWaalsContact C-N 3.28Å; I139-H141 PolarHBondContact O-N 3.24Å; I139-L142 WeakPolarHBondContact O-CB 3.36Å; I139-L142 PolarHBondContact O-N 3.46Å; I139-L142 VanDerWaalsContact O-N 3.12Å; I139-H143 WeakPolarHBondContact CG2-CE1 3.37Å; I139-H143 WeakPolarHBondContact CG2-NE2 3.37Å; I139-H143 PolarHBondContact O-CD2 3.43Å; I139-H143 VanDerWaalsContact O-CG 3.3Å; I139-H143 PolarHBondContact O-N 2.92Å; I139-L152 HydrophobicContact CD1-CD1 3.44Å; I139-L152 VanDerWaalsContact CD1-CD1 3.44Å; I139-L152 HydrophobicContact CG1-CD1 3.81Å; I139-I167 HydrophobicContact CG1-CD1 3.94Å; I139-D207 HydrophobicContact CD1-CB 4.41Å; I139-D207 HydrophobicContact CG2-CB 3.99Å; I139-V211 HydrophobicContact CD1-CG2 3.33Å; I139-V312 HydrophobicContact CG2-CG2 3.86Å
140	K	95.6	Very high	93.3	Very high	44 Å²	44	12.3 Å²	12.3	19%	0.191	7%	0.069	C	C	.	.	H	α-helix	trans	-58.6	-41.5	178.1	-177.3	167.4	166.7	67.3	0	111.7	L136 C137 L142 H143 S144 V312 D313 L316 A330	L136-K140 VanDerWaalsContact O-CB 3.29Å; L136-K140 WeakPolarHBondContact O-CB 3.36Å; L136-K140 PolarHBondContact O-N 2.8Å; C137-K140 PolarHBondContact O-N 2.83Å; K140-L142 VanDerWaalsContact C-N 3.34Å; K140-H143 PolarHBondContact O-N 3.21Å; K140-S144 WeakPolarHBondContact O-CB 3.39Å; K140-S144 PolarHBondContact O-N 2.84Å; K140-S144 PolarHBondContact O-OG 3.28Å; K140-V312 HydrophobicContact CB-CG1 3.79Å; K140-V312 HydrophobicContact CG-CG1 4.5Å; K140-D313 WeakPolarHBondContact CE-OD1 3.39Å; K140-D313 IonicContact NZ-OD1 3.22Å; K140-D313 PolarHBondContact NZ-OD1 3.42Å; K140-D313 IonicContact NZ-OD2 2.67Å; K140-L316 HydrophobicContact CB-CD1 4.42Å; K140-L316 HydrophobicContact CD-CD1 3.49Å; K140-L316 VanDerWaalsContact CD-CD1 3.49Å; K140-A330 WeakPolarHBondContact CD-O 3.32Å; K140-A330 WeakPolarHBondContact CE-O 3.17Å
141	H	93.4	Very high	92.8	Very high	6 Å²	6	9.8 Å²	9.8	3%	0.028	6%	0.059	C	C	.	.	H	α-helix	trans	-66.8	-33.8	177.3	-172.7	89.9	0	0	0	112.8	N81 H82 I85 C137 G138 I139 S144 P333	N81-H141 PolarHBondContact O-CE1 3.19Å; N81-H141 PolarHBondContact O-NE2 3.38Å; H82-H141 HydrophobicContact CB-CB 4.24Å; H82-H141 AromaticContact CD2-CG 3.86Å; H82-H141 AromaticContact CD2-ND1 3.73Å; H82-H141 AromaticContact CG-CG 3.78Å; I85-H141 HydrophobicContact CD1-CB 4.26Å; C137-H141 PolarHBondContact O-N 3.2Å; G138-H141 PolarHBondContact O-N 3.05Å; I139-H141 VanDerWaalsContact C-N 3.28Å; I139-H141 PolarHBondContact O-N 3.24Å; H141-S144 PolarHBondContact O-OG 2.91Å; H141-P333 PolarHBondContact CE1-O 3.16Å
142	L	91.4	Very high	92.5	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-68.6	-46.4	171.2	-66.4	168.4	0	0	0	111.2	V80 I85 G138 I139 K140 S144 A145 G146 I147 H149 F170	V80-L142 HydrophobicContact CG1-CD2 4.34Å; V80-L142 HydrophobicContact CG2-CD2 4.3Å; I85-L142 HydrophobicContact CD1-CD1 4.39Å; I85-L142 HydrophobicContact CD1-CD2 3.71Å; I85-L142 HydrophobicContact CD1-CG 3.69Å; G138-L142 WeakPolarHBondContact O-CG 3.48Å; G138-L142 PolarHBondContact O-N 3.47Å; G138-L142 VanDerWaalsContact O-N 3.12Å; I139-L142 WeakPolarHBondContact O-CB 3.36Å; I139-L142 PolarHBondContact O-N 3.46Å; I139-L142 VanDerWaalsContact O-N 3.12Å; K140-L142 VanDerWaalsContact C-N 3.34Å; L142-S144 VanDerWaalsContact C-N 3.31Å; L142-S144 PolarHBondContact O-N 2.8Å; L142-A145 WeakPolarHBondContact O-CA 3.36Å; L142-A145 VanDerWaalsContact O-CB 3.28Å; L142-A145 WeakPolarHBondContact O-CB 3.39Å; L142-A145 PolarHBondContact O-N 2.98Å; L142-G146 PolarHBondContact O-N 2.96Å; L142-I147 CarbonylContact C-O 3.42Å; L142-I147 HydrophobicContact CB-CB 4.26Å; L142-I147 WeakPolarHBondContact CB-O 3.37Å; L142-I147 HydrophobicContact CD2-CB 4.48Å; L142-I147 HydrophobicContact CD2-CD1 4.35Å; L142-I147 HydrophobicContact CD2-CG2 4.28Å; L142-I147 WeakPolarHBondContact O-CB 3.48Å; L142-I147 PolarHBondContact O-N 2.94Å; L142-H149 HydrophobicContact CD1-CB 4.45Å; L142-F170 HydrophobicContact CD1-CD1 4.31Å; L142-F170 HydrophobicContact CD1-CE1 3.62Å; L142-F170 HydrophobicContact CD2-CD1 4.03Å; L142-F170 HydrophobicContact CD2-CE1 3.54Å; L142-F170 HydrophobicContact CD2-CZ 4.11Å; L142-F170 HydrophobicContact CG-CE1 4.2Å
143	H	91.9	Very high	92.2	Very high	24 Å²	24	10.7 Å²	10.7	11%	0.111	6%	0.063	C	C	.	.	H	α-helix	trans	-62.7	-37.2	-179.4	-68	175.7	0	0	0	112	I139 K140 A145 G146 I147 E204 D207	I139-H143 WeakPolarHBondContact CG2-CE1 3.37Å; I139-H143 WeakPolarHBondContact CG2-NE2 3.37Å; I139-H143 PolarHBondContact O-CD2 3.43Å; I139-H143 VanDerWaalsContact O-CG 3.3Å; I139-H143 PolarHBondContact O-N 2.92Å; K140-H143 PolarHBondContact O-N 3.21Å; H143-A145 PolarHBondContact O-N 3.09Å; H143-G146 WeakPolarHBondContact O-CA 3.49Å; H143-G146 PolarHBondContact O-N 3.41Å; H143-I147 PolarHBondContact CD2-O 3.48Å; H143-I147 PolarHBondContact N-O 3.32Å; H143-E204 HydrophobicContact CB-CG 4.21Å; H143-E204 PolarHBondContact CE1-O 3.17Å; H143-E204 PolarHBondContact NE2-O 3.32Å; H143-D207 IonicContact CD2-OD2 3.48Å; H143-D207 IonicContact CE1-OD2 2.66Å; H143-D207 IonicContact NE2-OD2 3.78Å; H143-D207 PolarHBondContact NE2-OD2 3.21Å
144	S	90	Very high	91.9	Very high	60 Å²	60	10.7 Å²	10.7	42%	0.42	6%	0.063	S	C	.	.	H	α-helix	trans	-65.6	-22	175.3	68.4	0	0	0	0	113.3	K140 H141 L142 G146	K140-S144 WeakPolarHBondContact O-CB 3.39Å; K140-S144 PolarHBondContact O-N 2.84Å; K140-S144 PolarHBondContact O-OG 3.28Å; H141-S144 PolarHBondContact O-OG 2.91Å; L142-S144 VanDerWaalsContact C-N 3.31Å; L142-S144 PolarHBondContact O-N 2.8Å; S144-G146 VanDerWaalsContact C-N 3.32Å
145	A	85	Confident	91.5	Very high	5 Å²	5	13 Å²	13	4%	0.041	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-0.2	170.9	0	0	0	0	0	113.9	L142 H143 I147 P335	L142-A145 WeakPolarHBondContact O-CA 3.36Å; L142-A145 VanDerWaalsContact O-CB 3.28Å; L142-A145 WeakPolarHBondContact O-CB 3.39Å; L142-A145 PolarHBondContact O-N 2.98Å; H143-A145 PolarHBondContact O-N 3.09Å; A145-I147 VanDerWaalsContact C-N 3.32Å; A145-I147 HydrophobicContact CB-CD1 3.67Å; A145-I147 HydrophobicContact CB-CG1 3.99Å; A145-P335 HydrophobicContact CB-CG 3.41Å; A145-P335 VanDerWaalsContact CB-CG 3.41Å
146	G	85.3	Confident	91.2	Very high	26 Å²	26	13.6 Å²	13.6	27%	0.268	8%	0.083	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	16.5	-171.8	0	0	0	0	0	114.1	L142 H143 S144 T175	L142-G146 PolarHBondContact O-N 2.96Å; H143-G146 WeakPolarHBondContact O-CA 3.49Å; H143-G146 PolarHBondContact O-N 3.41Å; S144-G146 VanDerWaalsContact C-N 3.32Å; G146-T175 VanDerWaalsContact O-CA 3.28Å; G146-T175 WeakPolarHBondContact O-CA 3.5Å
147	I	86.4	Confident	91	Very high	4 Å²	4	13.7 Å²	13.7	2%	0.021	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	119.1	-177.8	-57.2	160.9	0	0	0	109.5	L76 V80 L142 H143 A145 A173 Y338	L76-I147 HydrophobicContact CD1-CG2 4.35Å; L76-I147 HydrophobicContact CD2-CD1 3.39Å; L76-I147 HydrophobicContact CD2-CG1 4.01Å; V80-I147 HydrophobicContact CG2-CD1 4.1Å; L142-I147 CarbonylContact C-O 3.42Å; L142-I147 HydrophobicContact CB-CB 4.26Å; L142-I147 WeakPolarHBondContact CB-O 3.37Å; L142-I147 HydrophobicContact CD2-CB 4.48Å; L142-I147 HydrophobicContact CD2-CD1 4.35Å; L142-I147 HydrophobicContact CD2-CG2 4.28Å; L142-I147 WeakPolarHBondContact O-CB 3.48Å; L142-I147 PolarHBondContact O-N 2.94Å; H143-I147 PolarHBondContact CD2-O 3.48Å; H143-I147 PolarHBondContact N-O 3.32Å; A145-I147 VanDerWaalsContact C-N 3.32Å; A145-I147 HydrophobicContact CB-CD1 3.67Å; A145-I147 HydrophobicContact CB-CG1 3.99Å; I147-A173 HydrophobicContact CG2-CB 3.63Å; I147-Y338 HydrophobicContact CG1-CG 4.42Å
148	I	89.6	Confident	90.8	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.005	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	129.9	171.7	-54.8	-178.2	0	0	0	108.8	R150 A173 R174 A176 Y202 E204 V206 D207	I148-R150 HydrophobicContact CB-CG 4.19Å; I148-R150 HydrophobicContact CG2-CG 3.56Å; I148-A173 CarbonylContact O-C 3.57Å; I148-A173 WeakPolarHBondContact O-CA 3.45Å; I148-A173 WeakPolarHBondContact O-CB 3.4Å; I148-R174 PolarHBondContact N-O 2.92Å; I148-R174 PolarHBondContact O-N 3.49Å; I148-A176 HydrophobicContact CD1-CB 3.71Å; I148-A176 HydrophobicContact CG1-CB 4.36Å; I148-Y202 HydrophobicContact CD1-CD2 4.11Å; I148-Y202 HydrophobicContact CD1-CE2 4.07Å; I148-E204 HydrophobicContact CD1-CG 4.29Å; I148-E204 HydrophobicContact CG1-CG 4.34Å; I148-V206 HydrophobicContact CG2-CG1 3.26Å; I148-D207 WeakPolarHBondContact CG2-OD2 3.42Å
149	H	89.2	Confident	90.8	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.091	C	C	.	.			trans	-73.3	-50.1	-172	-171.2	-72	0	0	0	112.8	L142 D151 L152 L168 D169 A173 D207	L142-H149 HydrophobicContact CD1-CB 4.45Å; H149-D151 VanDerWaalsContact CE1-C 3.45Å; H149-D151 PolarHBondContact CE1-O 3.22Å; H149-D151 VanDerWaalsContact ND1-C 3.32Å; H149-D151 PolarHBondContact ND1-N 3.35Å; H149-D151 PolarHBondContact O-N 3.27Å; H149-L152 HydrophobicContact CB-CD1 4.48Å; H149-L152 HydrophobicContact CB-CD2 4.41Å; H149-L152 HydrophobicContact CB-CG 4.01Å; H149-L152 PolarHBondContact ND1-N 3.47Å; H149-L152 VanDerWaalsContact ND1-N 3.17Å; H149-L168 PolarHBondContact NE2-O 2.81Å; H149-D169 PolarHBondContact NE2-O 3.43Å; H149-A173 WeakPolarHBondContact O-CA 3.5Å; H149-D207 PolarHBondContact N-OD2 3.05Å
150	R	86.3	Confident	90.8	Very high	16 Å²	16	18.2 Å²	18.2	6%	0.06	11%	0.105	C	C	.	.			trans	65.1	-16	175.6	-49.9	-175.2	-52.9	150.3	14.8	117.9	I148 L172 Y202 V206 D207	I148-R150 HydrophobicContact CB-CG 4.19Å; I148-R150 HydrophobicContact CG2-CG 3.56Å; R150-L172 PolarHBondContact NE-O 3.34Å; R150-L172 PolarHBondContact NH2-O 3.01Å; R150-Y202 VanDerWaalsContact CD-CE2 3.45Å; R150-Y202 WeakPolarHBondContact CD-OH 3.36Å; R150-Y202 HydrophobicContact CG-CE2 4.34Å; R150-Y202 PolarHBondContact NH1-OH 3.38Å; R150-V206 HydrophobicContact CG-CG1 4.23Å; R150-D207 PolarHBondContact N-OD1 3.09Å
151	D	85.9	Confident	90.5	Very high	7 Å²	7	21.5 Å²	21.5	4%	0.037	13%	0.134	C	C	.	.			trans	-123.4	38.1	175.5	-159.2	54.1	0	0	0	112.3	H149 K153 N156 L172	H149-D151 VanDerWaalsContact CE1-C 3.45Å; H149-D151 PolarHBondContact CE1-O 3.22Å; H149-D151 VanDerWaalsContact ND1-C 3.32Å; H149-D151 PolarHBondContact ND1-N 3.35Å; H149-D151 PolarHBondContact O-N 3.27Å; D151-K153 PolarHBondContact O-N 3.07Å; D151-K153 IonicContact OD2-NZ 3.26Å; D151-K153 PolarHBondContact OD2-NZ 3.11Å; D151-N156 PolarHBondContact O-ND2 2.77Å; D151-L172 HydrophobicContact CB-CB 4.04Å; D151-L172 HydrophobicContact CB-CD1 3.67Å; D151-L172 HydrophobicContact CB-CG 4.49Å
152	L	92.5	Very high	90.5	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.01	16%	0.158	C	C	.	.			trans	-66.8	128	173.3	-77.4	173.9	0	0	0	109.6	I139 H149 I167 Y191 D207 V211	I139-L152 HydrophobicContact CD1-CD1 3.44Å; I139-L152 VanDerWaalsContact CD1-CD1 3.44Å; I139-L152 HydrophobicContact CG1-CD1 3.81Å; H149-L152 HydrophobicContact CB-CD1 4.48Å; H149-L152 HydrophobicContact CB-CD2 4.41Å; H149-L152 HydrophobicContact CB-CG 4.01Å; H149-L152 PolarHBondContact ND1-N 3.47Å; H149-L152 VanDerWaalsContact ND1-N 3.17Å; L152-I167 HydrophobicContact CD2-CD1 4.41Å; L152-I167 HydrophobicContact CD2-CG2 3.88Å; L152-Y191 WeakPolarHBondContact O-CB 3.37Å; L152-D207 HydrophobicContact CD1-CB 3.78Å; L152-V211 HydrophobicContact CD1-CG2 4.38Å
153	K	91.4	Very high	90.6	Very high	21 Å²	21	27.5 Å²	27.5	9%	0.091	17%	0.168	C	C	.	.			trans	-159.4	159.5	179.7	61.8	-168.7	-179.3	-145.8	0	109.2	D151 S155 N156 Y191	D151-K153 PolarHBondContact O-N 3.07Å; D151-K153 IonicContact OD2-NZ 3.26Å; D151-K153 PolarHBondContact OD2-NZ 3.11Å; K153-S155 WeakPolarHBondContact CE-OG 3.42Å; K153-S155 WeakPolarHBondContact CG-OG 3.44Å; K153-S155 PolarHBondContact O-N 3.05Å; K153-S155 VanDerWaalsContact O-N 3.1Å; K153-N156 WeakPolarHBondContact CE-ND2 3.5Å; K153-N156 WeakPolarHBondContact CE-OD1 3.48Å; K153-N156 HydrophobicContact CG-CB 4.1Å; K153-N156 PolarHBondContact O-N 3.38Å; K153-Y191 HydrophobicContact CB-CD2 3.43Å; K153-Y191 VanDerWaalsContact CB-CD2 3.43Å; K153-Y191 HydrophobicContact CB-CE2 3.82Å; K153-Y191 HydrophobicContact CB-CG 4.02Å
154	P	93	Very high	90.8	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.006	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-56.2	-32.3	-175.7	-29.2	36.8	0	0	0	115	L115 I119 N156 I157 Y191 I214	L115-P154 HydrophobicContact CB-CB 3.97Å; L115-P154 WeakPolarHBondContact CB-O 3.45Å; L115-P154 PolarHBondContact N-O 2.73Å; L115-P154 VanDerWaalsContact N-O 3.16Å; I119-P154 HydrophobicContact CD1-CB 3.59Å; I119-P154 HydrophobicContact CD1-CG 3.45Å; I119-P154 VanDerWaalsContact CD1-CG 3.45Å; P154-N156 VanDerWaalsContact C-N 3.29Å; P154-N156 PolarHBondContact O-N 3.17Å; P154-I157 PolarHBondContact O-N 2.78Å; P154-Y191 VanDerWaalsContact CD-CE1 3.43Å; P154-Y191 WeakPolarHBondContact CD-OH 3.45Å; P154-Y191 HydrophobicContact CG-CE1 3.83Å; P154-Y191 HydrophobicContact CG-CE2 4.44Å; P154-Y191 WeakPolarHBondContact CG-OH 3.49Å; P154-I214 HydrophobicContact CG-CG1 4.15Å
155	S	88.9	Confident	91.1	Very high	53 Å²	53	25.3 Å²	25.3	37%	0.371	15%	0.154	S	C	.	.	G	3₁₀ helix	trans	-72	-18.7	177.2	44.9	0	0	0	0	114.6	C116 K153	C116-S155 PolarHBondContact SG-N 3.34Å; K153-S155 WeakPolarHBondContact CE-OG 3.42Å; K153-S155 WeakPolarHBondContact CG-OG 3.44Å; K153-S155 PolarHBondContact O-N 3.05Å; K153-S155 VanDerWaalsContact O-N 3.1Å
156	N	91.6	Very high	91.7	Very high	15 Å²	15	26.1 Å²	26.1	8%	0.08	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-97.6	12.1	175.8	-74	6.1	0	0	0	112.1	D151 K153 P154 L168 D169	D151-N156 PolarHBondContact O-ND2 2.77Å; K153-N156 WeakPolarHBondContact CE-ND2 3.5Å; K153-N156 WeakPolarHBondContact CE-OD1 3.48Å; K153-N156 HydrophobicContact CG-CB 4.1Å; K153-N156 PolarHBondContact O-N 3.38Å; P154-N156 VanDerWaalsContact C-N 3.29Å; P154-N156 PolarHBondContact O-N 3.17Å; N156-L168 WeakPolarHBondContact O-CB 3.4Å; N156-L168 PolarHBondContact O-N 2.8Å; N156-D169 PolarHBondContact ND2-OD2 3.48Å
157	I	94	Very high	92.1	Very high	1 Å²	1	25 Å²	25	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	124.3	178.1	-61.8	178.1	0	0	0	107.2	N114 L115 M135 P154 L165 I214	N114-I157 CarbonylContact C-O 3.57Å; N114-I157 VanDerWaalsContact CA-O 3.24Å; N114-I157 WeakPolarHBondContact CA-O 3.45Å; N114-I157 WeakPolarHBondContact CB-O 3.4Å; L115-I157 HydrophobicContact CB-CB 4.08Å; L115-I157 HydrophobicContact CB-CG2 4.16Å; L115-I157 HydrophobicContact CD2-CB 4.38Å; L115-I157 HydrophobicContact CD2-CD1 4.26Å; L115-I157 HydrophobicContact CD2-CG2 4.17Å; L115-I157 PolarHBondContact N-O 3.06Å; M135-I157 HydrophobicContact CG-CD1 4.18Å; M135-I157 HydrophobicContact SD-CD1 3.61Å; P154-I157 PolarHBondContact O-N 2.78Å; I157-L165 HydrophobicContact CG2-CD1 3.42Å; I157-L165 VanDerWaalsContact CG2-CD1 3.42Å; I157-L165 HydrophobicContact CG2-CD2 3.91Å; I157-L165 HydrophobicContact CG2-CG 3.57Å; I157-I214 HydrophobicContact CD1-CD1 3.69Å
158	V	94.8	Very high	92.3	Very high	16 Å²	16	26.6 Å²	26.6	10%	0.097	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	148	-177.6	-73.7	0	0	0	0	111.2	M111 A113 N114 L165 K166 L168	M111-V158 HydrophobicContact CB-CB 3.7Å; M111-V158 HydrophobicContact CB-CG1 4.44Å; M111-V158 HydrophobicContact CB-CG2 3.95Å; M111-V158 HydrophobicContact CE-CG2 4.25Å; M111-V158 HydrophobicContact CG-CB 3.92Å; M111-V158 HydrophobicContact CG-CG2 3.55Å; A113-V158 CarbonylContact O-C 3.58Å; A113-V158 VanDerWaalsContact O-CA 3.26Å; A113-V158 WeakPolarHBondContact O-CA 3.27Å; A113-V158 WeakPolarHBondContact O-CB 3.43Å; N114-V158 HydrophobicContact CB-CG1 4.17Å; V158-L165 CarbonylContact O-C 3.51Å; V158-L165 WeakPolarHBondContact O-CA 3.36Å; V158-K166 HydrophobicContact CG2-CB 4.09Å; V158-K166 VanDerWaalsContact CG2-O 3.31Å; V158-K166 WeakPolarHBondContact CG2-O 3.27Å; V158-K166 PolarHBondContact N-O 2.71Å; V158-K166 PolarHBondContact O-N 2.84Å; V158-L168 HydrophobicContact CB-CD1 4.47Å; V158-L168 HydrophobicContact CG1-CD1 3.52Å; V158-L168 HydrophobicContact CG1-CG 4.1Å; V158-L168 HydrophobicContact CG2-CD1 4.15Å; V158-L168 HydrophobicContact CG2-CD2 3.7Å; V158-L168 HydrophobicContact CG2-CG 3.81Å
159	V	96.1	Very high	91.5	Very high	9 Å²	9	27.4 Å²	27.4	6%	0.055	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	158.3	-176.6	-58.5	0	0	0	0	111.7	D112 A113 L115 V118 L131 T164 L165	D112-V159 PolarHBondContact N-O 3.33Å; A113-V159 HydrophobicContact CB-CG2 4.02Å; A113-V159 PolarHBondContact N-O 2.83Å; A113-V159 VanDerWaalsContact N-O 3.14Å; A113-V159 PolarHBondContact O-N 3.27Å; L115-V159 HydrophobicContact CD1-CG1 4.16Å; V118-V159 HydrophobicContact CG2-CG2 3.5Å; V118-V159 VanDerWaalsContact CG2-CG2 3.5Å; L131-V159 HydrophobicContact CD2-CG1 3.91Å; V159-T164 CarbonylContact C-O 3.53Å; V159-T164 WeakPolarHBondContact CA-O 3.39Å; V159-L165 HydrophobicContact CG1-CB 4.23Å; V159-L165 HydrophobicContact CG1-CD1 4.27Å; V159-L165 HydrophobicContact CG1-CG 4.31Å
160	K	94.1	Very high	90.5	Very high	71 Å²	71	27.4 Å²	27.4	31%	0.309	16%	0.157	S	C	.	.			trans	-107	168	164.9	-74	177.2	174.9	171.8	0	111.5	L110 M111 D112 D162 C163 T164	L110-K160 WeakPolarHBondContact O-CE 3.43Å; M111-K160 HydrophobicContact CE-CD 4.41Å; M111-K160 HydrophobicContact CE-CG 3.81Å; M111-K160 HydrophobicContact SD-CD 4.08Å; M111-K160 VanDerWaalsContact SD-CE 3.56Å; M111-K160 HydrophobicContact SD-CG 3.81Å; D112-K160 WeakPolarHBondContact OD2-CA 3.42Å; D112-K160 WeakPolarHBondContact OD2-CB 3.43Å; K160-D162 WeakPolarHBondContact CB-OD1 3.28Å; K160-D162 PolarHBondContact O-N 3.19Å; K160-C163 PolarHBondContact O-N 2.91Å; K160-T164 WeakPolarHBondContact CB-OG1 3.38Å; K160-T164 PolarHBondContact N-O 3.46Å
161	S	90.8	Very high	89	Confident	113 Å²	113	26.7 Å²	26.7	79%	0.79	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	-23.6	177	62.7	0	0	0	0	114	D112 C163	D112-S161 PolarHBondContact OD2-N 2.99Å; S161-C163 PolarHBondContact O-N 3.09Å
162	D	93	Very high	87.6	Confident	99 Å²	99	27.4 Å²	27.4	53%	0.529	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	11.5	175.1	67.7	-2.6	0	0	0	113.6	K160 T164	K160-D162 WeakPolarHBondContact CB-OD1 3.28Å; K160-D162 PolarHBondContact O-N 3.19Å; D162-T164 PolarHBondContact O-N 3.35Å; D162-T164 WeakPolarHBondContact OD1-CB 2.94Å; D162-T164 VanDerWaalsContact OD1-CG2 3.27Å; D162-T164 WeakPolarHBondContact OD1-CG2 3.43Å; D162-T164 PolarHBondContact OD1-N 3.31Å; D162-T164 PolarHBondContact OD1-OG1 2.73Å
163	C	92.9	Very high	85.9	Confident	33 Å²	33	27.3 Å²	27.3	22%	0.223	16%	0.158	C	C	.	.			trans	63.9	16	-175.8	-62.4	0	0	0	0	115	Y130 Q134 K160 S161	Y130-C163 HydrophobicContact CD1-CB 4.11Å; Y130-C163 HydrophobicContact CE1-CB 4.35Å; Q134-C163 PolarHBondContact NE2-O 3.06Å; K160-C163 PolarHBondContact O-N 2.91Å; S161-C163 PolarHBondContact O-N 3.09Å
164	T	95.6	Very high	84.2	Confident	38 Å²	38	29 Å²	29	23%	0.233	16%	0.164	C	C	.	.			trans	-71.1	140.3	168.3	58	0	0	0	0	110.7	V159 K160 D162	V159-T164 CarbonylContact C-O 3.53Å; V159-T164 WeakPolarHBondContact CA-O 3.39Å; K160-T164 WeakPolarHBondContact CB-OG1 3.38Å; K160-T164 PolarHBondContact N-O 3.46Å; D162-T164 PolarHBondContact O-N 3.35Å; D162-T164 WeakPolarHBondContact OD1-CB 2.94Å; D162-T164 VanDerWaalsContact OD1-CG2 3.27Å; D162-T164 WeakPolarHBondContact OD1-CG2 3.43Å; D162-T164 PolarHBondContact OD1-N 3.31Å; D162-T164 PolarHBondContact OD1-OG1 2.73Å
165	L	97.4	Very high	82.2	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	-125.9	139.3	-174.5	178.3	153.1	0	0	0	111.5	N84 L131 Q134 M135 I157 V158 V159 I167	N84-L165 VanDerWaalsContact CA-O 3.3Å; N84-L165 WeakPolarHBondContact CA-O 3.29Å; N84-L165 PolarHBondContact ND2-O 2.85Å; L131-L165 HydrophobicContact CB-CD1 4.25Å; L131-L165 HydrophobicContact CD2-CB 4.15Å; L131-L165 HydrophobicContact CD2-CD1 3.89Å; Q134-L165 HydrophobicContact CB-CB 3.98Å; Q134-L165 HydrophobicContact CB-CD2 4.28Å; M135-L165 HydrophobicContact CE-CD1 4.2Å; M135-L165 HydrophobicContact CG-CD1 3.59Å; M135-L165 HydrophobicContact CG-CD2 3.77Å; M135-L165 HydrophobicContact CG-CG 4.38Å; M135-L165 HydrophobicContact SD-CD1 4.39Å; I157-L165 HydrophobicContact CG2-CD1 3.42Å; I157-L165 VanDerWaalsContact CG2-CD1 3.42Å; I157-L165 HydrophobicContact CG2-CD2 3.91Å; I157-L165 HydrophobicContact CG2-CG 3.57Å; V158-L165 CarbonylContact O-C 3.51Å; V158-L165 WeakPolarHBondContact O-CA 3.36Å; V159-L165 HydrophobicContact CG1-CB 4.23Å; V159-L165 HydrophobicContact CG1-CD1 4.27Å; V159-L165 HydrophobicContact CG1-CG 4.31Å; L165-I167 HydrophobicContact CD2-CG1 4.34Å
166	K	96.3	Very high	79.9	Confident	22 Å²	22	28.6 Å²	28.6	10%	0.096	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	138.4	173	-73.7	168.7	175.5	-92.7	0	112.3	K83 N84 I85 I86 E109 M111 V158	K83-K166 WeakPolarHBondContact O-CE 3.39Å; K83-K166 VanDerWaalsContact O-CG 3.22Å; K83-K166 WeakPolarHBondContact O-CG 3.44Å; K83-K166 PolarHBondContact O-NZ 2.93Å; N84-K166 WeakPolarHBondContact O-CA 3.47Å; I85-K166 PolarHBondContact O-NZ 2.99Å; I86-K166 HydrophobicContact CD1-CD 4.33Å; E109-K166 HydrophobicContact CG-CD 4.27Å; E109-K166 WeakPolarHBondContact OE1-CD 3.3Å; E109-K166 WeakPolarHBondContact OE1-CE 3.46Å; E109-K166 IonicContact OE1-NZ 3.38Å; E109-K166 PolarHBondContact OE1-NZ 3.08Å; E109-K166 WeakPolarHBondContact OE2-CD 3.41Å; E109-K166 WeakPolarHBondContact OE2-CE 3.47Å; E109-K166 IonicContact OE2-NZ 2.71Å; E109-K166 PolarHBondContact OE2-NZ 3.43Å; M111-K166 HydrophobicContact CE-CB 4.2Å; M111-K166 HydrophobicContact CE-CD 4.05Å; M111-K166 HydrophobicContact CE-CG 4.25Å; M111-K166 HydrophobicContact SD-CD 3.92Å; V158-K166 HydrophobicContact CG2-CB 4.09Å; V158-K166 VanDerWaalsContact CG2-O 3.31Å; V158-K166 WeakPolarHBondContact CG2-O 3.27Å; V158-K166 PolarHBondContact N-O 2.71Å; V158-K166 PolarHBondContact O-N 2.84Å
167	I	95.2	Very high	76.9	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	135	173.9	-59.8	172.5	0	0	0	109.5	N84 I86 I139 L152 L165 F170	N84-I167 PolarHBondContact O-N 2.79Å; I86-I167 WeakPolarHBondContact CG2-O 3.4Å; I86-I167 PolarHBondContact N-O 3.32Å; I139-I167 HydrophobicContact CG1-CD1 3.94Å; L152-I167 HydrophobicContact CD2-CD1 4.41Å; L152-I167 HydrophobicContact CD2-CG2 3.88Å; L165-I167 HydrophobicContact CD2-CG1 4.34Å; I167-F170 HydrophobicContact CG2-CE1 4.32Å
168	L	89.1	Confident	74.1	Confident	38 Å²	38	33.3 Å²	33.3	20%	0.199	20%	0.195	C	C	.	.			trans	-105.4	171.4	175.8	-58.2	-177.1	0	0	0	112.2	I86 H149 N156 V158	I86-L168 HydrophobicContact CB-CD2 3.65Å; I86-L168 HydrophobicContact CD1-CD2 3.89Å; I86-L168 HydrophobicContact CG1-CD2 3.7Å; I86-L168 HydrophobicContact CG2-CD2 3.79Å; H149-L168 PolarHBondContact NE2-O 2.81Å; N156-L168 WeakPolarHBondContact O-CB 3.4Å; N156-L168 PolarHBondContact O-N 2.8Å; V158-L168 HydrophobicContact CB-CD1 4.47Å; V158-L168 HydrophobicContact CG1-CD1 3.52Å; V158-L168 HydrophobicContact CG1-CG 4.1Å; V158-L168 HydrophobicContact CG2-CD1 4.15Å; V158-L168 HydrophobicContact CG2-CD2 3.7Å; V158-L168 HydrophobicContact CG2-CG 3.81Å
169	D	73.6	Confident	71.3	Confident	18 Å²	18	38.5 Å²	38.5	10%	0.096	22%	0.222	C	C	.	.			trans	58.1	80.9	158	-173.2	11.4	0	0	0	116.4	Q37 H149 N156 G171	Q37-D169 PolarHBondContact NE2-OD1 2.9Å; Q37-D169 PolarHBondContact NE2-OD2 3.47Å; Q37-D169 VanDerWaalsContact OE1-CG 3.28Å; Q37-D169 PolarHBondContact OE1-OD1 2.88Å; Q37-D169 VanDerWaalsContact OE1-OD1 3.11Å; Q37-D169 PolarHBondContact OE1-OD2 3.38Å; H149-D169 PolarHBondContact NE2-O 3.43Å; N156-D169 PolarHBondContact ND2-OD2 3.48Å; D169-G171 VanDerWaalsContact C-N 3.26Å; D169-G171 PolarHBondContact O-N 3.01Å; D169-G171 PolarHBondContact OD1-N 2.8Å
170	F	68.2	Low	68.3	Low	1 Å²	1	45.6 Å²	45.6	0%	0.004	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-84.3	10.7	172	-50.8	-65.9	0	0	0	114.1	L76 L77 I85 I86 L142 I167 L172 A173	L76-F170 HydrophobicContact CB-CB 4.09Å; L76-F170 HydrophobicContact CB-CD2 4.25Å; L76-F170 HydrophobicContact CB-CG 4.32Å; L76-F170 HydrophobicContact CD1-CB 3.49Å; L76-F170 VanDerWaalsContact CD1-CB 3.49Å; L76-F170 HydrophobicContact CD1-CG 4.26Å; L76-F170 HydrophobicContact CG-CB 4.43Å; L77-F170 HydrophobicContact CD2-CD2 4.17Å; L77-F170 HydrophobicContact CD2-CE2 3.99Å; L77-F170 HydrophobicContact CG-CD2 4.4Å; I85-F170 HydrophobicContact CG2-CE2 3.81Å; I85-F170 HydrophobicContact CG2-CZ 3.43Å; I85-F170 VanDerWaalsContact CG2-CZ 3.43Å; I86-F170 HydrophobicContact CG2-CE2 4.48Å; L142-F170 HydrophobicContact CD1-CD1 4.31Å; L142-F170 HydrophobicContact CD1-CE1 3.62Å; L142-F170 HydrophobicContact CD2-CD1 4.03Å; L142-F170 HydrophobicContact CD2-CE1 3.54Å; L142-F170 HydrophobicContact CD2-CZ 4.11Å; L142-F170 HydrophobicContact CG-CE1 4.2Å; I167-F170 HydrophobicContact CG2-CE1 4.32Å; F170-L172 PolarHBondContact O-N 2.8Å; F170-L172 VanDerWaalsContact O-N 3.09Å; F170-A173 HydrophobicContact CB-CB 4Å; F170-A173 VanDerWaalsContact O-CB 3.27Å; F170-A173 WeakPolarHBondContact O-CB 3.2Å; F170-A173 PolarHBondContact O-N 2.89Å
171	G	54.9	Low	65.3	Low	1 Å²	1	50.6 Å²	50.6	1%	0.01	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-64.5	-18.9	-173.9	0	0	0	0	0	114.3	R69 D169	R69-G171 WeakPolarHBondContact CG-O 3.41Å; R69-G171 PolarHBondContact NE-O 3.19Å; D169-G171 VanDerWaalsContact C-N 3.26Å; D169-G171 PolarHBondContact O-N 3.01Å; D169-G171 PolarHBondContact OD1-N 2.8Å
172	L	57	Low	62.7	Low	21 Å²	21	48.2 Å²	48.2	11%	0.11	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-109.1	-4.7	173.5	-70.7	176.3	0	0	0	113.7	R69 R150 D151 F170 M182	R69-L172 VanDerWaalsContact NH2-CD2 3.26Å; R150-L172 PolarHBondContact NE-O 3.34Å; R150-L172 PolarHBondContact NH2-O 3.01Å; D151-L172 HydrophobicContact CB-CB 4.04Å; D151-L172 HydrophobicContact CB-CD1 3.67Å; D151-L172 HydrophobicContact CB-CG 4.49Å; F170-L172 PolarHBondContact O-N 2.8Å; F170-L172 VanDerWaalsContact O-N 3.09Å; L172-M182 HydrophobicContact CD1-CE 4.2Å; L172-M182 HydrophobicContact CD2-CE 4.16Å
173	A	55.2	Low	59.7	Low	1 Å²	1	48 Å²	48	1%	0.008	26%	0.259	C	S	.	.			trans	-58.6	143.8	177.5	0	0	0	0	0	109.8	R72 L76 I147 I148 H149 F170	R72-A173 WeakPolarHBondContact CD-O 3.48Å; R72-A173 PolarHBondContact NH1-O 2.9Å; L76-A173 HydrophobicContact CD1-CB 4.16Å; I147-A173 HydrophobicContact CG2-CB 3.63Å; I148-A173 CarbonylContact O-C 3.57Å; I148-A173 WeakPolarHBondContact O-CA 3.45Å; I148-A173 WeakPolarHBondContact O-CB 3.4Å; H149-A173 WeakPolarHBondContact O-CA 3.5Å; F170-A173 HydrophobicContact CB-CB 4Å; F170-A173 VanDerWaalsContact O-CB 3.27Å; F170-A173 WeakPolarHBondContact O-CB 3.2Å; F170-A173 PolarHBondContact O-N 2.89Å
174	R	57.5	Low	56.8	Low	57 Å²	57	51.4 Å²	51.4	22%	0.215	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	156	178.1	-74	-78.7	176.3	-68.7	5.7	110.8	R72 I148 T178 E343	R72-R174 VanDerWaalsContact NH1-CZ 3.3Å; I148-R174 PolarHBondContact N-O 2.92Å; I148-R174 PolarHBondContact O-N 3.49Å; R174-T178 WeakPolarHBondContact CD-OG1 3.41Å; R174-E343 WeakPolarHBondContact CA-OE1 3.38Å; R174-E343 WeakPolarHBondContact CD-OE2 3.15Å
175	T	51.2	Low	53.8	Low	14 Å²	14	57.5 Å²	57.5	9%	0.086	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	144.6	163	-50	0	0	0	0	109.5	G146 C177 T178 A340 E343	G146-T175 VanDerWaalsContact O-CA 3.28Å; G146-T175 WeakPolarHBondContact O-CA 3.5Å; T175-C177 PolarHBondContact O-N 3.12Å; T175-T178 PolarHBondContact O-N 3.07Å; T175-T178 PolarHBondContact O-OG1 2.95Å; T175-A340 HydrophobicContact CG2-CB 3.83Å; T175-E343 PolarHBondContact N-OE1 3.23Å; T175-E343 PolarHBondContact N-OE2 2.88Å
176	A	38.9	Very low	51	Low	31 Å²	31	64.2 Å²	64.2	26%	0.256	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-21.3	-179.7	0	0	0	0	0	114.3	I148	I148-A176 HydrophobicContact CD1-CB 3.71Å; I148-A176 HydrophobicContact CG1-CB 4.36Å
177	C	28.5	Very low	49.4	Very low	99 Å²	99	65.8 Å²	65.8	67%	0.669	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-9.4	-175.9	-59.8	0	0	0	0	115.7	T175	T175-C177 PolarHBondContact O-N 3.12Å
178	T	36.5	Very low	48.3	Very low	15 Å²	15	68.7 Å²	68.7	9%	0.092	37%	0.37	C	S	.	.			trans	-99.3	99.8	-170.9	55.2	0	0	0	0	114.1	R174 T175 F180 Y202 E343	R174-T178 WeakPolarHBondContact CD-OG1 3.41Å; T175-T178 PolarHBondContact O-N 3.07Å; T175-T178 PolarHBondContact O-OG1 2.95Å; T178-F180 VanDerWaalsContact C-N 3.28Å; T178-F180 PolarHBondContact O-N 3.32Å; T178-Y202 PolarHBondContact O-OH 3.07Å; T178-Y202 VanDerWaalsContact O-OH 3.1Å; T178-E343 HydrophobicContact CG2-CB 4.07Å; T178-E343 WeakPolarHBondContact CG2-OE2 3.37Å; T178-E343 PolarHBondContact OG1-OE2 2.77Å
179	N	35.4	Very low	48.2	Very low	126 Å²	126	68.4 Å²	68.4	67%	0.674	37%	0.366	S	S	*	.			trans	-79.7	52.9	177.1	-84.5	-19.4	0	0	0	114
180	F	32.7	Very low	49.2	Very low	158 Å²	158	70.1 Å²	70.1	69%	0.693	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-88.9	128.6	177.9	-97.6	-87.7	0	0	0	113.3	T178 M182	T178-F180 VanDerWaalsContact C-N 3.28Å; T178-F180 PolarHBondContact O-N 3.32Å; F180-M182 PolarHBondContact O-N 3.24Å
181	M	31.3	Very low	50.4	Low	176 Å²	176	71 Å²	71	87%	0.867	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-59.7	127.8	168.4	-74.1	-173.8	-88.9	0	0	110.6
182	M	36	Very low	52.2	Low	63 Å²	63	71.7 Å²	71.7	31%	0.31	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-71.1	135.3	171.5	-99.1	-164	168.7	0	0	110.7	L172 F180	L172-M182 HydrophobicContact CD1-CE 4.2Å; L172-M182 HydrophobicContact CD2-CE 4.16Å; F180-M182 PolarHBondContact O-N 3.24Å
183	T	31.1	Very low	54	Low	95 Å²	95	70.7 Å²	70.7	58%	0.583	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-66.7	137.2	162	29	0	0	0	0	109.8	Y185	T183-Y185 VanDerWaalsContact C-N 3.29Å; T183-Y185 PolarHBondContact O-N 2.83Å
184	P	31	Very low	55.9	Low	104 Å²	104	70.7 Å²	70.7	68%	0.675	37%	0.372	S	S	*	.			trans	-72.2	84.8	176.3	29	-32.3	0	0	0	109.6
185	Y	32.6	Very low	57.6	Low	166 Å²	166	68 Å²	68	65%	0.651	36%	0.362	S	S	*	.			trans	-94.7	138.7	166.6	-86.9	-87.5	0	0	0	110.2	T183 V187	T183-Y185 VanDerWaalsContact C-N 3.29Å; T183-Y185 PolarHBondContact O-N 2.83Å; Y185-V187 PolarHBondContact O-N 3.32Å
186	V	39.6	Very low	59.5	Low	141 Å²	141	68.7 Å²	68.7	86%	0.855	37%	0.367	S	S	*	.	S	Bend	trans	-65	79.6	178.4	-174.5	0	0	0	0	109.7
187	V	62.3	Low	62	Low	56 Å²	56	68.3 Å²	68.3	34%	0.339	36%	0.36	S	S	.	.	S	Bend	trans	-131	148.6	174.5	-174.8	0	0	0	0	107.4	Y185 R189	Y185-V187 PolarHBondContact O-N 3.32Å; V187-R189 PolarHBondContact O-N 3.42Å; V187-R189 VanDerWaalsContact O-N 3.09Å
188	T	71.1	Confident	65	Low	62 Å²	62	64.3 Å²	64.3	38%	0.38	33%	0.332	S	S	.	.			trans	-46.4	115.2	175.8	-49.7	0	0	0	0	111	Y190 Y191	T188-Y190 HydrophobicContact CG2-CD2 3.38Å; T188-Y190 HydrophobicContact CG2-CE2 3.75Å; T188-Y190 HydrophobicContact CG2-CG 3.93Å; T188-Y191 HydrophobicContact CG2-CD2 4.39Å; T188-Y191 HydrophobicContact CG2-CE2 4Å
189	R	86.9	Confident	67.4	Low	31 Å²	31	66 Å²	66	12%	0.117	35%	0.352	C	S	.	.			trans	-104.4	-2.1	-175.5	67	-176.8	65	85.1	-3.4	114	V187 Y191 R192 G227 T228 D229 Q233	V187-R189 PolarHBondContact O-N 3.42Å; V187-R189 VanDerWaalsContact O-N 3.09Å; R189-Y191 PolarHBondContact O-N 2.92Å; R189-Y191 VanDerWaalsContact O-N 3.08Å; R189-R192 WeakPolarHBondContact O-CB 3.4Å; R189-R192 PolarHBondContact O-N 2.82Å; R189-G227 PolarHBondContact NH1-O 3.33Å; R189-T228 PolarHBondContact NH1-O 2.87Å; R189-D229 VanDerWaalsContact CD-O 3.32Å; R189-D229 WeakPolarHBondContact CD-O 3.02Å; R189-Q233 HydrophobicContact CG-CB 4.31Å; R189-Q233 HydrophobicContact CG-CG 4.17Å
190	Y	94.4	Very high	70	Confident	54 Å²	54	61.3 Å²	61.3	21%	0.212	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-26.2	-167.2	-51.6	-33.7	0	0	0	114.4	T188 V223 F225 Q226 G227 Q233	T188-Y190 HydrophobicContact CG2-CD2 3.38Å; T188-Y190 HydrophobicContact CG2-CE2 3.75Å; T188-Y190 HydrophobicContact CG2-CG 3.93Å; Y190-V223 HydrophobicContact CD1-CG1 4.48Å; Y190-V223 HydrophobicContact CD2-CB 4.46Å; Y190-V223 HydrophobicContact CD2-CG1 3.67Å; Y190-V223 HydrophobicContact CD2-CG2 4.05Å; Y190-V223 HydrophobicContact CE2-CG1 4.48Å; Y190-V223 HydrophobicContact CG-CG1 3.68Å; Y190-F225 WeakPolarHBondContact CB-O 3.19Å; Y190-F225 WeakPolarHBondContact CD1-O 3.43Å; Y190-Q226 HydrophobicContact CD1-CG 4.49Å; Y190-Q226 HydrophobicContact CE1-CB 4.44Å; Y190-Q226 HydrophobicContact CE1-CG 3.85Å; Y190-Q226 HydrophobicContact CE2-CG 4.23Å; Y190-G227 WeakPolarHBondContact CE1-O 3.3Å; Y190-Q233 PolarHBondContact O-NE2 2.98Å
191	Y	95.1	Very high	72.6	Confident	19 Å²	19	56 Å²	56	8%	0.075	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	1.6	-177.6	-47.1	-85	0	0	0	113.2	L152 K153 P154 T188 R189 S210 C213 I214 E217	L152-Y191 WeakPolarHBondContact O-CB 3.37Å; K153-Y191 HydrophobicContact CB-CD2 3.43Å; K153-Y191 VanDerWaalsContact CB-CD2 3.43Å; K153-Y191 HydrophobicContact CB-CE2 3.82Å; K153-Y191 HydrophobicContact CB-CG 4.02Å; P154-Y191 VanDerWaalsContact CD-CE1 3.43Å; P154-Y191 WeakPolarHBondContact CD-OH 3.45Å; P154-Y191 HydrophobicContact CG-CE1 3.83Å; P154-Y191 HydrophobicContact CG-CE2 4.44Å; P154-Y191 WeakPolarHBondContact CG-OH 3.49Å; T188-Y191 HydrophobicContact CG2-CD2 4.39Å; T188-Y191 HydrophobicContact CG2-CE2 4Å; R189-Y191 PolarHBondContact O-N 2.92Å; R189-Y191 VanDerWaalsContact O-N 3.08Å; Y191-S210 WeakPolarHBondContact O-CA 3.31Å; Y191-S210 WeakPolarHBondContact O-CB 3.38Å; Y191-S210 PolarHBondContact O-OG 3.28Å; Y191-C213 HydrophobicContact CD1-CB 3.68Å; Y191-C213 HydrophobicContact CE1-CB 4.43Å; Y191-I214 HydrophobicContact CD1-CG1 3.91Å; Y191-I214 HydrophobicContact CE1-CG1 4.13Å; Y191-E217 WeakPolarHBondContact CE1-OE2 3.47Å; Y191-E217 PolarHBondContact OH-OE1 2.92Å; Y191-E217 PolarHBondContact OH-OE2 3.39Å
192	R	92.7	Very high	75.3	Confident	16 Å²	16	49 Å²	49	6%	0.06	28%	0.28	C	S	.	.			trans	-75.9	136.3	180	-67.7	-176.6	179.9	172.6	0.3	110.1	R189 V196 I197 W209	R189-R192 WeakPolarHBondContact O-CB 3.4Å; R189-R192 PolarHBondContact O-N 2.82Å; R192-V196 HydrophobicContact CB-CG1 4.48Å; R192-I197 HydrophobicContact CB-CD1 4.4Å; R192-I197 HydrophobicContact CB-CG1 4.12Å; R192-I197 WeakPolarHBondContact O-CD1 3.46Å; R192-W209 PolarHBondContact O-NE1 3.21Å; R192-W209 VanDerWaalsContact O-NE1 3.09Å
193	A	94.9	Very high	77.8	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.008	28%	0.28	C	S	.	.			trans	-67.6	153.6	178.4	0	0	0	0	0	112.5	E195 V196 I197 V206 W209	A193-E195 VanDerWaalsContact C-N 3.28Å; A193-E195 VanDerWaalsContact CB-CD 3.41Å; A193-E195 HydrophobicContact CB-CG 4.17Å; A193-E195 WeakPolarHBondContact CB-OE1 3.39Å; A193-E195 WeakPolarHBondContact CB-OE2 3.47Å; A193-E195 PolarHBondContact O-N 3.29Å; A193-V196 HydrophobicContact CB-CG2 4.37Å; A193-V196 WeakPolarHBondContact O-CB 3.24Å; A193-V196 PolarHBondContact O-N 2.98Å; A193-I197 PolarHBondContact O-N 2.77Å; A193-I197 VanDerWaalsContact O-N 3.07Å; A193-V206 HydrophobicContact CB-CG2 3.56Å; A193-W209 HydrophobicContact CB-CB 3.71Å; A193-W209 HydrophobicContact CB-CD2 4.41Å; A193-W209 HydrophobicContact CB-CG 3.72Å
194	P	94.7	Very high	80.7	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-49.5	-44.9	175.4	-35.1	41.4	0	0	0	114.2	V196 I197 L198 W209 W234 V237 I304	P194-V196 PolarHBondContact O-N 3.27Å; P194-I197 PolarHBondContact O-N 3.16Å; P194-I197 VanDerWaalsContact O-N 3.16Å; P194-L198 VanDerWaalsContact O-CB 3.3Å; P194-L198 WeakPolarHBondContact O-CB 3.48Å; P194-L198 VanDerWaalsContact O-CG 3.27Å; P194-L198 WeakPolarHBondContact O-CG 3.41Å; P194-L198 PolarHBondContact O-N 2.95Å; P194-W209 VanDerWaalsContact CD-CD2 3.48Å; P194-W209 HydrophobicContact CG-CD2 4.37Å; P194-W209 HydrophobicContact CG-CE3 4.12Å; P194-W209 HydrophobicContact CG-CH2 3.67Å; P194-W209 HydrophobicContact CG-CZ2 3.95Å; P194-W209 HydrophobicContact CG-CZ3 3.76Å; P194-W234 HydrophobicContact CB-CZ3 3.95Å; P194-W234 HydrophobicContact CG-CZ3 4.44Å; P194-V237 HydrophobicContact CG-CG1 4.47Å; P194-I304 HydrophobicContact CB-CG2 4.09Å; P194-I304 HydrophobicContact CG-CB 4.49Å; P194-I304 HydrophobicContact CG-CG1 4.49Å; P194-I304 HydrophobicContact CG-CG2 4.17Å
195	E	93.5	Very high	83.8	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.5	-31.9	178.9	59	-88.7	-153.6	0	0	112.5	A193 G199 M200 V206 R309	A193-E195 VanDerWaalsContact C-N 3.28Å; A193-E195 VanDerWaalsContact CB-CD 3.41Å; A193-E195 HydrophobicContact CB-CG 4.17Å; A193-E195 WeakPolarHBondContact CB-OE1 3.39Å; A193-E195 WeakPolarHBondContact CB-OE2 3.47Å; A193-E195 PolarHBondContact O-N 3.29Å; E195-G199 PolarHBondContact O-N 2.94Å; E195-M200 HydrophobicContact CB-CB 3.89Å; E195-M200 HydrophobicContact CB-CG 4.46Å; E195-M200 HydrophobicContact CB-SD 4.06Å; E195-M200 PolarHBondContact O-N 3.49Å; E195-V206 HydrophobicContact CG-CG2 4.28Å; E195-R309 IonicContact OE1-CZ 2.66Å; E195-R309 IonicContact OE1-NH1 3.39Å; E195-R309 PolarHBondContact OE1-NH1 3.26Å; E195-R309 IonicContact OE1-NH2 2.86Å; E195-R309 PolarHBondContact OE1-NH2 2.9Å; E195-R309 IonicContact OE2-CZ 3.47Å; E195-R309 IonicContact OE2-NH1 2.73Å; E195-R309 IonicContact OE2-NH2 3.32Å; E195-R309 PolarHBondContact OE2-NH2 3.4Å
196	V	90.4	Very high	86.8	Confident	30 Å²	30	36.2 Å²	36.2	18%	0.182	21%	0.21	C	C	.	.	H	α-helix	trans	-74.4	-43.3	174.8	-179.7	0	0	0	0	110.7	R192 A193 P194 L198 G199 V206	R192-V196 HydrophobicContact CB-CG1 4.48Å; A193-V196 HydrophobicContact CB-CG2 4.37Å; A193-V196 WeakPolarHBondContact O-CB 3.24Å; A193-V196 PolarHBondContact O-N 2.98Å; P194-V196 PolarHBondContact O-N 3.27Å; V196-L198 VanDerWaalsContact C-N 3.34Å; V196-G199 PolarHBondContact O-N 3.08Å; V196-V206 HydrophobicContact CG2-CG2 3.49Å; V196-V206 VanDerWaalsContact CG2-CG2 3.49Å
197	I	90.4	Very high	89.5	Confident	22 Å²	22	29.5 Å²	29.5	11%	0.113	17%	0.169	C	C	.	.	H	α-helix	trans	-65.3	-39.4	179.7	-65.3	161.7	0	0	0	111.1	R192 A193 P194 H230 Q233	R192-I197 HydrophobicContact CB-CD1 4.4Å; R192-I197 HydrophobicContact CB-CG1 4.12Å; R192-I197 WeakPolarHBondContact O-CD1 3.46Å; A193-I197 PolarHBondContact O-N 2.77Å; A193-I197 VanDerWaalsContact O-N 3.07Å; P194-I197 PolarHBondContact O-N 3.16Å; P194-I197 VanDerWaalsContact O-N 3.16Å; I197-H230 HydrophobicContact CG2-CB 4.33Å; I197-Q233 HydrophobicContact CD1-CB 4.4Å; I197-Q233 HydrophobicContact CD1-CG 3.46Å; I197-Q233 VanDerWaalsContact CD1-CG 3.46Å; I197-Q233 HydrophobicContact CG1-CG 4.38Å
198	L	91.6	Very high	91.2	Very high	15 Å²	15	26.9 Å²	26.9	8%	0.079	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	0.3	-176.7	-62	176.9	0	0	0	113.6	P194 V196 M200 W234 F248 L252 V256 V260	P194-L198 VanDerWaalsContact O-CB 3.3Å; P194-L198 WeakPolarHBondContact O-CB 3.48Å; P194-L198 VanDerWaalsContact O-CG 3.27Å; P194-L198 WeakPolarHBondContact O-CG 3.41Å; P194-L198 PolarHBondContact O-N 2.95Å; V196-L198 VanDerWaalsContact C-N 3.34Å; L198-M200 VanDerWaalsContact C-N 3.33Å; L198-M200 HydrophobicContact CB-CG 4.18Å; L198-M200 HydrophobicContact CB-SD 4.37Å; L198-M200 HydrophobicContact CD1-SD 4.46Å; L198-M200 PolarHBondContact O-N 3.2Å; L198-W234 HydrophobicContact CD1-CD2 4.44Å; L198-W234 HydrophobicContact CD1-CE3 4.04Å; L198-W234 HydrophobicContact CD1-CH2 3.86Å; L198-W234 HydrophobicContact CD1-CZ2 4.26Å; L198-W234 HydrophobicContact CD1-CZ3 3.77Å; L198-W234 HydrophobicContact CD2-CD2 4.08Å; L198-W234 HydrophobicContact CD2-CE3 4.24Å; L198-W234 HydrophobicContact CD2-CG 4.37Å; L198-W234 HydrophobicContact CG-CE3 4.27Å; L198-W234 HydrophobicContact CG-CZ3 4.46Å; L198-F248 HydrophobicContact CD1-CE1 4.03Å; L198-F248 HydrophobicContact CD1-CZ 3.92Å; L198-L252 HydrophobicContact CB-CD2 4.09Å; L198-L252 HydrophobicContact CD1-CD2 3.83Å; L198-V256 HydrophobicContact CB-CG1 4.09Å; L198-V256 HydrophobicContact CD2-CG1 3.86Å; L198-V260 HydrophobicContact CD2-CG2 3.92Å
199	G	87.7	Confident	92.5	Very high	50 Å²	50	23.9 Å²	23.9	52%	0.515	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.2	33	178.3	0	0	0	0	0	113.9	E195 V196	E195-G199 PolarHBondContact O-N 2.94Å; V196-G199 PolarHBondContact O-N 3.08Å
200	M	90.5	Very high	93	Very high	28 Å²	28	22.5 Å²	22.5	14%	0.138	13%	0.13	C	C	.	.			trans	-82.2	164.2	172.6	-57.3	170.4	68.5	0	0	110.3	E195 L198 F248 K251 L252	E195-M200 HydrophobicContact CB-CB 3.89Å; E195-M200 HydrophobicContact CB-CG 4.46Å; E195-M200 HydrophobicContact CB-SD 4.06Å; E195-M200 PolarHBondContact O-N 3.49Å; L198-M200 VanDerWaalsContact C-N 3.33Å; L198-M200 HydrophobicContact CB-CG 4.18Å; L198-M200 HydrophobicContact CB-SD 4.37Å; L198-M200 HydrophobicContact CD1-SD 4.46Å; L198-M200 PolarHBondContact O-N 3.2Å; M200-F248 HydrophobicContact CE-CD2 4.41Å; M200-F248 HydrophobicContact CE-CE2 3.87Å; M200-F248 HydrophobicContact CE-CZ 4.28Å; M200-F248 HydrophobicContact SD-CE2 3.87Å; M200-F248 HydrophobicContact SD-CZ 3.74Å; M200-K251 HydrophobicContact CE-CB 3.81Å; M200-L252 HydrophobicContact CE-CD2 4.14Å; M200-L252 HydrophobicContact CG-CD2 3.61Å; M200-L252 HydrophobicContact SD-CD2 3.36Å; M200-L252 WeakPolarHBondContact SD-CD2 3.26Å
201	G	86.9	Confident	93.2	Very high	47 Å²	47	20 Å²	20	49%	0.485	12%	0.12	S	C	.	.			trans	-62.4	147.9	159.8	0	0	0	0	0	110.1
202	Y	87.4	Confident	93.3	Very high	28 Å²	28	19 Å²	19	11%	0.11	12%	0.116	C	C	.	.			trans	-129.1	162.7	-179.6	57.4	-97.6	0	0	0	110.4	I148 R150 T178 V206	I148-Y202 HydrophobicContact CD1-CD2 4.11Å; I148-Y202 HydrophobicContact CD1-CE2 4.07Å; R150-Y202 VanDerWaalsContact CD-CE2 3.45Å; R150-Y202 WeakPolarHBondContact CD-OH 3.36Å; R150-Y202 HydrophobicContact CG-CE2 4.34Å; R150-Y202 PolarHBondContact NH1-OH 3.38Å; T178-Y202 PolarHBondContact O-OH 3.07Å; T178-Y202 VanDerWaalsContact O-OH 3.1Å; Y202-V206 HydrophobicContact CD2-CG1 4.34Å
203	K	89.8	Confident	93.6	Very high	72 Å²	72	18.4 Å²	18.4	31%	0.313	11%	0.114	S	C	.	.			trans	-128.2	-178	174.4	68	-169.5	179.6	-171.2	0	109.6	N205 V206 P306 D307	K203-N205 VanDerWaalsContact CE-CG 3.47Å; K203-N205 VanDerWaalsContact CE-ND2 3.35Å; K203-N205 WeakPolarHBondContact CE-ND2 3.11Å; K203-N205 WeakPolarHBondContact CE-OD1 3.23Å; K203-N205 WeakPolarHBondContact CG-OD1 3.31Å; K203-N205 PolarHBondContact O-N 3.4Å; K203-N205 VanDerWaalsContact O-N 3.15Å; K203-V206 VanDerWaalsContact O-CB 3.31Å; K203-V206 WeakPolarHBondContact O-CB 3.12Å; K203-V206 VanDerWaalsContact O-CG1 3.23Å; K203-V206 WeakPolarHBondContact O-CG1 3.3Å; K203-V206 PolarHBondContact O-N 3.09Å; K203-P306 WeakPolarHBondContact CE-O 3.27Å; K203-P306 PolarHBondContact NZ-O 2.81Å; K203-D307 IonicContact NZ-OD1 3.46Å; K203-D307 PolarHBondContact NZ-OD1 3.12Å
204	E	91.7	Very high	93.7	Very high	79 Å²	79	18.3 Å²	18.3	37%	0.369	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-38.9	-174.3	-66.7	85.4	176.9	0	0	113.2	H143 I148 V206 D207	H143-E204 HydrophobicContact CB-CG 4.21Å; H143-E204 PolarHBondContact CE1-O 3.17Å; H143-E204 PolarHBondContact NE2-O 3.32Å; I148-E204 HydrophobicContact CD1-CG 4.29Å; I148-E204 HydrophobicContact CG1-CG 4.34Å; E204-V206 PolarHBondContact O-N 3.43Å; E204-D207 PolarHBondContact O-N 3.39Å
205	N	95.5	Very high	93.8	Very high	8 Å²	8	18.3 Å²	18.3	4%	0.043	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	7	179.9	77.9	-13.7	0	0	0	114.9	K203 D207 I208 P306 R309	K203-N205 VanDerWaalsContact CE-CG 3.47Å; K203-N205 VanDerWaalsContact CE-ND2 3.35Å; K203-N205 WeakPolarHBondContact CE-ND2 3.11Å; K203-N205 WeakPolarHBondContact CE-OD1 3.23Å; K203-N205 WeakPolarHBondContact CG-OD1 3.31Å; K203-N205 PolarHBondContact O-N 3.4Å; K203-N205 VanDerWaalsContact O-N 3.15Å; N205-D207 PolarHBondContact O-N 3.07Å; N205-I208 HydrophobicContact CB-CB 4.37Å; N205-I208 HydrophobicContact CB-CG1 4.25Å; N205-I208 WeakPolarHBondContact O-CB 3.33Å; N205-I208 PolarHBondContact O-N 3.02Å; N205-P306 PolarHBondContact ND2-O 3.4Å; N205-R309 PolarHBondContact ND2-O 3.06Å; N205-R309 WeakPolarHBondContact O-CD 3.1Å; N205-R309 PolarHBondContact O-NH1 2.66Å
206	V	95.3	Very high	94	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.012	11%	0.114	C	C	.	.	H	α-helix	trans	-58.5	-37.3	163.1	71.6	0	0	0	0	111.1	I148 R150 A193 E195 V196 Y202 K203 E204 I208 W209	I148-V206 HydrophobicContact CG2-CG1 3.26Å; R150-V206 HydrophobicContact CG-CG1 4.23Å; A193-V206 HydrophobicContact CB-CG2 3.56Å; E195-V206 HydrophobicContact CG-CG2 4.28Å; V196-V206 HydrophobicContact CG2-CG2 3.49Å; V196-V206 VanDerWaalsContact CG2-CG2 3.49Å; Y202-V206 HydrophobicContact CD2-CG1 4.34Å; K203-V206 VanDerWaalsContact O-CB 3.31Å; K203-V206 WeakPolarHBondContact O-CB 3.12Å; K203-V206 VanDerWaalsContact O-CG1 3.23Å; K203-V206 WeakPolarHBondContact O-CG1 3.3Å; K203-V206 PolarHBondContact O-N 3.09Å; E204-V206 PolarHBondContact O-N 3.43Å; V206-I208 VanDerWaalsContact C-N 3.29Å; V206-I208 PolarHBondContact O-N 3.49Å; V206-W209 WeakPolarHBondContact O-CB 3.48Å; V206-W209 PolarHBondContact O-N 3.08Å
207	D	96.3	Very high	94.3	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-70.7	-26.6	179.5	-71	-31.9	0	0	0	111.7	I139 H143 I148 H149 R150 L152 E204 N205 W209 S210 V211	I139-D207 HydrophobicContact CD1-CB 4.41Å; I139-D207 HydrophobicContact CG2-CB 3.99Å; H143-D207 IonicContact CD2-OD2 3.48Å; H143-D207 IonicContact CE1-OD2 2.66Å; H143-D207 IonicContact NE2-OD2 3.78Å; H143-D207 PolarHBondContact NE2-OD2 3.21Å; I148-D207 WeakPolarHBondContact CG2-OD2 3.42Å; H149-D207 PolarHBondContact N-OD2 3.05Å; R150-D207 PolarHBondContact N-OD1 3.09Å; L152-D207 HydrophobicContact CD1-CB 3.78Å; E204-D207 PolarHBondContact O-N 3.39Å; N205-D207 PolarHBondContact O-N 3.07Å; D207-W209 VanDerWaalsContact C-N 3.32Å; D207-W209 PolarHBondContact O-N 2.87Å; D207-S210 WeakPolarHBondContact O-CB 3.44Å; D207-S210 PolarHBondContact O-N 2.92Å; D207-V211 WeakPolarHBondContact O-CG2 3.46Å; D207-V211 PolarHBondContact O-N 2.91Å
208	I	98.4	Very high	94.5	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-65.3	-34.6	175.2	-69.1	-65.7	0	0	0	112	L136 N205 V206 S210 V211 G212 M301 R309 I310 V312 A315	L136-I208 HydrophobicContact CD2-CD1 3.47Å; L136-I208 VanDerWaalsContact CD2-CD1 3.47Å; N205-I208 HydrophobicContact CB-CB 4.37Å; N205-I208 HydrophobicContact CB-CG1 4.25Å; N205-I208 WeakPolarHBondContact O-CB 3.33Å; N205-I208 PolarHBondContact O-N 3.02Å; V206-I208 VanDerWaalsContact C-N 3.29Å; V206-I208 PolarHBondContact O-N 3.49Å; I208-S210 VanDerWaalsContact C-N 3.32Å; I208-S210 PolarHBondContact O-N 3.1Å; I208-V211 PolarHBondContact O-N 3.35Å; I208-G212 PolarHBondContact O-N 3.33Å; I208-M301 HydrophobicContact CG2-CB 3.98Å; I208-M301 HydrophobicContact CG2-CG 3.78Å; I208-R309 HydrophobicContact CG2-CG 4.05Å; I208-I310 HydrophobicContact CG2-CG2 3.72Å; I208-V312 HydrophobicContact CD1-CB 4.35Å; I208-V312 HydrophobicContact CD1-CG2 3.77Å; I208-V312 HydrophobicContact CG1-CG2 3.87Å; I208-A315 HydrophobicContact CD1-CB 4.31Å
209	W	98.2	Very high	94.6	Very high	0 Å²	0	17 Å²	17	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-61.2	-45.2	173	174	-83.8	0	0	0	111.2	R192 A193 P194 V206 D207 V211 G212 C213 F225 V237 L241 I304	R192-W209 PolarHBondContact O-NE1 3.21Å; R192-W209 VanDerWaalsContact O-NE1 3.09Å; A193-W209 HydrophobicContact CB-CB 3.71Å; A193-W209 HydrophobicContact CB-CD2 4.41Å; A193-W209 HydrophobicContact CB-CG 3.72Å; P194-W209 VanDerWaalsContact CD-CD2 3.48Å; P194-W209 HydrophobicContact CG-CD2 4.37Å; P194-W209 HydrophobicContact CG-CE3 4.12Å; P194-W209 HydrophobicContact CG-CH2 3.67Å; P194-W209 HydrophobicContact CG-CZ2 3.95Å; P194-W209 HydrophobicContact CG-CZ3 3.76Å; V206-W209 WeakPolarHBondContact O-CB 3.48Å; V206-W209 PolarHBondContact O-N 3.08Å; D207-W209 VanDerWaalsContact C-N 3.32Å; D207-W209 PolarHBondContact O-N 2.87Å; W209-V211 VanDerWaalsContact C-N 3.33Å; W209-V211 PolarHBondContact O-N 3.47Å; W209-G212 PolarHBondContact O-N 3.2Å; W209-G212 VanDerWaalsContact O-N 3.16Å; W209-C213 PolarHBondContact NE1-SG 3.08Å; W209-C213 PolarHBondContact O-N 3.42Å; W209-C213 PolarHBondContact O-SG 3.02Å; W209-F225 HydrophobicContact CH2-CE2 4.23Å; W209-F225 HydrophobicContact CH2-CZ 4.49Å; W209-F225 HydrophobicContact CZ2-CD2 4.08Å; W209-F225 AromaticContact CZ2-CE2 3.76Å; W209-F225 HydrophobicContact CZ2-CE2 3.76Å; W209-F225 HydrophobicContact CZ2-CZ 4.42Å; W209-V237 HydrophobicContact CH2-CG1 3.78Å; W209-V237 HydrophobicContact CH2-CG2 4.33Å; W209-V237 HydrophobicContact CZ2-CG1 4.23Å; W209-V237 HydrophobicContact CZ2-CG2 3.94Å; W209-L241 HydrophobicContact CH2-CD1 3.56Å; W209-L241 HydrophobicContact CZ3-CD1 3.92Å; W209-I304 HydrophobicContact CZ3-CG1 4.46Å
210	S	97.1	Very high	94.9	Very high	2 Å²	2	18 Å²	18	1%	0.014	10%	0.096	C	C	.	.	H	α-helix	trans	-62	-42.5	178.5	-55	0	0	0	0	111.2	Y191 D207 I208 G212 C213 I214	Y191-S210 WeakPolarHBondContact O-CA 3.31Å; Y191-S210 WeakPolarHBondContact O-CB 3.38Å; Y191-S210 PolarHBondContact O-OG 3.28Å; D207-S210 WeakPolarHBondContact O-CB 3.44Å; D207-S210 PolarHBondContact O-N 2.92Å; I208-S210 VanDerWaalsContact C-N 3.32Å; I208-S210 PolarHBondContact O-N 3.1Å; S210-G212 VanDerWaalsContact C-N 3.35Å; S210-G212 PolarHBondContact O-N 3.4Å; S210-C213 PolarHBondContact O-N 2.83Å; S210-I214 WeakPolarHBondContact O-CD1 3.45Å; S210-I214 VanDerWaalsContact O-CG1 3.29Å; S210-I214 WeakPolarHBondContact O-CG1 3.46Å; S210-I214 PolarHBondContact O-N 3.07Å
211	V	98.3	Very high	95	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-60.5	-42.8	172.8	176.9	0	0	0	0	111.3	L132 I139 L152 D207 I208 W209 C213 I214 M215 M301	L132-V211 HydrophobicContact CD2-CG1 3.78Å; I139-V211 HydrophobicContact CD1-CG2 3.33Å; L152-V211 HydrophobicContact CD1-CG2 4.38Å; D207-V211 WeakPolarHBondContact O-CG2 3.46Å; D207-V211 PolarHBondContact O-N 2.91Å; I208-V211 PolarHBondContact O-N 3.35Å; W209-V211 VanDerWaalsContact C-N 3.33Å; W209-V211 PolarHBondContact O-N 3.47Å; V211-C213 VanDerWaalsContact C-N 3.33Å; V211-C213 PolarHBondContact O-N 3.5Å; V211-I214 PolarHBondContact O-N 3.08Å; V211-M215 WeakPolarHBondContact O-CB 3.42Å; V211-M215 PolarHBondContact O-N 2.53Å; V211-M301 HydrophobicContact CB-SD 4.49Å; V211-M301 HydrophobicContact CG1-CE 3.91Å; V211-M301 HydrophobicContact CG1-SD 3.96Å
212	G	98.5	Very high	95.3	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.4	-39.4	175.6	0	0	0	0	0	113	I208 W209 S210 M215 G216 L298	I208-G212 PolarHBondContact O-N 3.33Å; W209-G212 PolarHBondContact O-N 3.2Å; W209-G212 VanDerWaalsContact O-N 3.16Å; S210-G212 VanDerWaalsContact C-N 3.35Å; S210-G212 PolarHBondContact O-N 3.4Å; G212-M215 PolarHBondContact O-N 3.5Å; G212-G216 PolarHBondContact O-N 3.4Å; G212-L298 WeakPolarHBondContact O-CD2 3.41Å
213	C	98.2	Very high	95.7	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.014	11%	0.109	C	C	.	.	H	α-helix	trans	-65.8	-43.1	175.1	-66.8	0	0	0	0	111.7	Y191 W209 S210 V211 G216 E217 I224	Y191-C213 HydrophobicContact CD1-CB 3.68Å; Y191-C213 HydrophobicContact CE1-CB 4.43Å; W209-C213 PolarHBondContact NE1-SG 3.08Å; W209-C213 PolarHBondContact O-N 3.42Å; W209-C213 PolarHBondContact O-SG 3.02Å; S210-C213 PolarHBondContact O-N 2.83Å; V211-C213 VanDerWaalsContact C-N 3.33Å; V211-C213 PolarHBondContact O-N 3.5Å; C213-G216 PolarHBondContact O-N 3.16Å; C213-E217 WeakPolarHBondContact O-CB 3.44Å; C213-E217 PolarHBondContact O-N 3.48Å; C213-I224 WeakPolarHBondContact O-CD1 3.44Å
214	I	97.3	Very high	96	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-63.3	-46.3	175.7	-69.4	161.6	0	0	0	110.5	L115 M135 P154 I157 Y191 S210 V211 G216 E217 L218	L115-I214 HydrophobicContact CD2-CG2 3.35Å; M135-I214 HydrophobicContact CE-CG2 4.13Å; M135-I214 HydrophobicContact SD-CG2 4.17Å; P154-I214 HydrophobicContact CG-CG1 4.15Å; I157-I214 HydrophobicContact CD1-CD1 3.69Å; Y191-I214 HydrophobicContact CD1-CG1 3.91Å; Y191-I214 HydrophobicContact CE1-CG1 4.13Å; S210-I214 WeakPolarHBondContact O-CD1 3.45Å; S210-I214 VanDerWaalsContact O-CG1 3.29Å; S210-I214 WeakPolarHBondContact O-CG1 3.46Å; S210-I214 PolarHBondContact O-N 3.07Å; V211-I214 PolarHBondContact O-N 3.08Å; I214-G216 PolarHBondContact O-N 3.4Å; I214-E217 PolarHBondContact O-N 2.96Å; I214-L218 HydrophobicContact CG2-CD1 4.11Å; I214-L218 HydrophobicContact CG2-CG 4.45Å; I214-L218 WeakPolarHBondContact O-CG 3.13Å; I214-L218 PolarHBondContact O-N 3.15Å
215	M	97.8	Very high	96.2	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-58.9	-48.4	177.4	-178.6	175.2	178.1	0	0	111.2	L132 V211 G212 E217 L218 V219 A294 L297 L298 M301 Y320	L132-M215 HydrophobicContact CD1-CB 4.38Å; L132-M215 HydrophobicContact CD1-CE 4.02Å; L132-M215 HydrophobicContact CD1-CG 3.8Å; L132-M215 HydrophobicContact CD1-SD 3.64Å; L132-M215 HydrophobicContact CD2-CB 3.82Å; L132-M215 HydrophobicContact CD2-CG 4.18Å; L132-M215 HydrophobicContact CD2-SD 4.41Å; V211-M215 WeakPolarHBondContact O-CB 3.42Å; V211-M215 PolarHBondContact O-N 2.53Å; G212-M215 PolarHBondContact O-N 3.5Å; M215-E217 VanDerWaalsContact C-N 3.27Å; M215-E217 PolarHBondContact O-N 3.3Å; M215-L218 WeakPolarHBondContact O-CB 3.46Å; M215-L218 PolarHBondContact O-N 3.15Å; M215-V219 WeakPolarHBondContact O-CG2 3.39Å; M215-V219 PolarHBondContact O-N 3.2Å; M215-V219 VanDerWaalsContact O-N 3.12Å; M215-A294 HydrophobicContact CE-CB 3.77Å; M215-A294 VanDerWaalsContact CE-O 3.23Å; M215-A294 WeakPolarHBondContact CE-O 3.45Å; M215-L297 HydrophobicContact CE-CB 4.38Å; M215-L297 HydrophobicContact CE-CD2 4.33Å; M215-L297 HydrophobicContact SD-CD2 4.07Å; M215-L297 HydrophobicContact SD-CG 4.25Å; M215-L298 HydrophobicContact CB-CD2 3.89Å; M215-L298 HydrophobicContact CE-CD1 4.24Å; M215-L298 HydrophobicContact CE-CG 3.9Å; M215-L298 HydrophobicContact CG-CD1 4.49Å; M215-L298 HydrophobicContact CG-CD2 3.73Å; M215-L298 HydrophobicContact CG-CG 4.02Å; M215-L298 HydrophobicContact SD-CD2 3.93Å; M215-L298 HydrophobicContact SD-CG 3.77Å; M215-M301 HydrophobicContact SD-SD 4.46Å; M215-Y320 HydrophobicContact CE-CD1 4.13Å; M215-Y320 HydrophobicContact CE-CE1 3.87Å
216	G	97.2	Very high	96.2	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-69.7	-27.5	-179.2	0	0	0	0	0	112.6	G212 C213 I214 V219 K220	G212-G216 PolarHBondContact O-N 3.4Å; C213-G216 PolarHBondContact O-N 3.16Å; I214-G216 PolarHBondContact O-N 3.4Å; G216-V219 PolarHBondContact O-N 3.44Å; G216-K220 VanDerWaalsContact O-CB 3.28Å; G216-K220 WeakPolarHBondContact O-CB 3.45Å; G216-K220 WeakPolarHBondContact O-CG 3.43Å; G216-K220 PolarHBondContact O-N 3.1Å
217	E	96.2	Very high	96	Very high	16 Å²	16	18.2 Å²	18.2	8%	0.075	10%	0.103	C	C	.	.	H	α-helix	trans	-71.3	-38.5	170.3	179.6	168.6	-169.3	0	0	112.5	I119 Y191 C213 I214 M215 V219 K220 G221 V223	I119-E217 HydrophobicContact CD1-CG 3.75Å; I119-E217 HydrophobicContact CG1-CG 4.08Å; I119-E217 HydrophobicContact CG2-CG 3.64Å; Y191-E217 WeakPolarHBondContact CE1-OE2 3.47Å; Y191-E217 PolarHBondContact OH-OE1 2.92Å; Y191-E217 PolarHBondContact OH-OE2 3.39Å; C213-E217 WeakPolarHBondContact O-CB 3.44Å; C213-E217 PolarHBondContact O-N 3.48Å; I214-E217 PolarHBondContact O-N 2.96Å; M215-E217 VanDerWaalsContact C-N 3.27Å; M215-E217 PolarHBondContact O-N 3.3Å; E217-V219 PolarHBondContact O-N 3Å; E217-K220 PolarHBondContact O-N 3.28Å; E217-G221 WeakPolarHBondContact O-CA 3.43Å; E217-G221 PolarHBondContact O-N 2.93Å; E217-V223 WeakPolarHBondContact OE1-CG2 3.43Å
218	L	95.3	Very high	95.7	Very high	13 Å²	13	23.4 Å²	23.4	7%	0.068	14%	0.135	C	C	.	.	H	α-helix	trans	-59.5	-33.8	172.1	-72.9	167.1	0	0	0	112.1	L115 V118 I119 L123 I214 M215	L115-L218 HydrophobicContact CD1-CD2 4.47Å; L115-L218 HydrophobicContact CG-CD2 4.44Å; V118-L218 HydrophobicContact CG1-CD2 4.29Å; I119-L218 HydrophobicContact CG1-CD2 3.66Å; I119-L218 HydrophobicContact CG1-CG 4.18Å; L123-L218 HydrophobicContact CD1-CD2 3.86Å; I214-L218 HydrophobicContact CG2-CD1 4.11Å; I214-L218 HydrophobicContact CG2-CG 4.45Å; I214-L218 WeakPolarHBondContact O-CG 3.13Å; I214-L218 PolarHBondContact O-N 3.15Å; M215-L218 WeakPolarHBondContact O-CB 3.46Å; M215-L218 PolarHBondContact O-N 3.15Å
219	V	93.9	Very high	95.3	Very high	11 Å²	11	26.8 Å²	26.8	7%	0.067	15%	0.153	C	C	.	.	H	α-helix	trans	-82.8	-43.1	177.6	-176.2	0	0	0	0	111.6	M128 M215 G216 E217 I279 F280	M128-V219 HydrophobicContact CE-CG2 3.89Å; M128-V219 HydrophobicContact SD-CG2 3.73Å; M215-V219 WeakPolarHBondContact O-CG2 3.39Å; M215-V219 PolarHBondContact O-N 3.2Å; M215-V219 VanDerWaalsContact O-N 3.12Å; G216-V219 PolarHBondContact O-N 3.44Å; E217-V219 PolarHBondContact O-N 3Å; V219-I279 HydrophobicContact CB-CD1 4.45Å; V219-I279 HydrophobicContact CG1-CB 4.24Å; V219-I279 HydrophobicContact CG1-CD1 3.47Å; V219-I279 VanDerWaalsContact CG1-CD1 3.47Å; V219-I279 HydrophobicContact CG1-CG1 3.69Å; V219-F280 HydrophobicContact CB-CE1 4.24Å; V219-F280 HydrophobicContact CG1-CD1 3.62Å; V219-F280 HydrophobicContact CG1-CD2 4.13Å; V219-F280 HydrophobicContact CG1-CE1 3.47Å; V219-F280 VanDerWaalsContact CG1-CE1 3.47Å; V219-F280 HydrophobicContact CG1-CE2 4Å; V219-F280 HydrophobicContact CG1-CG 3.96Å; V219-F280 HydrophobicContact CG1-CZ 3.68Å; V219-F280 HydrophobicContact CG2-CD1 4.12Å; V219-F280 HydrophobicContact CG2-CE1 3.66Å; V219-F280 HydrophobicContact CG2-CZ 4.37Å
220	K	93.5	Very high	94.7	Very high	71 Å²	71	29.8 Å²	29.8	31%	0.309	17%	0.167	S	C	.	.	H	α-helix	trans	-83.6	-17.2	-175.1	-68.8	-178.1	70.5	146.9	0	114	G216 E217 C222 L274 F275 I279	G216-K220 VanDerWaalsContact O-CB 3.28Å; G216-K220 WeakPolarHBondContact O-CB 3.45Å; G216-K220 WeakPolarHBondContact O-CG 3.43Å; G216-K220 PolarHBondContact O-N 3.1Å; E217-K220 PolarHBondContact O-N 3.28Å; K220-C222 PolarHBondContact O-N 3.41Å; K220-L274 PolarHBondContact NZ-O 3.03Å; K220-F275 HydrophobicContact CD-CD1 3.89Å; K220-F275 HydrophobicContact CD-CE1 3.58Å; K220-F275 HydrophobicContact CD-CZ 4.48Å; K220-F275 HydrophobicContact CG-CD1 3.89Å; K220-F275 HydrophobicContact CG-CE1 3.88Å; K220-I279 HydrophobicContact CG-CD1 3.7Å
221	G	92.9	Very high	94.4	Very high	32 Å²	32	33.9 Å²	33.9	33%	0.33	19%	0.188	S	C	.	.	S	Bend	trans	69.6	5.4	-171.2	0	0	0	0	0	114.3	E217	E217-G221 WeakPolarHBondContact O-CA 3.43Å; E217-G221 PolarHBondContact O-N 2.93Å
222	C	93.3	Very high	94.2	Very high	68 Å²	68	35.3 Å²	35.3	46%	0.459	20%	0.196	S	C	.	.	S	Bend	trans	-147.6	154	-179.1	68.9	0	0	0	0	112.3	K220 I224	K220-C222 PolarHBondContact O-N 3.41Å; C222-I224 PolarHBondContact O-N 3.38Å
223	V	95.3	Very high	94	Very high	36 Å²	36	35.3 Å²	35.3	22%	0.218	20%	0.196	C	C	.	.			trans	-57.9	127.3	178.5	176.3	0	0	0	0	110.9	Y190 E217 Q226	Y190-V223 HydrophobicContact CD1-CG1 4.48Å; Y190-V223 HydrophobicContact CD2-CB 4.46Å; Y190-V223 HydrophobicContact CD2-CG1 3.67Å; Y190-V223 HydrophobicContact CD2-CG2 4.05Å; Y190-V223 HydrophobicContact CE2-CG1 4.48Å; Y190-V223 HydrophobicContact CG-CG1 3.68Å; E217-V223 WeakPolarHBondContact OE1-CG2 3.43Å; V223-Q226 HydrophobicContact CG1-CB 4.19Å
224	I	96.1	Very high	93.8	Very high	10 Å²	10	35.3 Å²	35.3	5%	0.051	20%	0.196	C	C	.	.	S	Bend	trans	-70	-46.4	-177	-47	173.8	0	0	0	111.9	C213 C222 Q240 F275 L302	C213-I224 WeakPolarHBondContact O-CD1 3.44Å; C222-I224 PolarHBondContact O-N 3.38Å; I224-Q240 VanDerWaalsContact CG2-OE1 3.3Å; I224-Q240 PolarHBondContact O-NE2 3.16Å; I224-F275 HydrophobicContact CD1-CE1 4.43Å; I224-F275 HydrophobicContact CD1-CZ 4.11Å; I224-L302 HydrophobicContact CD1-CD1 3.99Å
225	F	96.4	Very high	93.7	Very high	1 Å²	1	36.6 Å²	36.6	0%	0.004	20%	0.202	C	C	.	.			trans	-121	83	-173.8	-49.8	-63.2	0	0	0	110.5	Y190 W209 G227 Q233 K236 V237 Q240 L241 L302	Y190-F225 WeakPolarHBondContact CB-O 3.19Å; Y190-F225 WeakPolarHBondContact CD1-O 3.43Å; W209-F225 HydrophobicContact CH2-CE2 4.23Å; W209-F225 HydrophobicContact CH2-CZ 4.49Å; W209-F225 HydrophobicContact CZ2-CD2 4.08Å; W209-F225 AromaticContact CZ2-CE2 3.76Å; W209-F225 HydrophobicContact CZ2-CE2 3.76Å; W209-F225 HydrophobicContact CZ2-CZ 4.42Å; F225-G227 PolarHBondContact O-N 2.89Å; F225-Q233 PolarHBondContact O-NE2 2.8Å; F225-Q233 PolarHBondContact O-OE1 3.48Å; F225-Q233 VanDerWaalsContact O-OE1 3.08Å; F225-K236 HydrophobicContact CB-CB 4.34Å; F225-V237 HydrophobicContact CB-CG2 4.22Å; F225-V237 HydrophobicContact CD1-CG2 3.98Å; F225-V237 HydrophobicContact CD2-CG2 4.28Å; F225-V237 HydrophobicContact CE1-CG2 4.42Å; F225-V237 HydrophobicContact CG-CG2 3.9Å; F225-Q240 HydrophobicContact CE1-CB 4.09Å; F225-Q240 HydrophobicContact CE1-CG 4.49Å; F225-L241 HydrophobicContact CE1-CD1 4.44Å; F225-L241 HydrophobicContact CE1-CG 4.26Å; F225-L241 HydrophobicContact CZ-CD1 3.9Å; F225-L241 HydrophobicContact CZ-CD2 4.38Å; F225-L241 HydrophobicContact CZ-CG 4.07Å; F225-L302 HydrophobicContact CE2-CD2 4.05Å
226	Q	93.9	Very high	93.7	Very high	120 Å²	120	39.7 Å²	39.7	56%	0.561	22%	0.216	S	C	*	.			trans	-92.5	86.4	-177.5	-165.6	178.3	24	0	0	111.7	Y190 V223	Y190-Q226 HydrophobicContact CD1-CG 4.49Å; Y190-Q226 HydrophobicContact CE1-CB 4.44Å; Y190-Q226 HydrophobicContact CE1-CG 3.85Å; Y190-Q226 HydrophobicContact CE2-CG 4.23Å; V223-Q226 HydrophobicContact CG1-CB 4.19Å
227	G	92.4	Very high	93.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.216	C	C	.	.			trans	-96.7	129.3	178.1	0	0	0	0	0	114.3	R189 Y190 F225 D229 D232 Q233	R189-G227 PolarHBondContact NH1-O 3.33Å; Y190-G227 WeakPolarHBondContact CE1-O 3.3Å; F225-G227 PolarHBondContact O-N 2.89Å; G227-D229 VanDerWaalsContact C-N 3.32Å; G227-D229 PolarHBondContact O-N 3.45Å; G227-D232 WeakPolarHBondContact CA-OD2 3.21Å; G227-Q233 VanDerWaalsContact CA-OE1 3.29Å
228	T	90.6	Very high	93.7	Very high	109 Å²	109	39 Å²	39	67%	0.669	21%	0.213	S	C	*	.	S	Bend	trans	-66.7	-29.9	178.3	53.3	0	0	0	0	113.6	R189 D232	R189-T228 PolarHBondContact NH1-O 2.87Å; T228-D232 PolarHBondContact N-OD2 3.47Å; T228-D232 WeakPolarHBondContact OG1-CB 3.35Å; T228-D232 PolarHBondContact OG1-OD2 3.21Å
229	D	88.7	Confident	93.8	Very high	72 Å²	72	41.8 Å²	41.8	39%	0.385	23%	0.225	S	C	.	.	S	Bend	trans	-145.1	-172.3	172.1	64.5	33.8	0	0	0	111.2	R189 G227 I231 D232 Q233	R189-D229 VanDerWaalsContact CD-O 3.32Å; R189-D229 WeakPolarHBondContact CD-O 3.02Å; G227-D229 VanDerWaalsContact C-N 3.32Å; G227-D229 PolarHBondContact O-N 3.45Å; D229-I231 VanDerWaalsContact C-N 3.31Å; D229-I231 PolarHBondContact O-N 3.47Å; D229-I231 WeakPolarHBondContact OD1-CA 3.35Å; D229-I231 VanDerWaalsContact OD1-CB 3.3Å; D229-I231 WeakPolarHBondContact OD1-CB 3.2Å; D229-I231 PolarHBondContact OD1-N 2.84Å; D229-D232 PolarHBondContact OD1-N 2.94Å; D229-Q233 WeakPolarHBondContact O-CB 3.22Å; D229-Q233 PolarHBondContact O-N 2.98Å
230	H	86.8	Confident	93.9	Very high	62 Å²	62	42.9 Å²	42.9	29%	0.287	23%	0.23	S	C	.	.	H	α-helix	trans	-65.4	-32.6	179	-65.1	156.1	0	0	0	113.4	I197 W234	I197-H230 HydrophobicContact CG2-CB 4.33Å; H230-W234 PolarHBondContact O-N 3.08Å
231	I	90	Very high	94.1	Very high	88 Å²	88	41.2 Å²	41.2	45%	0.451	22%	0.224	S	C	.	.	H	α-helix	trans	-71.6	-49.9	-179.8	-79.6	166.8	0	0	0	109.4	D229 W234 N235 Y259	D229-I231 VanDerWaalsContact C-N 3.31Å; D229-I231 PolarHBondContact O-N 3.47Å; D229-I231 WeakPolarHBondContact OD1-CA 3.35Å; D229-I231 VanDerWaalsContact OD1-CB 3.3Å; D229-I231 WeakPolarHBondContact OD1-CB 3.2Å; D229-I231 PolarHBondContact OD1-N 2.84Å; I231-W234 PolarHBondContact O-N 3.39Å; I231-N235 PolarHBondContact O-N 3.06Å; I231-N235 PolarHBondContact O-ND2 2.69Å; I231-Y259 HydrophobicContact CG1-CE2 4.38Å; I231-Y259 WeakPolarHBondContact CG2-OH 3.35Å
232	D	93.3	Very high	94.3	Very high	31 Å²	31	39.9 Å²	39.9	17%	0.166	21%	0.21	C	C	.	.	H	α-helix	trans	-65.3	-39.8	178.1	-172.3	38.8	0	0	0	111.1	G227 T228 D229 W234 N235 K236	G227-D232 WeakPolarHBondContact CA-OD2 3.21Å; T228-D232 PolarHBondContact N-OD2 3.47Å; T228-D232 WeakPolarHBondContact OG1-CB 3.35Å; T228-D232 PolarHBondContact OG1-OD2 3.21Å; D229-D232 PolarHBondContact OD1-N 2.94Å; D232-W234 VanDerWaalsContact C-N 3.3Å; D232-W234 PolarHBondContact O-N 3.12Å; D232-N235 WeakPolarHBondContact O-CB 3.32Å; D232-N235 PolarHBondContact O-N 3.42Å; D232-K236 WeakPolarHBondContact O-CG 3.47Å; D232-K236 PolarHBondContact O-N 2.92Å
233	Q	94.3	Very high	94.5	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-55.2	-45.8	173.3	-173.4	67.2	33.7	0	0	111.9	R189 Y190 I197 F225 G227 D229 K236 V237	R189-Q233 HydrophobicContact CG-CB 4.31Å; R189-Q233 HydrophobicContact CG-CG 4.17Å; Y190-Q233 PolarHBondContact O-NE2 2.98Å; I197-Q233 HydrophobicContact CD1-CB 4.4Å; I197-Q233 HydrophobicContact CD1-CG 3.46Å; I197-Q233 VanDerWaalsContact CD1-CG 3.46Å; I197-Q233 HydrophobicContact CG1-CG 4.38Å; F225-Q233 PolarHBondContact O-NE2 2.8Å; F225-Q233 PolarHBondContact O-OE1 3.48Å; F225-Q233 VanDerWaalsContact O-OE1 3.08Å; G227-Q233 VanDerWaalsContact CA-OE1 3.29Å; D229-Q233 WeakPolarHBondContact O-CB 3.22Å; D229-Q233 PolarHBondContact O-N 2.98Å; Q233-K236 PolarHBondContact O-N 3.29Å; Q233-V237 WeakPolarHBondContact O-CG2 3.15Å; Q233-V237 PolarHBondContact O-N 3.36Å
234	W	95.4	Very high	94.5	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.008	19%	0.194	C	C	.	.	H	α-helix	trans	-62.8	-42.4	175.8	175.9	-109.7	0	0	0	112.1	P194 L198 H230 I231 D232 K236 V237 I238 P244 F248 V260 I304	P194-W234 HydrophobicContact CB-CZ3 3.95Å; P194-W234 HydrophobicContact CG-CZ3 4.44Å; L198-W234 HydrophobicContact CD1-CD2 4.44Å; L198-W234 HydrophobicContact CD1-CE3 4.04Å; L198-W234 HydrophobicContact CD1-CH2 3.86Å; L198-W234 HydrophobicContact CD1-CZ2 4.26Å; L198-W234 HydrophobicContact CD1-CZ3 3.77Å; L198-W234 HydrophobicContact CD2-CD2 4.08Å; L198-W234 HydrophobicContact CD2-CE3 4.24Å; L198-W234 HydrophobicContact CD2-CG 4.37Å; L198-W234 HydrophobicContact CG-CE3 4.27Å; L198-W234 HydrophobicContact CG-CZ3 4.46Å; H230-W234 PolarHBondContact O-N 3.08Å; I231-W234 PolarHBondContact O-N 3.39Å; D232-W234 VanDerWaalsContact C-N 3.3Å; D232-W234 PolarHBondContact O-N 3.12Å; W234-K236 PolarHBondContact O-N 3.12Å; W234-V237 HydrophobicContact CZ3-CG1 4.35Å; W234-V237 WeakPolarHBondContact O-CB 3.43Å; W234-V237 PolarHBondContact O-N 3.36Å; W234-I238 HydrophobicContact CD2-CG2 4.1Å; W234-I238 HydrophobicContact CE3-CG2 4.37Å; W234-I238 HydrophobicContact CH2-CG2 3.71Å; W234-I238 HydrophobicContact CZ2-CG2 3.38Å; W234-I238 HydrophobicContact CZ3-CG2 4.17Å; W234-I238 PolarHBondContact O-N 3.45Å; W234-I238 VanDerWaalsContact O-N 3.09Å; W234-P244 HydrophobicContact CH2-CG 3.97Å; W234-P244 HydrophobicContact CZ2-CG 4.05Å; W234-F248 HydrophobicContact CH2-CE1 4.16Å; W234-V260 HydrophobicContact CZ2-CG1 3.69Å; W234-V260 HydrophobicContact CZ2-CG2 4.19Å; W234-I304 HydrophobicContact CH2-CG2 4.02Å; W234-I304 HydrophobicContact CZ3-CG2 4.21Å
235	N	95.2	Very high	94.5	Very high	26 Å²	26	39.3 Å²	39.3	14%	0.139	21%	0.208	C	C	.	.	H	α-helix	trans	-59.6	-46.7	177.1	-64.3	-29.6	0	0	0	111.3	I231 D232 V237 I238 E239	I231-N235 PolarHBondContact O-N 3.06Å; I231-N235 PolarHBondContact O-ND2 2.69Å; D232-N235 WeakPolarHBondContact O-CB 3.32Å; D232-N235 PolarHBondContact O-N 3.42Å; N235-V237 PolarHBondContact O-N 3.38Å; N235-I238 WeakPolarHBondContact O-CG1 3.45Å; N235-I238 PolarHBondContact O-N 3.28Å; N235-E239 WeakPolarHBondContact O-CB 3.22Å; N235-E239 WeakPolarHBondContact O-CG 3.29Å; N235-E239 PolarHBondContact O-N 3.32Å
236	K	96.4	Very high	94.4	Very high	65 Å²	65	42.1 Å²	42.1	28%	0.283	23%	0.231	S	C	.	.	H	α-helix	trans	-57.3	-38	176.6	-62.9	-53.4	175.4	-168.6	0	112.9	F225 D232 Q233 W234 E239	F225-K236 HydrophobicContact CB-CB 4.34Å; D232-K236 WeakPolarHBondContact O-CG 3.47Å; D232-K236 PolarHBondContact O-N 2.92Å; Q233-K236 PolarHBondContact O-N 3.29Å; W234-K236 PolarHBondContact O-N 3.12Å; K236-E239 IonicContact NZ-OE2 2.58Å
237	V	97.4	Very high	94.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-66	-51.6	177.9	169.3	0	0	0	0	111.1	P194 W209 F225 Q233 W234 N235 Q240 L241 I304	P194-V237 HydrophobicContact CG-CG1 4.47Å; W209-V237 HydrophobicContact CH2-CG1 3.78Å; W209-V237 HydrophobicContact CH2-CG2 4.33Å; W209-V237 HydrophobicContact CZ2-CG1 4.23Å; W209-V237 HydrophobicContact CZ2-CG2 3.94Å; F225-V237 HydrophobicContact CB-CG2 4.22Å; F225-V237 HydrophobicContact CD1-CG2 3.98Å; F225-V237 HydrophobicContact CD2-CG2 4.28Å; F225-V237 HydrophobicContact CE1-CG2 4.42Å; F225-V237 HydrophobicContact CG-CG2 3.9Å; Q233-V237 WeakPolarHBondContact O-CG2 3.15Å; Q233-V237 PolarHBondContact O-N 3.36Å; W234-V237 HydrophobicContact CZ3-CG1 4.35Å; W234-V237 WeakPolarHBondContact O-CB 3.43Å; W234-V237 PolarHBondContact O-N 3.36Å; N235-V237 PolarHBondContact O-N 3.38Å; V237-Q240 PolarHBondContact O-N 3.47Å; V237-L241 HydrophobicContact CG1-CD1 4.2Å; V237-L241 WeakPolarHBondContact O-CB 3.31Å; V237-L241 PolarHBondContact O-N 3.25Å; V237-I304 HydrophobicContact CG1-CD1 3.97Å; V237-I304 HydrophobicContact CG1-CG1 4.01Å
238	I	97	Very high	94.6	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-74.3	-28	-176.5	62.9	174.9	0	0	0	113.3	W234 N235 Q240 G242 R263 Y266 I304	W234-I238 HydrophobicContact CD2-CG2 4.1Å; W234-I238 HydrophobicContact CE3-CG2 4.37Å; W234-I238 HydrophobicContact CH2-CG2 3.71Å; W234-I238 HydrophobicContact CZ2-CG2 3.38Å; W234-I238 HydrophobicContact CZ3-CG2 4.17Å; W234-I238 PolarHBondContact O-N 3.45Å; W234-I238 VanDerWaalsContact O-N 3.09Å; N235-I238 WeakPolarHBondContact O-CG1 3.45Å; N235-I238 PolarHBondContact O-N 3.28Å; I238-Q240 PolarHBondContact O-N 2.95Å; I238-G242 CarbonylContact O-C 3.54Å; I238-G242 WeakPolarHBondContact O-CA 3.03Å; I238-G242 PolarHBondContact O-N 3.28Å; I238-R263 HydrophobicContact CD1-CB 3.93Å; I238-R263 HydrophobicContact CD1-CG 4.23Å; I238-Y266 HydrophobicContact CB-CD2 4.39Å; I238-Y266 HydrophobicContact CD1-CD2 3.98Å; I238-Y266 HydrophobicContact CD1-CE2 4.01Å; I238-Y266 HydrophobicContact CG1-CD2 3.89Å; I238-Y266 HydrophobicContact CG1-CE2 4.11Å; I238-Y266 WeakPolarHBondContact O-CB 3.02Å; I238-I304 HydrophobicContact CG2-CD1 4.4Å
239	E	96.7	Very high	94.8	Very high	72 Å²	72	37.3 Å²	37.3	34%	0.336	20%	0.201	S	C	.	.	H	α-helix	trans	-60.5	-35.8	173.9	-79.9	171	-177.2	0	0	111.3	N235 K236 Y266	N235-E239 WeakPolarHBondContact O-CB 3.22Å; N235-E239 WeakPolarHBondContact O-CG 3.29Å; N235-E239 PolarHBondContact O-N 3.32Å; K236-E239 IonicContact NZ-OE2 2.58Å; E239-Y266 HydrophobicContact CG-CD1 4.24Å; E239-Y266 HydrophobicContact CG-CD2 4.47Å; E239-Y266 HydrophobicContact CG-CE1 3.74Å; E239-Y266 HydrophobicContact CG-CE2 4.01Å
240	Q	97.1	Very high	95.1	Very high	34 Å²	34	40.7 Å²	40.7	16%	0.159	21%	0.213	C	C	.	.	H	α-helix	trans	-94.7	-45.1	-178.7	-65.2	-175.7	37.4	0	0	113.3	I224 F225 V237 I238 G268 I269 L274	I224-Q240 VanDerWaalsContact CG2-OE1 3.3Å; I224-Q240 PolarHBondContact O-NE2 3.16Å; F225-Q240 HydrophobicContact CE1-CB 4.09Å; F225-Q240 HydrophobicContact CE1-CG 4.49Å; V237-Q240 PolarHBondContact O-N 3.47Å; I238-Q240 PolarHBondContact O-N 2.95Å; Q240-G268 WeakPolarHBondContact O-CA 3.35Å; Q240-I269 PolarHBondContact O-N 2.92Å; Q240-L274 VanDerWaalsContact OE1-CD1 3.24Å
241	L	97.8	Very high	95.5	Very high	35 Å²	35	41.4 Å²	41.4	18%	0.183	22%	0.215	C	C	.	.	H	α-helix	trans	-95.4	-7.5	-174	-57.4	-176.6	0	0	0	113.6	W209 F225 V237 F271 L274 L302 I304	W209-L241 HydrophobicContact CH2-CD1 3.56Å; W209-L241 HydrophobicContact CZ3-CD1 3.92Å; F225-L241 HydrophobicContact CE1-CD1 4.44Å; F225-L241 HydrophobicContact CE1-CG 4.26Å; F225-L241 HydrophobicContact CZ-CD1 3.9Å; F225-L241 HydrophobicContact CZ-CD2 4.38Å; F225-L241 HydrophobicContact CZ-CG 4.07Å; V237-L241 HydrophobicContact CG1-CD1 4.2Å; V237-L241 WeakPolarHBondContact O-CB 3.31Å; V237-L241 PolarHBondContact O-N 3.25Å; L241-F271 HydrophobicContact CD2-CE2 4.27Å; L241-F271 HydrophobicContact CD2-CZ 3.95Å; L241-L274 HydrophobicContact CD2-CD2 4.22Å; L241-L302 HydrophobicContact CD1-CB 4.4Å; L241-L302 WeakPolarHBondContact CD1-O 3.44Å; L241-I304 HydrophobicContact CB-CD1 4.09Å; L241-I304 HydrophobicContact CB-CG1 4.37Å; L241-I304 HydrophobicContact CD1-CG1 4.13Å
242	G	97.1	Very high	95.7	Very high	4 Å²	4	37.8 Å²	37.8	4%	0.041	20%	0.196	C	C	.	.			trans	90.1	166	-179.4	0	0	0	0	0	113.7	I238 Y266 G268 I304	I238-G242 CarbonylContact O-C 3.54Å; I238-G242 WeakPolarHBondContact O-CA 3.03Å; I238-G242 PolarHBondContact O-N 3.28Å; G242-Y266 CarbonylContact C-O 3.43Å; G242-Y266 VanDerWaalsContact CA-O 3.3Å; G242-Y266 WeakPolarHBondContact CA-O 3.39Å; G242-G268 VanDerWaalsContact CA-CA 3.45Å; G242-G268 VanDerWaalsContact N-CA 3.33Å; G242-I304 WeakPolarHBondContact O-CD1 3.08Å
243	T	96.9	Very high	95.7	Very high	37 Å²	37	42.3 Å²	42.3	23%	0.227	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-70.5	130.4	176.1	-57.4	0	0	0	0	110.5	K265 Y266	T243-K265 HydrophobicContact CG2-CD 3.73Å; T243-K265 WeakPolarHBondContact OG1-CA 3.08Å; T243-Y266 PolarHBondContact N-O 3.48Å; T243-Y266 PolarHBondContact OG1-N 3Å
244	P	95.6	Very high	95.7	Very high	16 Å²	16	47 Å²	47	10%	0.104	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-66.8	159.9	-178.5	29.7	-38.4	0	0	0	112.8	W234 F248 M249 I304	W234-P244 HydrophobicContact CH2-CG 3.97Å; W234-P244 HydrophobicContact CZ2-CG 4.05Å; P244-F248 HydrophobicContact CB-CB 4.11Å; P244-F248 HydrophobicContact CB-CD1 3.4Å; P244-F248 VanDerWaalsContact CB-CD1 3.4Å; P244-F248 HydrophobicContact CB-CE1 4.02Å; P244-F248 HydrophobicContact CB-CG 3.9Å; P244-F248 HydrophobicContact CG-CD1 3.53Å; P244-F248 HydrophobicContact CG-CE1 3.84Å; P244-F248 HydrophobicContact CG-CG 4.49Å; P244-M249 HydrophobicContact CG-CG 4.32Å; P244-I304 HydrophobicContact CB-CG2 4Å; P244-I304 HydrophobicContact CG-CG2 4.48Å
245	S	95.5	Very high	95.5	Very high	50 Å²	50	52.3 Å²	52.3	35%	0.35	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-60.4	157.2	179.4	71.7	0	0	0	0	113.4	E247 F248 M249	S245-E247 PolarHBondContact O-N 3.36Å; S245-F248 WeakPolarHBondContact O-CB 3.11Å; S245-F248 PolarHBondContact O-N 3.19Å; S245-F248 VanDerWaalsContact O-N 3.15Å; S245-F248 PolarHBondContact OG-N 3.49Å; S245-M249 PolarHBondContact O-N 3.44Å; S245-M249 VanDerWaalsContact O-N 3.1Å
246	A	94.7	Very high	95.4	Very high	60 Å²	60	52.9 Å²	52.9	50%	0.496	28%	0.284	S	S	.	.	H	α-helix	trans	-60.1	-29.7	173.8	0	0	0	0	0	113	M249 K250	A246-M249 HydrophobicContact CB-CE 4.36Å; A246-M249 PolarHBondContact O-N 3.3Å; A246-K250 VanDerWaalsContact O-CG 3.3Å; A246-K250 WeakPolarHBondContact O-CG 3.49Å; A246-K250 PolarHBondContact O-N 2.94Å; A246-K250 VanDerWaalsContact O-N 3.08Å
247	E	95.4	Very high	95.3	Very high	111 Å²	111	53.6 Å²	53.6	52%	0.519	29%	0.285	S	S	.	.	H	α-helix	trans	-63	-45.5	174.5	-176.1	-176.1	-163.7	0	0	111.6	S245 K250 K308	S245-E247 PolarHBondContact O-N 3.36Å; E247-K250 PolarHBondContact O-N 3.17Å; E247-K308 IonicContact OE2-NZ 2.63Å; E247-K308 PolarHBondContact OE2-NZ 2.71Å
248	F	95.7	Very high	95.2	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-61.9	-47.6	174	172.6	-92.9	0	0	0	111.3	L198 M200 W234 P244 S245 K250 K251 L252 I304 D305	L198-F248 HydrophobicContact CD1-CE1 4.03Å; L198-F248 HydrophobicContact CD1-CZ 3.92Å; M200-F248 HydrophobicContact CE-CD2 4.41Å; M200-F248 HydrophobicContact CE-CE2 3.87Å; M200-F248 HydrophobicContact CE-CZ 4.28Å; M200-F248 HydrophobicContact SD-CE2 3.87Å; M200-F248 HydrophobicContact SD-CZ 3.74Å; W234-F248 HydrophobicContact CH2-CE1 4.16Å; P244-F248 HydrophobicContact CB-CB 4.11Å; P244-F248 HydrophobicContact CB-CD1 3.4Å; P244-F248 VanDerWaalsContact CB-CD1 3.4Å; P244-F248 HydrophobicContact CB-CE1 4.02Å; P244-F248 HydrophobicContact CB-CG 3.9Å; P244-F248 HydrophobicContact CG-CD1 3.53Å; P244-F248 HydrophobicContact CG-CE1 3.84Å; P244-F248 HydrophobicContact CG-CG 4.49Å; S245-F248 WeakPolarHBondContact O-CB 3.11Å; S245-F248 PolarHBondContact O-N 3.19Å; S245-F248 VanDerWaalsContact O-N 3.15Å; S245-F248 PolarHBondContact OG-N 3.49Å; F248-K250 PolarHBondContact O-N 3Å; F248-K251 WeakPolarHBondContact O-CB 3.13Å; F248-K251 PolarHBondContact O-N 3.18Å; F248-L252 HydrophobicContact CE1-CD1 4.39Å; F248-L252 HydrophobicContact CE1-CD2 4.33Å; F248-L252 HydrophobicContact CZ-CD2 4.46Å; F248-I304 HydrophobicContact CD1-CG2 4.47Å; F248-I304 HydrophobicContact CD2-CG2 4.45Å; F248-I304 HydrophobicContact CE1-CG2 4Å; F248-I304 HydrophobicContact CE2-CG2 3.97Å; F248-I304 HydrophobicContact CZ-CG2 3.72Å; F248-D305 HydrophobicContact CD2-CB 3.96Å
249	M	94.7	Very high	94.9	Very high	16 Å²	16	60.9 Å²	60.9	8%	0.079	32%	0.32	C	S	.	.	H	α-helix	trans	-62.1	-28.9	-178.4	-68.5	-174.8	-69.7	0	0	112.9	P244 S245 A246 K251 L252 R257 V260 E261	P244-M249 HydrophobicContact CG-CG 4.32Å; S245-M249 PolarHBondContact O-N 3.44Å; S245-M249 VanDerWaalsContact O-N 3.1Å; A246-M249 HydrophobicContact CB-CE 4.36Å; A246-M249 PolarHBondContact O-N 3.3Å; M249-K251 PolarHBondContact O-N 3.42Å; M249-L252 HydrophobicContact CB-CD1 4.49Å; M249-L252 WeakPolarHBondContact O-CB 3.38Å; M249-L252 PolarHBondContact O-N 2.96Å; M249-R257 VanDerWaalsContact O-CD 3.27Å; M249-R257 WeakPolarHBondContact O-CD 3.48Å; M249-R257 WeakPolarHBondContact O-CG 3.35Å; M249-V260 HydrophobicContact CG-CG1 4.22Å; M249-V260 HydrophobicContact SD-CG1 4.13Å; M249-E261 HydrophobicContact CE-CG 4.41Å; M249-E261 HydrophobicContact SD-CG 3.61Å
250	K	94.9	Very high	94.7	Very high	144 Å²	144	57.5 Å²	57.5	63%	0.626	30%	0.304	S	S	*	.	H	α-helix	trans	-64.8	-22.9	173.8	-76.4	171.8	-177	-178.7	0	113.8	A246 E247 F248 L252	A246-K250 VanDerWaalsContact O-CG 3.3Å; A246-K250 WeakPolarHBondContact O-CG 3.49Å; A246-K250 PolarHBondContact O-N 2.94Å; A246-K250 VanDerWaalsContact O-N 3.08Å; E247-K250 PolarHBondContact O-N 3.17Å; F248-K250 PolarHBondContact O-N 3Å; K250-L252 VanDerWaalsContact C-N 3.28Å
251	K	94.6	Very high	94.5	Very high	77 Å²	77	59.1 Å²	59.1	34%	0.335	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-11.4	178.4	-54.8	174.2	-168.4	176.3	0	112.5	M200 F248 M249 D305 D307	M200-K251 HydrophobicContact CE-CB 3.81Å; F248-K251 WeakPolarHBondContact O-CB 3.13Å; F248-K251 PolarHBondContact O-N 3.18Å; M249-K251 PolarHBondContact O-N 3.42Å; K251-D305 IonicContact NZ-OD1 3.37Å; K251-D305 PolarHBondContact NZ-OD1 2.67Å; K251-D305 IonicContact NZ-OD2 3.22Å; K251-D305 PolarHBondContact NZ-OD2 3.31Å; K251-D307 IonicContact NZ-OD2 2.95Å; K251-D307 PolarHBondContact NZ-OD2 3.17Å
252	L	94.1	Very high	94.3	Very high	11 Å²	11	62.6 Å²	62.6	6%	0.058	33%	0.331	C	S	.	.	S	Bend	trans	-80.8	149.1	-177.5	-59.8	176.7	0	0	0	112.1	L198 M200 F248 M249 K250 V256 R257 V260	L198-L252 HydrophobicContact CB-CD2 4.09Å; L198-L252 HydrophobicContact CD1-CD2 3.83Å; M200-L252 HydrophobicContact CE-CD2 4.14Å; M200-L252 HydrophobicContact CG-CD2 3.61Å; M200-L252 HydrophobicContact SD-CD2 3.36Å; M200-L252 WeakPolarHBondContact SD-CD2 3.26Å; F248-L252 HydrophobicContact CE1-CD1 4.39Å; F248-L252 HydrophobicContact CE1-CD2 4.33Å; F248-L252 HydrophobicContact CZ-CD2 4.46Å; M249-L252 HydrophobicContact CB-CD1 4.49Å; M249-L252 WeakPolarHBondContact O-CB 3.38Å; M249-L252 PolarHBondContact O-N 2.96Å; K250-L252 VanDerWaalsContact C-N 3.28Å; L252-V256 HydrophobicContact CD2-CG1 4.46Å; L252-R257 HydrophobicContact CB-CB 3.85Å; L252-R257 HydrophobicContact CB-CG 4.48Å; L252-V260 HydrophobicContact CD1-CB 4.02Å; L252-V260 HydrophobicContact CD1-CG1 4.19Å; L252-V260 HydrophobicContact CD1-CG2 3.91Å
253	Q	93.1	Very high	94.1	Very high	127 Å²	127	66.3 Å²	66.3	59%	0.593	34%	0.343	S	S	*	.			trans	-59	145.5	168.7	-70.3	-65.5	-19.7	0	0	110.7	T255 V256 R257	Q253-T255 VanDerWaalsContact C-N 3.31Å; Q253-T255 PolarHBondContact O-N 3.25Å; Q253-T255 VanDerWaalsContact O-N 3.12Å; Q253-V256 HydrophobicContact CB-CG2 4.38Å; Q253-V256 PolarHBondContact O-N 2.92Å; Q253-V256 VanDerWaalsContact O-N 3.1Å; Q253-R257 WeakPolarHBondContact O-CB 3.16Å; Q253-R257 PolarHBondContact O-N 3.39Å
254	P	93.6	Very high	94	Very high	98 Å²	98	67.9 Å²	67.9	64%	0.636	35%	0.354	S	S	*	.	H	α-helix	trans	-53.3	-40.5	-170	-29.4	35.3	0	0	0	115.3	N258	P254-N258 WeakPolarHBondContact O-CB 3.43Å; P254-N258 PolarHBondContact O-N 2.89Å
255	T	93.1	Very high	94	Very high	114 Å²	114	73 Å²	73	70%	0.699	38%	0.375	S	S	*	.	H	α-helix	trans	-68.3	-46.2	179.5	49.2	0	0	0	0	112	Q253 N258 Y259	Q253-T255 VanDerWaalsContact C-N 3.31Å; Q253-T255 PolarHBondContact O-N 3.25Å; Q253-T255 VanDerWaalsContact O-N 3.12Å; T255-N258 PolarHBondContact O-N 3.37Å; T255-Y259 PolarHBondContact O-N 3.26Å; T255-Y259 VanDerWaalsContact O-N 3.16Å
256	V	92.6	Very high	94	Very high	38 Å²	38	73.9 Å²	73.9	23%	0.23	37%	0.371	C	S	.	.	H	α-helix	trans	-65.7	-41.8	177.1	-177.9	0	0	0	0	110.4	L198 L252 Q253 N258 Y259 V260	L198-V256 HydrophobicContact CB-CG1 4.09Å; L198-V256 HydrophobicContact CD2-CG1 3.86Å; L252-V256 HydrophobicContact CD2-CG1 4.46Å; Q253-V256 HydrophobicContact CB-CG2 4.38Å; Q253-V256 PolarHBondContact O-N 2.92Å; Q253-V256 VanDerWaalsContact O-N 3.1Å; V256-N258 PolarHBondContact O-N 3.26Å; V256-Y259 WeakPolarHBondContact O-CB 3.31Å; V256-Y259 PolarHBondContact O-N 3.24Å; V256-V260 HydrophobicContact CG1-CG2 4.31Å; V256-V260 WeakPolarHBondContact O-CG2 3.07Å; V256-V260 PolarHBondContact O-N 2.87Å
257	R	94.3	Very high	94.1	Very high	79 Å²	79	77.6 Å²	77.6	30%	0.298	39%	0.39	S	S	.	.	H	α-helix	trans	-56.9	-50.2	176	-174.4	176.5	173.2	179.7	-6.4	111.7	M249 L252 Q253 Y259 V260 E261	M249-R257 VanDerWaalsContact O-CD 3.27Å; M249-R257 WeakPolarHBondContact O-CD 3.48Å; M249-R257 WeakPolarHBondContact O-CG 3.35Å; L252-R257 HydrophobicContact CB-CB 3.85Å; L252-R257 HydrophobicContact CB-CG 4.48Å; Q253-R257 WeakPolarHBondContact O-CB 3.16Å; Q253-R257 PolarHBondContact O-N 3.39Å; R257-Y259 VanDerWaalsContact C-N 3.28Å; R257-Y259 PolarHBondContact O-N 3.49Å; R257-V260 PolarHBondContact O-N 2.86Å; R257-E261 HydrophobicContact CG-CG 4.22Å; R257-E261 IonicContact CZ-OE1 2.8Å; R257-E261 VanDerWaalsContact CZ-OE1 3.32Å; R257-E261 IonicContact NE-OE1 2.88Å; R257-E261 PolarHBondContact NE-OE1 2.83Å; R257-E261 IonicContact NE-OE2 3.17Å; R257-E261 IonicContact NH2-OE1 2.65Å; R257-E261 PolarHBondContact NH2-OE1 3.35Å; R257-E261 WeakPolarHBondContact O-CB 3.29Å; R257-E261 WeakPolarHBondContact O-CG 3.46Å; R257-E261 PolarHBondContact O-N 3.44Å
258	N	93.9	Very high	94.1	Very high	94 Å²	94	73.3 Å²	73.3	50%	0.503	38%	0.376	S	S	.	.	H	α-helix	trans	-59.7	-40.9	178.1	-172	27.3	0	0	0	111.3	P254 T255 V256 N262	P254-N258 WeakPolarHBondContact O-CB 3.43Å; P254-N258 PolarHBondContact O-N 2.89Å; T255-N258 PolarHBondContact O-N 3.37Å; V256-N258 PolarHBondContact O-N 3.26Å; N258-N262 WeakPolarHBondContact O-CB 3.35Å; N258-N262 VanDerWaalsContact O-CG 3.26Å; N258-N262 PolarHBondContact O-N 2.94Å; N258-N262 PolarHBondContact O-ND2 3.49Å; N258-N262 PolarHBondContact OD1-ND2 2.86Å
259	Y	92.2	Very high	94.1	Very high	61 Å²	61	76.7 Å²	76.7	24%	0.239	39%	0.393	C	S	.	.	H	α-helix	trans	-61	-47.7	175.2	172	-96.9	0	0	0	112.5	I231 T255 V256 R257 R263	I231-Y259 HydrophobicContact CG1-CE2 4.38Å; I231-Y259 WeakPolarHBondContact CG2-OH 3.35Å; T255-Y259 PolarHBondContact O-N 3.26Å; T255-Y259 VanDerWaalsContact O-N 3.16Å; V256-Y259 WeakPolarHBondContact O-CB 3.31Å; V256-Y259 PolarHBondContact O-N 3.24Å; R257-Y259 VanDerWaalsContact C-N 3.28Å; R257-Y259 PolarHBondContact O-N 3.49Å; Y259-R263 PolarHBondContact O-NE 2.94Å
260	V	92.4	Very high	94.3	Very high	2 Å²	2	82.7 Å²	82.7	1%	0.012	42%	0.419	C	S	.	.	H	α-helix	trans	-67.3	-42.9	-179.6	172.4	0	0	0	0	111.8	L198 W234 M249 L252 V256 R257 N262 R263	L198-V260 HydrophobicContact CD2-CG2 3.92Å; W234-V260 HydrophobicContact CZ2-CG1 3.69Å; W234-V260 HydrophobicContact CZ2-CG2 4.19Å; M249-V260 HydrophobicContact CG-CG1 4.22Å; M249-V260 HydrophobicContact SD-CG1 4.13Å; L252-V260 HydrophobicContact CD1-CB 4.02Å; L252-V260 HydrophobicContact CD1-CG1 4.19Å; L252-V260 HydrophobicContact CD1-CG2 3.91Å; V256-V260 HydrophobicContact CG1-CG2 4.31Å; V256-V260 WeakPolarHBondContact O-CG2 3.07Å; V256-V260 PolarHBondContact O-N 2.87Å; R257-V260 PolarHBondContact O-N 2.86Å; V260-N262 VanDerWaalsContact C-N 3.28Å; V260-N262 PolarHBondContact O-N 2.99Å; V260-R263 WeakPolarHBondContact O-CB 3.25Å; V260-R263 PolarHBondContact O-N 2.96Å
261	E	93.4	Very high	94.4	Very high	68 Å²	68	77.4 Å²	77.4	32%	0.318	40%	0.396	S	S	.	.	H	α-helix	trans	-63.8	-34.3	-179.8	-78.6	178.2	165.7	0	0	112.1	M249 R257 R263 K265	M249-E261 HydrophobicContact CE-CG 4.41Å; M249-E261 HydrophobicContact SD-CG 3.61Å; R257-E261 HydrophobicContact CG-CG 4.22Å; R257-E261 IonicContact CZ-OE1 2.8Å; R257-E261 VanDerWaalsContact CZ-OE1 3.32Å; R257-E261 IonicContact NE-OE1 2.88Å; R257-E261 PolarHBondContact NE-OE1 2.83Å; R257-E261 IonicContact NE-OE2 3.17Å; R257-E261 IonicContact NH2-OE1 2.65Å; R257-E261 PolarHBondContact NH2-OE1 3.35Å; R257-E261 WeakPolarHBondContact O-CB 3.29Å; R257-E261 WeakPolarHBondContact O-CG 3.46Å; R257-E261 PolarHBondContact O-N 3.44Å; E261-R263 VanDerWaalsContact C-N 3.32Å; E261-R263 PolarHBondContact O-N 3.14Å; E261-K265 PolarHBondContact O-NZ 2.67Å
262	N	93.6	Very high	94.4	Very high	108 Å²	108	79.1 Å²	79.1	58%	0.578	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	1.6	177.8	-71	-40.2	0	0	0	114.7	N258 V260	N258-N262 WeakPolarHBondContact O-CB 3.35Å; N258-N262 VanDerWaalsContact O-CG 3.26Å; N258-N262 PolarHBondContact O-N 2.94Å; N258-N262 PolarHBondContact O-ND2 3.49Å; N258-N262 PolarHBondContact OD1-ND2 2.86Å; V260-N262 VanDerWaalsContact C-N 3.28Å; V260-N262 PolarHBondContact O-N 2.99Å
263	R	92.7	Very high	94.5	Very high	81 Å²	81	84.7 Å²	84.7	31%	0.306	43%	0.431	S	S	.	.	S	Bend	trans	-74.1	153.7	170.9	-66.5	-60.1	94.8	-169.2	2.6	110.8	I238 Y259 V260 E261	I238-R263 HydrophobicContact CD1-CB 3.93Å; I238-R263 HydrophobicContact CD1-CG 4.23Å; Y259-R263 PolarHBondContact O-NE 2.94Å; V260-R263 WeakPolarHBondContact O-CB 3.25Å; V260-R263 PolarHBondContact O-N 2.96Å; E261-R263 VanDerWaalsContact C-N 3.32Å; E261-R263 PolarHBondContact O-N 3.14Å
264	P	94.1	Very high	94.7	Very high	71 Å²	71	79.1 Å²	79.1	46%	0.461	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-51.9	142.6	169.3	-23.4	33.2	0	0	0	111.3	Y266	P264-Y266 HydrophobicContact CB-CE2 3.79Å; P264-Y266 HydrophobicContact CG-CE2 4.41Å; P264-Y266 WeakPolarHBondContact O-CD2 3.5Å; P264-Y266 WeakPolarHBondContact O-CE2 3.3Å
265	K	95.4	Very high	94.8	Very high	123 Å²	123	74.5 Å²	74.5	54%	0.535	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-83.4	124.1	177.2	-59.8	-58.9	-179.2	-157.3	0	109.3	T243 E261	T243-K265 HydrophobicContact CG2-CD 3.73Å; T243-K265 WeakPolarHBondContact OG1-CA 3.08Å; E261-K265 PolarHBondContact O-NZ 2.67Å
266	Y	96.4	Very high	94.9	Very high	69 Å²	69	70.3 Å²	70.3	27%	0.271	35%	0.35	S	S	.	.			trans	-112.7	133.8	178	-63.5	-82.4	0	0	0	109.5	I238 E239 G242 T243 P264 G268	I238-Y266 HydrophobicContact CB-CD2 4.39Å; I238-Y266 HydrophobicContact CD1-CD2 3.98Å; I238-Y266 HydrophobicContact CD1-CE2 4.01Å; I238-Y266 HydrophobicContact CG1-CD2 3.89Å; I238-Y266 HydrophobicContact CG1-CE2 4.11Å; I238-Y266 WeakPolarHBondContact O-CB 3.02Å; E239-Y266 HydrophobicContact CG-CD1 4.24Å; E239-Y266 HydrophobicContact CG-CD2 4.47Å; E239-Y266 HydrophobicContact CG-CE1 3.74Å; E239-Y266 HydrophobicContact CG-CE2 4.01Å; G242-Y266 CarbonylContact C-O 3.43Å; G242-Y266 VanDerWaalsContact CA-O 3.3Å; G242-Y266 WeakPolarHBondContact CA-O 3.39Å; T243-Y266 PolarHBondContact N-O 3.48Å; T243-Y266 PolarHBondContact OG1-N 3Å; P264-Y266 HydrophobicContact CB-CE2 3.79Å; P264-Y266 HydrophobicContact CG-CE2 4.41Å; P264-Y266 WeakPolarHBondContact O-CD2 3.5Å; P264-Y266 WeakPolarHBondContact O-CE2 3.3Å; Y266-G268 PolarHBondContact O-N 3.01Å
267	P	95.8	Very high	94.9	Very high	137 Å²	137	73.3 Å²	73.3	89%	0.89	36%	0.364	S	S	*	.			trans	-71.9	-18.4	178	29.3	-34.7	0	0	0	113.2
268	G	95.4	Very high	94.7	Very high	22 Å²	22	79.6 Å²	79.6	23%	0.227	39%	0.388	C	S	.	.			trans	82.1	150.4	-168.4	0	0	0	0	0	111.9	Q240 G242 Y266	Q240-G268 WeakPolarHBondContact O-CA 3.35Å; G242-G268 VanDerWaalsContact CA-CA 3.45Å; G242-G268 VanDerWaalsContact N-CA 3.33Å; Y266-G268 PolarHBondContact O-N 3.01Å
269	I	96.6	Very high	94.7	Very high	71 Å²	71	76.7 Å²	76.7	36%	0.364	37%	0.372	S	S	.	.			trans	-92.7	137.2	174.9	-57.7	173.4	0	0	0	107	Q240 E273 L274	Q240-I269 PolarHBondContact O-N 2.92Å; I269-E273 HydrophobicContact CG2-CB 3.55Å; I269-L274 HydrophobicContact CG2-CB 4.25Å
270	K	97.3	Very high	94.7	Very high	141 Å²	141	74.2 Å²	74.2	61%	0.613	36%	0.363	S	S	*	.			trans	-63.5	147.9	176.2	-66.4	-179.4	-178.8	173	0	110.5	E272 E273 L274	K270-E272 PolarHBondContact O-N 2.82Å; K270-E273 HydrophobicContact CB-CG 4.42Å; K270-E273 PolarHBondContact O-N 3.25Å; K270-L274 PolarHBondContact O-N 2.98Å
271	F	97.2	Very high	94.3	Very high	34 Å²	34	76.2 Å²	76.2	15%	0.149	38%	0.376	C	S	.	.	H	α-helix	trans	-63.3	-26.6	-178.7	-88.8	-99.5	0	0	0	112.9	L241 E273 F275 R295 L298 S299 L302	L241-F271 HydrophobicContact CD2-CE2 4.27Å; L241-F271 HydrophobicContact CD2-CZ 3.95Å; F271-E273 VanDerWaalsContact C-N 3.31Å; F271-F275 AromaticContact CD1-CD2 3.73Å; F271-F275 HydrophobicContact CD1-CD2 3.73Å; F271-F275 AromaticContact CD1-CE2 3.7Å; F271-F275 HydrophobicContact CD1-CE2 3.7Å; F271-F275 HydrophobicContact CE1-CD2 4.29Å; F271-F275 AromaticContact CE1-CE2 3.78Å; F271-F275 HydrophobicContact CE1-CE2 3.78Å; F271-F275 WeakPolarHBondContact O-CA 3.5Å; F271-F275 WeakPolarHBondContact O-CB 3.37Å; F271-F275 PolarHBondContact O-N 3.34Å; F271-R295 HydrophobicContact CB-CG 3.94Å; F271-L298 HydrophobicContact CD1-CB 4.12Å; F271-L298 HydrophobicContact CE1-CB 4.05Å; F271-S299 VanDerWaalsContact CE1-CA 3.42Å; F271-L302 HydrophobicContact CE1-CB 4.17Å; F271-L302 HydrophobicContact CE1-CD1 4.29Å; F271-L302 HydrophobicContact CZ-CB 3.93Å
272	E	96	Very high	93.4	Very high	113 Å²	113	75.8 Å²	75.8	53%	0.528	38%	0.38	S	S	.	.	H	α-helix	trans	-68.4	-30.1	172.9	-62.1	71.5	-155.7	0	0	112.6	K270 F275 P276	K270-E272 PolarHBondContact O-N 2.82Å; E272-F275 CarbonylContact O-C 3.53Å; E272-P276 WeakPolarHBondContact O-CA 3.37Å
273	E	96.3	Very high	92.5	Very high	128 Å²	128	79.9 Å²	79.9	60%	0.598	40%	0.396	S	S	*	.	H	α-helix	trans	-85.6	-35.5	176.1	-67.9	172.6	-141.8	0	0	111	I269 K270 F271	I269-E273 HydrophobicContact CG2-CB 3.55Å; K270-E273 HydrophobicContact CB-CG 4.42Å; K270-E273 PolarHBondContact O-N 3.25Å; F271-E273 VanDerWaalsContact C-N 3.31Å
274	L	95.8	Very high	92	Very high	10 Å²	10	78.4 Å²	78.4	5%	0.052	40%	0.398	C	S	.	.	H	α-helix	trans	-72	-35.6	178.2	-175.3	60.1	0	0	0	112.4	K220 Q240 L241 I269 K270	K220-L274 PolarHBondContact NZ-O 3.03Å; Q240-L274 VanDerWaalsContact OE1-CD1 3.24Å; L241-L274 HydrophobicContact CD2-CD2 4.22Å; I269-L274 HydrophobicContact CG2-CB 4.25Å; K270-L274 PolarHBondContact O-N 2.98Å
275	F	96.5	Very high	91.4	Very high	0 Å²	0	81.2 Å²	81.2	0%	0	41%	0.405	C	S	.	.	S	Bend	trans	-130	76.9	176.8	-54	-82	0	0	0	110.2	K220 I224 F271 E272 I279 F280 R295 L298 L302	K220-F275 HydrophobicContact CD-CD1 3.89Å; K220-F275 HydrophobicContact CD-CE1 3.58Å; K220-F275 HydrophobicContact CD-CZ 4.48Å; K220-F275 HydrophobicContact CG-CD1 3.89Å; K220-F275 HydrophobicContact CG-CE1 3.88Å; I224-F275 HydrophobicContact CD1-CE1 4.43Å; I224-F275 HydrophobicContact CD1-CZ 4.11Å; F271-F275 AromaticContact CD1-CD2 3.73Å; F271-F275 HydrophobicContact CD1-CD2 3.73Å; F271-F275 AromaticContact CD1-CE2 3.7Å; F271-F275 HydrophobicContact CD1-CE2 3.7Å; F271-F275 HydrophobicContact CE1-CD2 4.29Å; F271-F275 AromaticContact CE1-CE2 3.78Å; F271-F275 HydrophobicContact CE1-CE2 3.78Å; F271-F275 WeakPolarHBondContact O-CA 3.5Å; F271-F275 WeakPolarHBondContact O-CB 3.37Å; F271-F275 PolarHBondContact O-N 3.34Å; E272-F275 CarbonylContact O-C 3.53Å; F275-I279 HydrophobicContact CB-CD1 3.97Å; F275-I279 HydrophobicContact CD1-CD1 3.91Å; F275-I279 HydrophobicContact CG-CD1 4.43Å; F275-F280 HydrophobicContact CB-CE2 3.75Å; F275-F280 HydrophobicContact CB-CZ 3.87Å; F275-F280 WeakPolarHBondContact O-CE2 3.36Å; F275-R295 PolarHBondContact O-NE 3.11Å; F275-R295 PolarHBondContact O-NH2 3.25Å; F275-L298 HydrophobicContact CD1-CD1 3.93Å; F275-L298 HydrophobicContact CD2-CD1 4Å; F275-L298 HydrophobicContact CE1-CD1 4Å; F275-L298 HydrophobicContact CE2-CB 4.36Å; F275-L298 HydrophobicContact CE2-CD1 4.04Å; F275-L298 HydrophobicContact CE2-CD2 4.47Å; F275-L298 HydrophobicContact CG-CD1 3.94Å; F275-L298 HydrophobicContact CZ-CD1 4.05Å; F275-L298 HydrophobicContact CZ-CD2 4.13Å; F275-L302 HydrophobicContact CE2-CD1 4.24Å; F275-L302 HydrophobicContact CZ-CD1 4Å
276	P	95.1	Very high	90.8	Very high	26 Å²	26	85.2 Å²	85.2	17%	0.169	42%	0.417	C	S	.	.			trans	-67.3	160.3	-180	29.7	-37	0	0	0	112.3	E272 W278 I279 F280	E272-P276 WeakPolarHBondContact O-CA 3.37Å; P276-W278 HydrophobicContact CB-CG 4.5Å; P276-W278 HydrophobicContact CG-CD2 4.26Å; P276-W278 VanDerWaalsContact CG-CE2 3.46Å; P276-W278 HydrophobicContact CG-CG 4.41Å; P276-W278 HydrophobicContact CG-CZ2 3.79Å; P276-W278 PolarHBondContact O-N 3.17Å; P276-W278 VanDerWaalsContact O-N 3.17Å; P276-I279 HydrophobicContact CG-CG1 4.27Å; P276-I279 HydrophobicContact CG-CG2 4.26Å; P276-I279 WeakPolarHBondContact O-CG1 3.4Å; P276-I279 PolarHBondContact O-N 3.18Å; P276-F280 WeakPolarHBondContact O-CD2 3.28Å
277	D	92.5	Very high	90.4	Very high	101 Å²	101	83.7 Å²	83.7	54%	0.54	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-58.8	-33.3	-174.7	-68.6	-23.3	0	0	0	113.4	I279 F280 R295	D277-I279 VanDerWaalsContact C-N 3.26Å; D277-I279 PolarHBondContact O-N 2.79Å; D277-F280 PolarHBondContact O-N 3.4Å; D277-F280 VanDerWaalsContact O-N 3.09Å; D277-R295 IonicContact OD1-CZ 3.7Å; D277-R295 IonicContact OD1-NH1 2.84Å; D277-R295 PolarHBondContact OD1-NH1 3.09Å; D277-R295 IonicContact OD1-NH2 3.47Å; D277-R295 PolarHBondContact OD1-NH2 3.19Å
278	W	91.4	Very high	90.1	Very high	211 Å²	211	82.8 Å²	82.8	80%	0.799	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-71.1	-12.6	-175	62.7	-97.1	0	0	0	115.2	P276	P276-W278 HydrophobicContact CB-CG 4.5Å; P276-W278 HydrophobicContact CG-CD2 4.26Å; P276-W278 VanDerWaalsContact CG-CE2 3.46Å; P276-W278 HydrophobicContact CG-CG 4.41Å; P276-W278 HydrophobicContact CG-CZ2 3.79Å; P276-W278 PolarHBondContact O-N 3.17Å; P276-W278 VanDerWaalsContact O-N 3.17Å
279	I	93	Very high	90	Very high	33 Å²	33	86.8 Å²	86.8	17%	0.169	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-88.9	-9.2	172.6	60.4	162.9	0	0	0	112.6	V219 K220 F275 P276 D277	V219-I279 HydrophobicContact CB-CD1 4.45Å; V219-I279 HydrophobicContact CG1-CB 4.24Å; V219-I279 HydrophobicContact CG1-CD1 3.47Å; V219-I279 VanDerWaalsContact CG1-CD1 3.47Å; V219-I279 HydrophobicContact CG1-CG1 3.69Å; K220-I279 HydrophobicContact CG-CD1 3.7Å; F275-I279 HydrophobicContact CB-CD1 3.97Å; F275-I279 HydrophobicContact CD1-CD1 3.91Å; F275-I279 HydrophobicContact CG-CD1 4.43Å; P276-I279 HydrophobicContact CG-CG1 4.27Å; P276-I279 HydrophobicContact CG-CG2 4.26Å; P276-I279 WeakPolarHBondContact O-CG1 3.4Å; P276-I279 PolarHBondContact O-N 3.18Å; D277-I279 VanDerWaalsContact C-N 3.26Å; D277-I279 PolarHBondContact O-N 2.79Å
280	F	92.2	Very high	90	Very high	9 Å²	9	85.6 Å²	85.6	4%	0.039	40%	0.402	C	S	.	.	S	Bend	trans	-93.4	151	174.2	-66.7	-89.2	0	0	0	110.3	V219 F275 P276 D277 S282 T291 A294 R295 L298	V219-F280 HydrophobicContact CB-CE1 4.24Å; V219-F280 HydrophobicContact CG1-CD1 3.62Å; V219-F280 HydrophobicContact CG1-CD2 4.13Å; V219-F280 HydrophobicContact CG1-CE1 3.47Å; V219-F280 VanDerWaalsContact CG1-CE1 3.47Å; V219-F280 HydrophobicContact CG1-CE2 4Å; V219-F280 HydrophobicContact CG1-CG 3.96Å; V219-F280 HydrophobicContact CG1-CZ 3.68Å; V219-F280 HydrophobicContact CG2-CD1 4.12Å; V219-F280 HydrophobicContact CG2-CE1 3.66Å; V219-F280 HydrophobicContact CG2-CZ 4.37Å; F275-F280 HydrophobicContact CB-CE2 3.75Å; F275-F280 HydrophobicContact CB-CZ 3.87Å; F275-F280 WeakPolarHBondContact O-CE2 3.36Å; P276-F280 WeakPolarHBondContact O-CD2 3.28Å; D277-F280 PolarHBondContact O-N 3.4Å; D277-F280 VanDerWaalsContact O-N 3.09Å; F280-S282 PolarHBondContact O-N 3.25Å; F280-S282 VanDerWaalsContact O-N 3.12Å; F280-T291 HydrophobicContact CB-CG2 3.99Å; F280-T291 VanDerWaalsContact CB-OG1 3.26Å; F280-T291 WeakPolarHBondContact CB-OG1 3.32Å; F280-T291 HydrophobicContact CD1-CG2 4.48Å; F280-T291 HydrophobicContact CD2-CG2 3.63Å; F280-T291 HydrophobicContact CE2-CG2 4.18Å; F280-T291 HydrophobicContact CG-CG2 3.79Å; F280-A294 HydrophobicContact CD1-CB 4.22Å; F280-A294 HydrophobicContact CE1-CB 3.67Å; F280-A294 HydrophobicContact CZ-CB 4.49Å; F280-R295 HydrophobicContact CZ-CB 4.48Å; F280-L298 HydrophobicContact CZ-CD1 4.3Å
281	P	83.1	Confident	89.9	Confident	44 Å²	44	79 Å²	79	29%	0.286	37%	0.374	S	S	.	.			trans	-59.5	116.9	167.8	-15	28.4	0	0	0	108.7	L123 H125	L123-P281 WeakPolarHBondContact O-CG 3.48Å; H125-P281 PolarHBondContact CD2-O 3.39Å; H125-P281 PolarHBondContact NE2-O 2.71Å; H125-P281 VanDerWaalsContact NE2-O 3.11Å
282	S	76.1	Confident	89.8	Confident	59 Å²	59	80.7 Å²	80.7	41%	0.413	39%	0.39	S	S	.	.			trans	-143.7	87.9	-175.1	-71.6	0	0	0	0	111	F280 T291	F280-S282 PolarHBondContact O-N 3.25Å; F280-S282 VanDerWaalsContact O-N 3.12Å; S282-T291 PolarHBondContact OG-OG1 2.88Å
283	E	73.2	Confident	89.9	Confident	195 Å²	195	77.4 Å²	77.4	91%	0.911	38%	0.375	S	S	*	.	S	Bend	trans	-109.6	-29.6	175.7	-62.6	-170.8	174.7	0	0	112.2	D287	E283-D287 PolarHBondContact N-OD2 2.97Å
284	S	82	Confident	89.9	Confident	49 Å²	49	71.3 Å²	71.3	34%	0.343	35%	0.347	S	S	.	.	S	Bend	trans	-124.6	164.5	-173	75.7	0	0	0	0	113.9	R286 D287 K288	S284-R286 PolarHBondContact O-N 3.17Å; S284-R286 PolarHBondContact OG-N 2.8Å; S284-D287 WeakPolarHBondContact CB-OD2 3.46Å; S284-D287 PolarHBondContact N-OD2 3.17Å; S284-D287 WeakPolarHBondContact O-CB 3.37Å; S284-D287 PolarHBondContact O-N 2.96Å; S284-D287 PolarHBondContact OG-N 3.25Å; S284-D287 PolarHBondContact OG-OD2 3.47Å; S284-K288 PolarHBondContact O-N 3.16Å
285	E	82	Confident	90	Very high	131 Å²	131	71.8 Å²	71.8	61%	0.612	35%	0.348	S	S	*	.	H	α-helix	trans	-60.6	-29.4	171.5	-72	-59.7	129.8	0	0	112.7	D287 K288 I289	E285-D287 VanDerWaalsContact C-N 3.3Å; E285-K288 PolarHBondContact O-N 2.65Å; E285-K288 WeakPolarHBondContact OE1-CE 3.35Å; E285-K288 IonicContact OE1-NZ 3.64Å; E285-K288 PolarHBondContact OE1-NZ 2.92Å; E285-K288 IonicContact OE2-NZ 3.39Å; E285-I289 PolarHBondContact O-N 3Å
286	R	84.1	Confident	90.1	Very high	207 Å²	207	74.8 Å²	74.8	78%	0.781	36%	0.363	S	S	*	.	H	α-helix	trans	-65.8	-37.7	174.1	-68	-178.1	179.8	-178.5	0.8	110.9	S284 K288 I289 K290	S284-R286 PolarHBondContact O-N 3.17Å; S284-R286 PolarHBondContact OG-N 2.8Å; R286-K288 VanDerWaalsContact C-N 3.34Å; R286-I289 PolarHBondContact O-N 3.33Å; R286-K290 PolarHBondContact O-N 2.85Å
287	D	87.1	Confident	90.3	Very high	36 Å²	36	73.5 Å²	73.5	19%	0.193	36%	0.355	C	S	.	.	H	α-helix	trans	-68.1	-34.1	177.2	-56.5	-39.4	0	0	0	111.7	H125 E283 S284 E285 I289 K290 T291	H125-D287 IonicContact CD2-OD1 2.68Å; H125-D287 PolarHBondContact NE2-O 3.08Å; E283-D287 PolarHBondContact N-OD2 2.97Å; S284-D287 WeakPolarHBondContact CB-OD2 3.46Å; S284-D287 PolarHBondContact N-OD2 3.17Å; S284-D287 WeakPolarHBondContact O-CB 3.37Å; S284-D287 PolarHBondContact O-N 2.96Å; S284-D287 PolarHBondContact OG-N 3.25Å; S284-D287 PolarHBondContact OG-OD2 3.47Å; E285-D287 VanDerWaalsContact C-N 3.3Å; D287-I289 VanDerWaalsContact C-N 3.32Å; D287-I289 PolarHBondContact O-N 2.88Å; D287-K290 CarbonylContact O-C 3.55Å; D287-K290 PolarHBondContact O-N 3.16Å; D287-K290 VanDerWaalsContact O-N 3.15Å; D287-T291 WeakPolarHBondContact O-CB 3.3Å; D287-T291 PolarHBondContact O-N 2.84Å; D287-T291 PolarHBondContact O-OG1 2.76Å
288	K	90.3	Very high	90.5	Very high	119 Å²	119	68.7 Å²	68.7	52%	0.517	33%	0.33	S	S	.	.	H	α-helix	trans	-60.5	-41.6	173.3	-66.5	-179.2	-177.6	170.5	0	112.5	S284 E285 R286 S292	S284-K288 PolarHBondContact O-N 3.16Å; E285-K288 PolarHBondContact O-N 2.65Å; E285-K288 WeakPolarHBondContact OE1-CE 3.35Å; E285-K288 IonicContact OE1-NZ 3.64Å; E285-K288 PolarHBondContact OE1-NZ 2.92Å; E285-K288 IonicContact OE2-NZ 3.39Å; R286-K288 VanDerWaalsContact C-N 3.34Å; K288-S292 PolarHBondContact O-N 2.97Å; K288-S292 VanDerWaalsContact O-N 3.13Å
289	I	93.2	Very high	90.9	Very high	105 Å²	105	60.6 Å²	60.6	54%	0.538	31%	0.305	S	S	.	.	H	α-helix	trans	-64.3	-44.9	174.7	-62.9	172.3	0	0	0	109.9	E285 R286 D287 S292 Q293	E285-I289 PolarHBondContact O-N 3Å; R286-I289 PolarHBondContact O-N 3.33Å; D287-I289 VanDerWaalsContact C-N 3.32Å; D287-I289 PolarHBondContact O-N 2.88Å; I289-S292 PolarHBondContact O-N 2.87Å; I289-Q293 HydrophobicContact CG2-CG 4.47Å; I289-Q293 VanDerWaalsContact O-CG 3.32Å; I289-Q293 WeakPolarHBondContact O-CG 3.44Å; I289-Q293 PolarHBondContact O-N 2.88Å
290	K	95	Very high	91.1	Very high	46 Å²	46	62.5 Å²	62.5	20%	0.2	31%	0.312	C	S	.	.	H	α-helix	trans	-65.1	-39	179.2	-75.1	-73.2	-178.8	-177	0	112.8	H125 R286 D287 Q293 A294 Y320	H125-K290 HydrophobicContact CB-CB 4.05Å; H125-K290 HydrophobicContact CB-CG 4.31Å; R286-K290 PolarHBondContact O-N 2.85Å; D287-K290 CarbonylContact O-C 3.55Å; D287-K290 PolarHBondContact O-N 3.16Å; D287-K290 VanDerWaalsContact O-N 3.15Å; K290-Q293 CarbonylContact O-C 3.58Å; K290-Q293 PolarHBondContact O-N 3.33Å; K290-A294 WeakPolarHBondContact O-CB 3.27Å; K290-A294 PolarHBondContact O-N 3.45Å; K290-Y320 HydrophobicContact CB-CE2 4.2Å; K290-Y320 HydrophobicContact CD-CD2 3.94Å; K290-Y320 HydrophobicContact CD-CE2 4Å; K290-Y320 WeakPolarHBondContact O-CE2 3.46Å
291	T	95.4	Very high	91.5	Very high	2 Å²	2	62 Å²	62	1%	0.012	31%	0.31	C	S	.	.	H	α-helix	trans	-57.7	-47.4	171.9	-73.9	0	0	0	0	111.3	H125 F280 S282 D287 Q293 A294 R295	H125-T291 PolarHBondContact CE1-N 3.31Å; H125-T291 PolarHBondContact NE2-OG1 2.8Å; F280-T291 HydrophobicContact CB-CG2 3.99Å; F280-T291 VanDerWaalsContact CB-OG1 3.26Å; F280-T291 WeakPolarHBondContact CB-OG1 3.32Å; F280-T291 HydrophobicContact CD1-CG2 4.48Å; F280-T291 HydrophobicContact CD2-CG2 3.63Å; F280-T291 HydrophobicContact CE2-CG2 4.18Å; F280-T291 HydrophobicContact CG-CG2 3.79Å; S282-T291 PolarHBondContact OG-OG1 2.88Å; D287-T291 WeakPolarHBondContact O-CB 3.3Å; D287-T291 PolarHBondContact O-N 2.84Å; D287-T291 PolarHBondContact O-OG1 2.76Å; T291-Q293 PolarHBondContact O-N 3.01Å; T291-A294 PolarHBondContact O-N 2.9Å; T291-R295 WeakPolarHBondContact O-CB 3.32Å; T291-R295 PolarHBondContact O-N 2.94Å
292	S	95.7	Very high	92.2	Very high	71 Å²	71	60.1 Å²	60.1	50%	0.497	30%	0.298	S	S	.	.	H	α-helix	trans	-60.7	-44.9	175	-176	0	0	0	0	112	K288 I289 A294 R295 D296	K288-S292 PolarHBondContact O-N 2.97Å; K288-S292 VanDerWaalsContact O-N 3.13Å; I289-S292 PolarHBondContact O-N 2.87Å; S292-A294 PolarHBondContact O-N 3.12Å; S292-R295 PolarHBondContact O-N 3.21Å; S292-D296 WeakPolarHBondContact O-CB 3.22Å; S292-D296 PolarHBondContact O-N 3.41Å
293	Q	97.2	Very high	93.3	Very high	44 Å²	44	58.9 Å²	58.9	21%	0.206	29%	0.287	C	S	.	.	H	α-helix	trans	-64.9	-37.8	176.6	-68.6	174.2	-4.5	0	0	112.9	I289 K290 T291 L297 H318 P319 Y320	I289-Q293 HydrophobicContact CG2-CG 4.47Å; I289-Q293 VanDerWaalsContact O-CG 3.32Å; I289-Q293 WeakPolarHBondContact O-CG 3.44Å; I289-Q293 PolarHBondContact O-N 2.88Å; K290-Q293 CarbonylContact O-C 3.58Å; K290-Q293 PolarHBondContact O-N 3.33Å; T291-Q293 PolarHBondContact O-N 3.01Å; Q293-L297 PolarHBondContact O-N 3.43Å; Q293-H318 PolarHBondContact O-CE1 3.48Å; Q293-P319 HydrophobicContact CG-CB 4.14Å; Q293-P319 PolarHBondContact OE1-O 2.95Å; Q293-Y320 HydrophobicContact CB-CD2 3.92Å; Q293-Y320 HydrophobicContact CB-CG 4.37Å
294	A	97.5	Very high	94.4	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-66	-45.4	177.7	0	0	0	0	0	111	M215 F280 K290 T291 S292 L297 L298 Y320	M215-A294 HydrophobicContact CE-CB 3.77Å; M215-A294 VanDerWaalsContact CE-O 3.23Å; M215-A294 WeakPolarHBondContact CE-O 3.45Å; F280-A294 HydrophobicContact CD1-CB 4.22Å; F280-A294 HydrophobicContact CE1-CB 3.67Å; F280-A294 HydrophobicContact CZ-CB 4.49Å; K290-A294 WeakPolarHBondContact O-CB 3.27Å; K290-A294 PolarHBondContact O-N 3.45Å; T291-A294 PolarHBondContact O-N 2.9Å; S292-A294 PolarHBondContact O-N 3.12Å; A294-L297 PolarHBondContact O-N 2.94Å; A294-L298 PolarHBondContact O-N 2.97Å; A294-Y320 HydrophobicContact CB-CD1 4.4Å; A294-Y320 HydrophobicContact CB-CD2 4.03Å; A294-Y320 HydrophobicContact CB-CE1 4.05Å; A294-Y320 HydrophobicContact CB-CE2 3.66Å; A294-Y320 HydrophobicContact CB-CG 4.39Å
295	R	97.6	Very high	95.1	Very high	20 Å²	20	48.4 Å²	48.4	8%	0.075	23%	0.233	C	C	.	.	H	α-helix	trans	-63.5	-42.6	175.9	-174	-178	-62.4	114.3	5.5	112.2	F271 F275 D277 F280 T291 S292 L297 L298 S299	F271-R295 HydrophobicContact CB-CG 3.94Å; F275-R295 PolarHBondContact O-NE 3.11Å; F275-R295 PolarHBondContact O-NH2 3.25Å; D277-R295 IonicContact OD1-CZ 3.7Å; D277-R295 IonicContact OD1-NH1 2.84Å; D277-R295 PolarHBondContact OD1-NH1 3.09Å; D277-R295 IonicContact OD1-NH2 3.47Å; D277-R295 PolarHBondContact OD1-NH2 3.19Å; F280-R295 HydrophobicContact CZ-CB 4.48Å; T291-R295 WeakPolarHBondContact O-CB 3.32Å; T291-R295 PolarHBondContact O-N 2.94Å; S292-R295 PolarHBondContact O-N 3.21Å; R295-L297 VanDerWaalsContact C-N 3.34Å; R295-L297 PolarHBondContact O-N 3.48Å; R295-L298 WeakPolarHBondContact O-CB 3.33Å; R295-L298 PolarHBondContact O-N 3.4Å; R295-S299 PolarHBondContact O-N 3.02Å
296	D	98.4	Very high	95.8	Very high	62 Å²	62	42.6 Å²	42.6	33%	0.332	21%	0.207	S	C	.	.	H	α-helix	trans	-59.8	-44.4	175.1	-179	45.1	0	0	0	111	S292 S299 K300 H318	S292-D296 WeakPolarHBondContact O-CB 3.22Å; S292-D296 PolarHBondContact O-N 3.41Å; D296-S299 PolarHBondContact O-N 2.79Å; D296-S299 PolarHBondContact O-OG 3.22Å; D296-K300 VanDerWaalsContact CG-NZ 3.25Å; D296-K300 WeakPolarHBondContact O-CG 3.36Å; D296-K300 PolarHBondContact O-N 2.88Å; D296-K300 WeakPolarHBondContact OD1-CE 3.35Å; D296-K300 IonicContact OD1-NZ 3.76Å; D296-K300 PolarHBondContact OD1-NZ 2.86Å; D296-K300 IonicContact OD2-NZ 2.95Å; D296-K300 PolarHBondContact OD2-NZ 3.4Å; D296-H318 IonicContact OD2-CE1 2.77Å; D296-H318 PolarHBondContact OD2-CE1 3.23Å; D296-H318 IonicContact OD2-NE2 3.32Å; D296-H318 PolarHBondContact OD2-NE2 2.58Å
297	L	98.6	Very high	96.4	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.4	-46.5	175	-173.3	56.1	0	0	0	112.3	M215 Q293 A294 R295 S299 K300 M301 I310 A315 H318 Y320 I321	M215-L297 HydrophobicContact CE-CB 4.38Å; M215-L297 HydrophobicContact CE-CD2 4.33Å; M215-L297 HydrophobicContact SD-CD2 4.07Å; M215-L297 HydrophobicContact SD-CG 4.25Å; Q293-L297 PolarHBondContact O-N 3.43Å; A294-L297 PolarHBondContact O-N 2.94Å; R295-L297 VanDerWaalsContact C-N 3.34Å; R295-L297 PolarHBondContact O-N 3.48Å; L297-S299 VanDerWaalsContact C-N 3.26Å; L297-S299 PolarHBondContact O-N 2.78Å; L297-K300 PolarHBondContact O-N 3.48Å; L297-K300 VanDerWaalsContact O-N 3.08Å; L297-M301 HydrophobicContact CD1-CE 3.76Å; L297-M301 HydrophobicContact CD1-CG 4.22Å; L297-M301 HydrophobicContact CD1-SD 4.35Å; L297-M301 HydrophobicContact CD2-CE 4Å; L297-M301 HydrophobicContact CG-CE 3.84Å; L297-M301 HydrophobicContact CG-CG 4.35Å; L297-M301 HydrophobicContact CG-SD 4.05Å; L297-M301 WeakPolarHBondContact O-CG 3.43Å; L297-M301 PolarHBondContact O-N 3.48Å; L297-I310 HydrophobicContact CD1-CD1 4.33Å; L297-A315 HydrophobicContact CD1-CB 4.49Å; L297-H318 HydrophobicContact CD1-CB 3.92Å; L297-Y320 HydrophobicContact CD2-CD1 4.05Å; L297-I321 HydrophobicContact CD2-CD1 3.92Å; L297-I321 HydrophobicContact CD2-CG1 3.64Å
298	L	98.5	Very high	96.9	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-54.9	-43.6	174.8	-82.3	164.8	0	0	0	111.5	G212 M215 F271 F275 F280 A294 R295 K300 M301 L302	G212-L298 WeakPolarHBondContact O-CD2 3.41Å; M215-L298 HydrophobicContact CB-CD2 3.89Å; M215-L298 HydrophobicContact CE-CD1 4.24Å; M215-L298 HydrophobicContact CE-CG 3.9Å; M215-L298 HydrophobicContact CG-CD1 4.49Å; M215-L298 HydrophobicContact CG-CD2 3.73Å; M215-L298 HydrophobicContact CG-CG 4.02Å; M215-L298 HydrophobicContact SD-CD2 3.93Å; M215-L298 HydrophobicContact SD-CG 3.77Å; F271-L298 HydrophobicContact CD1-CB 4.12Å; F271-L298 HydrophobicContact CE1-CB 4.05Å; F275-L298 HydrophobicContact CD1-CD1 3.93Å; F275-L298 HydrophobicContact CD2-CD1 4Å; F275-L298 HydrophobicContact CE1-CD1 4Å; F275-L298 HydrophobicContact CE2-CB 4.36Å; F275-L298 HydrophobicContact CE2-CD1 4.04Å; F275-L298 HydrophobicContact CE2-CD2 4.47Å; F275-L298 HydrophobicContact CG-CD1 3.94Å; F275-L298 HydrophobicContact CZ-CD1 4.05Å; F275-L298 HydrophobicContact CZ-CD2 4.13Å; F280-L298 HydrophobicContact CZ-CD1 4.3Å; A294-L298 PolarHBondContact O-N 2.97Å; R295-L298 WeakPolarHBondContact O-CB 3.33Å; R295-L298 PolarHBondContact O-N 3.4Å; L298-K300 PolarHBondContact O-N 3.23Å; L298-M301 PolarHBondContact O-N 3.12Å; L298-L302 HydrophobicContact CD2-CD1 4.11Å; L298-L302 WeakPolarHBondContact O-CB 3.22Å; L298-L302 PolarHBondContact O-N 3.3Å
299	S	98.3	Very high	97.2	Very high	40 Å²	40	36.1 Å²	36.1	28%	0.28	19%	0.188	S	C	.	.	H	α-helix	trans	-63.9	-26.9	179.6	82.8	0	0	0	0	113.9	F271 R295 D296 L297 V303	F271-S299 VanDerWaalsContact CE1-CA 3.42Å; R295-S299 PolarHBondContact O-N 3.02Å; D296-S299 PolarHBondContact O-N 2.79Å; D296-S299 PolarHBondContact O-OG 3.22Å; L297-S299 VanDerWaalsContact C-N 3.26Å; L297-S299 PolarHBondContact O-N 2.78Å; S299-V303 WeakPolarHBondContact O-CG2 3.4Å
300	K	98.6	Very high	97.5	Very high	73 Å²	73	31.9 Å²	31.9	32%	0.317	17%	0.166	S	C	.	.	H	α-helix	trans	-89.2	-27.2	178.4	-69	175.2	-171.2	157.8	0	113.1	D296 L297 L298 V303 I310 H318	D296-K300 VanDerWaalsContact CG-NZ 3.25Å; D296-K300 WeakPolarHBondContact O-CG 3.36Å; D296-K300 PolarHBondContact O-N 2.88Å; D296-K300 WeakPolarHBondContact OD1-CE 3.35Å; D296-K300 IonicContact OD1-NZ 3.76Å; D296-K300 PolarHBondContact OD1-NZ 2.86Å; D296-K300 IonicContact OD2-NZ 2.95Å; D296-K300 PolarHBondContact OD2-NZ 3.4Å; L297-K300 PolarHBondContact O-N 3.48Å; L297-K300 VanDerWaalsContact O-N 3.08Å; L298-K300 PolarHBondContact O-N 3.23Å; K300-V303 WeakPolarHBondContact O-CG2 2.93Å; K300-I310 HydrophobicContact CB-CB 3.98Å; K300-I310 HydrophobicContact CB-CD1 4.09Å; K300-I310 HydrophobicContact CB-CG2 4.08Å; K300-I310 HydrophobicContact CD-CD1 4.08Å; K300-I310 VanDerWaalsContact O-CG2 3.32Å; K300-I310 WeakPolarHBondContact O-CG2 3.47Å; K300-I310 PolarHBondContact O-N 3.08Å; K300-I310 VanDerWaalsContact O-N 3.08Å; K300-H318 PolarHBondContact NZ-NE2 3.24Å; K300-H318 VanDerWaalsContact NZ-NE2 3.15Å
301	M	98.6	Very high	97.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-83.8	-45.1	176.6	-67.5	-174.6	164.1	0	0	112.7	L136 I208 V211 M215 L297 L298 V303 R309 I310 A315	L136-M301 HydrophobicContact CD1-CE 4.36Å; L136-M301 HydrophobicContact CD2-CE 4.32Å; I208-M301 HydrophobicContact CG2-CB 3.98Å; I208-M301 HydrophobicContact CG2-CG 3.78Å; V211-M301 HydrophobicContact CB-SD 4.49Å; V211-M301 HydrophobicContact CG1-CE 3.91Å; V211-M301 HydrophobicContact CG1-SD 3.96Å; M215-M301 HydrophobicContact SD-SD 4.46Å; L297-M301 HydrophobicContact CD1-CE 3.76Å; L297-M301 HydrophobicContact CD1-CG 4.22Å; L297-M301 HydrophobicContact CD1-SD 4.35Å; L297-M301 HydrophobicContact CD2-CE 4Å; L297-M301 HydrophobicContact CG-CE 3.84Å; L297-M301 HydrophobicContact CG-CG 4.35Å; L297-M301 HydrophobicContact CG-SD 4.05Å; L297-M301 WeakPolarHBondContact O-CG 3.43Å; L297-M301 PolarHBondContact O-N 3.48Å; L298-M301 PolarHBondContact O-N 3.12Å; M301-V303 PolarHBondContact O-N 2.99Å; M301-R309 WeakPolarHBondContact O-CD 3.32Å; M301-R309 WeakPolarHBondContact O-CG 3.39Å; M301-I310 HydrophobicContact CG-CG2 3.86Å; M301-A315 HydrophobicContact CE-CB 3.92Å
302	L	98.6	Very high	97.8	Very high	4 Å²	4	32 Å²	32	2%	0.021	17%	0.172	C	C	.	.	S	Bend	trans	-84.3	57.9	-178.9	-66	-179	0	0	0	111.3	I224 F225 L241 F271 F275 L298	I224-L302 HydrophobicContact CD1-CD1 3.99Å; F225-L302 HydrophobicContact CE2-CD2 4.05Å; L241-L302 HydrophobicContact CD1-CB 4.4Å; L241-L302 WeakPolarHBondContact CD1-O 3.44Å; F271-L302 HydrophobicContact CE1-CB 4.17Å; F271-L302 HydrophobicContact CE1-CD1 4.29Å; F271-L302 HydrophobicContact CZ-CB 3.93Å; F275-L302 HydrophobicContact CE2-CD1 4.24Å; F275-L302 HydrophobicContact CZ-CD1 4Å; L298-L302 HydrophobicContact CD2-CD1 4.11Å; L298-L302 WeakPolarHBondContact O-CB 3.22Å; L298-L302 PolarHBondContact O-N 3.3Å
303	V	98.3	Very high	97.8	Very high	32 Å²	32	31.7 Å²	31.7	19%	0.194	17%	0.165	C	C	.	.			trans	-110.8	125.6	178.5	179.3	0	0	0	0	109.6	S299 K300 M301 K308 R309	S299-V303 WeakPolarHBondContact O-CG2 3.4Å; K300-V303 WeakPolarHBondContact O-CG2 2.93Å; M301-V303 PolarHBondContact O-N 2.99Å; V303-K308 HydrophobicContact CG1-CB 3.89Å; V303-R309 HydrophobicContact CB-CB 4Å; V303-R309 HydrophobicContact CB-CG 4.24Å; V303-R309 HydrophobicContact CG1-CB 4.47Å; V303-R309 PolarHBondContact O-NE 2.83Å; V303-R309 PolarHBondContact O-NH2 3.22Å
304	I	97.7	Very high	97.9	Very high	14 Å²	14	34.8 Å²	34.8	7%	0.072	18%	0.179	C	C	.	.	S	Bend	trans	-63.7	-45.7	-176.6	-65	176.1	0	0	0	111.6	P194 W209 W234 V237 I238 L241 G242 P244 F248 P306 R309	P194-I304 HydrophobicContact CB-CG2 4.09Å; P194-I304 HydrophobicContact CG-CB 4.49Å; P194-I304 HydrophobicContact CG-CG1 4.49Å; P194-I304 HydrophobicContact CG-CG2 4.17Å; W209-I304 HydrophobicContact CZ3-CG1 4.46Å; W234-I304 HydrophobicContact CH2-CG2 4.02Å; W234-I304 HydrophobicContact CZ3-CG2 4.21Å; V237-I304 HydrophobicContact CG1-CD1 3.97Å; V237-I304 HydrophobicContact CG1-CG1 4.01Å; I238-I304 HydrophobicContact CG2-CD1 4.4Å; L241-I304 HydrophobicContact CB-CD1 4.09Å; L241-I304 HydrophobicContact CB-CG1 4.37Å; L241-I304 HydrophobicContact CD1-CG1 4.13Å; G242-I304 WeakPolarHBondContact O-CD1 3.08Å; P244-I304 HydrophobicContact CB-CG2 4Å; P244-I304 HydrophobicContact CG-CG2 4.48Å; F248-I304 HydrophobicContact CD1-CG2 4.47Å; F248-I304 HydrophobicContact CD2-CG2 4.45Å; F248-I304 HydrophobicContact CE1-CG2 4Å; F248-I304 HydrophobicContact CE2-CG2 3.97Å; F248-I304 HydrophobicContact CZ-CG2 3.72Å; I304-P306 VanDerWaalsContact O-CD 3.31Å; I304-P306 WeakPolarHBondContact O-CD 3.38Å; I304-R309 PolarHBondContact O-NH2 2.99Å
305	D	96.8	Very high	97.9	Very high	10 Å²	10	34.8 Å²	34.8	5%	0.053	18%	0.179	C	C	.	.	S	Bend	trans	-78.2	113.1	-179	-168.7	-9.6	0	0	0	110.3	F248 K251 D307 K308 R309	F248-D305 HydrophobicContact CD2-CB 3.96Å; K251-D305 IonicContact NZ-OD1 3.37Å; K251-D305 PolarHBondContact NZ-OD1 2.67Å; K251-D305 IonicContact NZ-OD2 3.22Å; K251-D305 PolarHBondContact NZ-OD2 3.31Å; D305-D307 PolarHBondContact O-N 3.32Å; D305-D307 VanDerWaalsContact O-N 3.08Å; D305-D307 PolarHBondContact OD1-N 2.95Å; D305-K308 HydrophobicContact CB-CB 4.38Å; D305-K308 HydrophobicContact CB-CD 4.24Å; D305-K308 HydrophobicContact CB-CG 4.31Å; D305-K308 PolarHBondContact O-N 2.69Å; D305-K308 IonicContact OD2-NZ 3.83Å; D305-R309 PolarHBondContact O-N 3.41Å; D305-R309 VanDerWaalsContact O-N 3.16Å
306	P	96.7	Very high	98	Very high	10 Å²	10	33.9 Å²	33.9	7%	0.065	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-18.3	-177.8	26.3	-35.4	0	0	0	112.7	K203 N205 I304 K308	K203-P306 WeakPolarHBondContact CE-O 3.27Å; K203-P306 PolarHBondContact NZ-O 2.81Å; N205-P306 PolarHBondContact ND2-O 3.4Å; I304-P306 VanDerWaalsContact O-CD 3.31Å; I304-P306 WeakPolarHBondContact O-CD 3.38Å; P306-K308 VanDerWaalsContact C-N 3.3Å
307	D	95.9	Very high	98	Very high	99 Å²	99	38.2 Å²	38.2	53%	0.529	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-14.6	175.3	-64.5	-31	0	0	0	113.9	K203 K251 D305	K203-D307 IonicContact NZ-OD1 3.46Å; K203-D307 PolarHBondContact NZ-OD1 3.12Å; K251-D307 IonicContact NZ-OD2 2.95Å; K251-D307 PolarHBondContact NZ-OD2 3.17Å; D305-D307 PolarHBondContact O-N 3.32Å; D305-D307 VanDerWaalsContact O-N 3.08Å; D305-D307 PolarHBondContact OD1-N 2.95Å
308	K	97.2	Very high	98	Very high	119 Å²	119	38.6 Å²	38.6	52%	0.517	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-11.1	178.5	-59.9	177.6	-173.4	171.3	0	112.4	E247 V303 D305 P306	E247-K308 IonicContact OE2-NZ 2.63Å; E247-K308 PolarHBondContact OE2-NZ 2.71Å; V303-K308 HydrophobicContact CG1-CB 3.89Å; D305-K308 HydrophobicContact CB-CB 4.38Å; D305-K308 HydrophobicContact CB-CD 4.24Å; D305-K308 HydrophobicContact CB-CG 4.31Å; D305-K308 PolarHBondContact O-N 2.69Å; D305-K308 IonicContact OD2-NZ 3.83Å; P306-K308 VanDerWaalsContact C-N 3.3Å
309	R	98.4	Very high	97.9	Very high	8 Å²	8	41.6 Å²	41.6	3%	0.03	21%	0.209	C	C	.	.	S	Bend	trans	-74.1	135.3	177.9	-168.5	-174.5	-55.1	146.5	5.1	110.4	E195 N205 I208 M301 V303 I304 D305	E195-R309 IonicContact OE1-CZ 2.66Å; E195-R309 IonicContact OE1-NH1 3.39Å; E195-R309 PolarHBondContact OE1-NH1 3.26Å; E195-R309 IonicContact OE1-NH2 2.86Å; E195-R309 PolarHBondContact OE1-NH2 2.9Å; E195-R309 IonicContact OE2-CZ 3.47Å; E195-R309 IonicContact OE2-NH1 2.73Å; E195-R309 IonicContact OE2-NH2 3.32Å; E195-R309 PolarHBondContact OE2-NH2 3.4Å; N205-R309 PolarHBondContact ND2-O 3.06Å; N205-R309 WeakPolarHBondContact O-CD 3.1Å; N205-R309 PolarHBondContact O-NH1 2.66Å; I208-R309 HydrophobicContact CG2-CG 4.05Å; M301-R309 WeakPolarHBondContact O-CD 3.32Å; M301-R309 WeakPolarHBondContact O-CG 3.39Å; V303-R309 HydrophobicContact CB-CB 4Å; V303-R309 HydrophobicContact CB-CG 4.24Å; V303-R309 HydrophobicContact CG1-CB 4.47Å; V303-R309 PolarHBondContact O-NE 2.83Å; V303-R309 PolarHBondContact O-NH2 3.22Å; I304-R309 PolarHBondContact O-NH2 2.99Å; D305-R309 PolarHBondContact O-N 3.41Å; D305-R309 VanDerWaalsContact O-N 3.16Å
310	I	98.6	Very high	97.9	Very high	16 Å²	16	39.7 Å²	39.7	8%	0.082	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-53.1	141.5	178	-163.4	171.1	0	0	0	111.7	I208 L297 K300 M301 E314 A315	I208-I310 HydrophobicContact CG2-CG2 3.72Å; L297-I310 HydrophobicContact CD1-CD1 4.33Å; K300-I310 HydrophobicContact CB-CB 3.98Å; K300-I310 HydrophobicContact CB-CD1 4.09Å; K300-I310 HydrophobicContact CB-CG2 4.08Å; K300-I310 HydrophobicContact CD-CD1 4.08Å; K300-I310 VanDerWaalsContact O-CG2 3.32Å; K300-I310 WeakPolarHBondContact O-CG2 3.47Å; K300-I310 PolarHBondContact O-N 3.08Å; K300-I310 VanDerWaalsContact O-N 3.08Å; M301-I310 HydrophobicContact CG-CG2 3.86Å; I310-E314 HydrophobicContact CD1-CB 3.86Å; 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 4.47Å; I310-A315 HydrophobicContact CG2-CB 4.47Å
311	S	98	Very high	97.9	Very high	40 Å²	40	36.2 Å²	36.2	28%	0.28	18%	0.18	S	C	.	.	P	Polyproline II helix	trans	-79	166.1	172	64.7	0	0	0	0	111.8	D313 E314 A315	S311-D313 VanDerWaalsContact C-N 3.29Å; S311-D313 PolarHBondContact O-N 2.95Å; S311-E314 WeakPolarHBondContact CB-OE2 3.25Å; S311-E314 PolarHBondContact N-OE2 3.02Å; S311-E314 PolarHBondContact O-N 3.28Å; S311-E314 WeakPolarHBondContact OG-CB 3.37Å; S311-E314 WeakPolarHBondContact OG-CG 3.16Å; S311-E314 PolarHBondContact OG-N 3.36Å; S311-E314 PolarHBondContact OG-OE2 2.97Å; S311-A315 WeakPolarHBondContact O-CB 3.45Å; S311-A315 PolarHBondContact O-N 3.27Å
312	V	97.6	Very high	97.9	Very high	10 Å²	10	39.1 Å²	39.1	6%	0.061	20%	0.198	C	C	.	.	H	α-helix	trans	-59.8	-41.5	175.1	-178	0	0	0	0	111.4	L136 I139 K140 I208 E314 A315 L316	L136-V312 HydrophobicContact CD2-CG1 4.24Å; I139-V312 HydrophobicContact CG2-CG2 3.86Å; K140-V312 HydrophobicContact CB-CG1 3.79Å; K140-V312 HydrophobicContact CG-CG1 4.5Å; I208-V312 HydrophobicContact CD1-CB 4.35Å; I208-V312 HydrophobicContact CD1-CG2 3.77Å; I208-V312 HydrophobicContact CG1-CG2 3.87Å; V312-E314 PolarHBondContact O-N 2.95Å; V312-A315 PolarHBondContact O-N 3.08Å; V312-L316 HydrophobicContact CG1-CD1 4.17Å; V312-L316 WeakPolarHBondContact O-CG 3.43Å; V312-L316 PolarHBondContact O-N 3.2Å
313	D	97.3	Very high	97.8	Very high	64 Å²	64	43 Å²	43	34%	0.342	22%	0.222	S	C	.	.	H	α-helix	trans	-67.7	-35.5	-179.6	-71.8	-20.4	0	0	0	113.3	K140 S311 R317	K140-D313 WeakPolarHBondContact CE-OD1 3.39Å; K140-D313 IonicContact NZ-OD1 3.22Å; K140-D313 PolarHBondContact NZ-OD1 3.42Å; K140-D313 IonicContact NZ-OD2 2.67Å; S311-D313 VanDerWaalsContact C-N 3.29Å; S311-D313 PolarHBondContact O-N 2.95Å; D313-R317 PolarHBondContact O-N 3.28Å; D313-R317 PolarHBondContact O-NE 3.43Å
314	E	98.2	Very high	97.8	Very high	109 Å²	109	44.9 Å²	44.9	51%	0.509	23%	0.225	S	C	.	.	H	α-helix	trans	-73.3	-36.9	174.1	-70.6	164.1	140.7	0	0	111.3	I310 S311 V312 R317 H318	I310-E314 HydrophobicContact CD1-CB 3.86Å; I310-E314 HydrophobicContact CG1-CB 3.36Å; I310-E314 HydrophobicContact CG1-CG 4.48Å; S311-E314 WeakPolarHBondContact CB-OE2 3.25Å; S311-E314 PolarHBondContact N-OE2 3.02Å; S311-E314 PolarHBondContact O-N 3.28Å; S311-E314 WeakPolarHBondContact OG-CB 3.37Å; S311-E314 WeakPolarHBondContact OG-CG 3.16Å; S311-E314 PolarHBondContact OG-N 3.36Å; S311-E314 PolarHBondContact OG-OE2 2.97Å; V312-E314 PolarHBondContact O-N 2.95Å; E314-R317 CarbonylContact O-C 3.57Å; E314-R317 PolarHBondContact O-N 3.49Å; E314-H318 PolarHBondContact O-N 2.91Å; E314-H318 VanDerWaalsContact O-N 3.12Å
315	A	98.6	Very high	97.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.2	-41	176.4	0	0	0	0	0	112.2	L136 I208 L297 M301 I310 S311 V312 R317 H318 I321	L136-A315 HydrophobicContact CD1-CB 3.92Å; L136-A315 HydrophobicContact CD2-CB 3.91Å; I208-A315 HydrophobicContact CD1-CB 4.31Å; L297-A315 HydrophobicContact CD1-CB 4.49Å; M301-A315 HydrophobicContact CE-CB 3.92Å; I310-A315 HydrophobicContact CD1-CB 4.2Å; I310-A315 HydrophobicContact CG1-CB 4.47Å; I310-A315 HydrophobicContact CG2-CB 4.47Å; S311-A315 WeakPolarHBondContact O-CB 3.45Å; S311-A315 PolarHBondContact O-N 3.27Å; V312-A315 PolarHBondContact O-N 3.08Å; A315-R317 PolarHBondContact O-N 3.34Å; A315-H318 WeakPolarHBondContact O-CB 3.47Å; A315-H318 PolarHBondContact O-N 3.4Å; A315-H318 VanDerWaalsContact O-N 3.11Å; A315-I321 WeakPolarHBondContact O-CB 3.42Å
316	L	98.3	Very high	97.7	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-62.3	-31.2	174.2	-78.1	166.9	0	0	0	112.8	Y133 L136 K140 V312 H318 I321 Y325 A330	Y133-L316 HydrophobicContact CD2-CD2 3.87Å; Y133-L316 HydrophobicContact CE2-CD2 4.08Å; L136-L316 HydrophobicContact CB-CD2 3.59Å; L136-L316 HydrophobicContact CB-CG 3.9Å; L136-L316 HydrophobicContact CD1-CD2 4.37Å; K140-L316 HydrophobicContact CB-CD1 4.42Å; K140-L316 HydrophobicContact CD-CD1 3.49Å; K140-L316 VanDerWaalsContact CD-CD1 3.49Å; V312-L316 HydrophobicContact CG1-CD1 4.17Å; V312-L316 WeakPolarHBondContact O-CG 3.43Å; V312-L316 PolarHBondContact O-N 3.2Å; L316-H318 VanDerWaalsContact C-N 3.35Å; L316-I321 HydrophobicContact CD2-CG2 4.4Å; 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	154 Å²	154	52.6 Å²	52.6	58%	0.581	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	0.8	176.4	-72.7	-173.3	-94	-122	5.5	113.9	D313 E314 A315	D313-R317 PolarHBondContact O-N 3.28Å; D313-R317 PolarHBondContact O-NE 3.43Å; E314-R317 CarbonylContact O-C 3.57Å; E314-R317 PolarHBondContact O-N 3.49Å; A315-R317 PolarHBondContact O-N 3.34Å
318	H	98.7	Very high	97.6	Very high	7 Å²	7	51.5 Å²	51.5	3%	0.032	27%	0.271	C	S	.	.	S	Bend	trans	-66.7	141.2	-180	-163.4	-95.6	0	0	0	111.1	Q293 D296 L297 K300 E314 A315 L316 Y320 I321 T322	Q293-H318 PolarHBondContact O-CE1 3.48Å; D296-H318 IonicContact OD2-CE1 2.77Å; D296-H318 PolarHBondContact OD2-CE1 3.23Å; D296-H318 IonicContact OD2-NE2 3.32Å; D296-H318 PolarHBondContact OD2-NE2 2.58Å; L297-H318 HydrophobicContact CD1-CB 3.92Å; K300-H318 PolarHBondContact NZ-NE2 3.24Å; K300-H318 VanDerWaalsContact NZ-NE2 3.15Å; E314-H318 PolarHBondContact O-N 2.91Å; E314-H318 VanDerWaalsContact O-N 3.12Å; A315-H318 WeakPolarHBondContact O-CB 3.47Å; A315-H318 PolarHBondContact O-N 3.4Å; A315-H318 VanDerWaalsContact O-N 3.11Å; L316-H318 VanDerWaalsContact C-N 3.35Å; H318-Y320 PolarHBondContact ND1-N 2.71Å; H318-Y320 PolarHBondContact O-N 3.34Å; H318-I321 PolarHBondContact O-N 3.29Å; H318-T322 WeakPolarHBondContact O-CB 3.37Å; H318-T322 WeakPolarHBondContact O-CG2 3.4Å; H318-T322 PolarHBondContact O-N 3.04Å
319	P	98.1	Very high	97.5	Very high	63 Å²	63	47.3 Å²	47.3	41%	0.409	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-27.8	-179.3	-30.1	36.4	0	0	0	115.4	Q293	Q293-P319 HydrophobicContact CG-CB 4.14Å; Q293-P319 PolarHBondContact OE1-O 2.95Å
320	Y	98.1	Very high	97.3	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-34.1	175.7	-163.4	-117.5	0	0	0	113.1	H125 M128 S129 L132 M215 K290 Q293 A294 L297 H318	H125-Y320 HydrophobicContact CB-CE2 4.33Å; H125-Y320 AromaticContact ND1-CE2 3.49Å; H125-Y320 WeakPolarHBondContact ND1-CE2 3.38Å; H125-Y320 AromaticContact ND1-CZ 3.62Å; H125-Y320 PolarHBondContact ND1-OH 2.93Å; M128-Y320 PolarHBondContact SD-OH 2.95Å; S129-Y320 VanDerWaalsContact CB-O 3.32Å; S129-Y320 WeakPolarHBondContact CB-O 3.1Å; L132-Y320 HydrophobicContact CD1-CD1 4.42Å; L132-Y320 HydrophobicContact CD1-CE1 4.01Å; M215-Y320 HydrophobicContact CE-CD1 4.13Å; M215-Y320 HydrophobicContact CE-CE1 3.87Å; K290-Y320 HydrophobicContact CB-CE2 4.2Å; K290-Y320 HydrophobicContact CD-CD2 3.94Å; K290-Y320 HydrophobicContact CD-CE2 4Å; K290-Y320 WeakPolarHBondContact O-CE2 3.46Å; Q293-Y320 HydrophobicContact CB-CD2 3.92Å; Q293-Y320 HydrophobicContact CB-CG 4.37Å; A294-Y320 HydrophobicContact CB-CD1 4.4Å; A294-Y320 HydrophobicContact CB-CD2 4.03Å; A294-Y320 HydrophobicContact CB-CE1 4.05Å; A294-Y320 HydrophobicContact CB-CE2 3.66Å; A294-Y320 HydrophobicContact CB-CG 4.39Å; L297-Y320 HydrophobicContact CD2-CD1 4.05Å; H318-Y320 PolarHBondContact ND1-N 2.71Å; H318-Y320 PolarHBondContact O-N 3.34Å
321	I	98.4	Very high	97	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-36.7	-170.9	-58.4	-57.6	0	0	0	112.2	L132 Y133 L136 L297 A315 L316 H318 V323 W324	L132-I321 HydrophobicContact CB-CD1 3.6Å; L132-I321 HydrophobicContact CD1-CD1 4.26Å; Y133-I321 HydrophobicContact CD2-CG2 4Å; Y133-I321 HydrophobicContact CG-CG2 4.47Å; L136-I321 HydrophobicContact CD1-CG1 4.24Å; L136-I321 HydrophobicContact CD1-CG2 4.07Å; L297-I321 HydrophobicContact CD2-CD1 3.92Å; L297-I321 HydrophobicContact CD2-CG1 3.64Å; A315-I321 WeakPolarHBondContact O-CB 3.42Å; L316-I321 HydrophobicContact CD2-CG2 4.4Å; H318-I321 PolarHBondContact O-N 3.29Å; I321-V323 PolarHBondContact O-N 2.96Å; I321-W324 PolarHBondContact O-N 3.44Å
322	T	97.6	Very high	96.7	Very high	61 Å²	61	51.1 Å²	51.1	37%	0.374	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-58.6	-16.7	-170.9	-168.4	0	0	0	0	114.7	H318 W324 Y325	H318-T322 WeakPolarHBondContact O-CB 3.37Å; H318-T322 WeakPolarHBondContact O-CG2 3.4Å; H318-T322 PolarHBondContact O-N 3.04Å; T322-W324 PolarHBondContact O-N 2.87Å; T322-Y325 WeakPolarHBondContact O-CB 3.46Å; T322-Y325 PolarHBondContact O-N 3.1Å
323	V	97	Very high	96.3	Very high	86 Å²	86	55.7 Å²	55.7	52%	0.521	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-62.6	-22.9	175.2	-61	0	0	0	0	112.6	I321	I321-V323 PolarHBondContact O-N 2.96Å
324	W	97.8	Very high	95.4	Very high	71 Å²	71	55.8 Å²	55.8	27%	0.269	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-99.9	-3	178.4	-56.1	115.4	0	0	0	113.6	E126 S129 Y130 Y133 I321 T322 D326	E126-W324 HydrophobicContact CB-CZ2 4.43Å; E126-W324 HydrophobicContact CG-CH2 3.55Å; E126-W324 HydrophobicContact CG-CZ2 3.36Å; S129-W324 PolarHBondContact OG-NE1 3.45Å; Y130-W324 HydrophobicContact CD2-CB 4.5Å; Y130-W324 AromaticContact CD2-CD2 3.71Å; Y130-W324 HydrophobicContact CD2-CD2 3.71Å; Y130-W324 AromaticContact CD2-CE3 3.83Å; Y130-W324 HydrophobicContact CD2-CE3 3.83Å; Y130-W324 HydrophobicContact CD2-CG 4.01Å; Y130-W324 HydrophobicContact CD2-CZ3 4.32Å; Y130-W324 HydrophobicContact CE2-CE3 4.33Å; Y130-W324 HydrophobicContact CG-CD2 4.38Å; Y130-W324 HydrophobicContact CG-CZ2 4.48Å; Y133-W324 HydrophobicContact CD1-CB 3.54Å; Y133-W324 HydrophobicContact CD1-CG 4.31Å; Y133-W324 HydrophobicContact CD2-CB 3.79Å; Y133-W324 HydrophobicContact CE1-CB 3.93Å; Y133-W324 WeakPolarHBondContact CE1-O 3.49Å; Y133-W324 HydrophobicContact CE2-CB 4.18Å; Y133-W324 WeakPolarHBondContact CE2-O 3.12Å; Y133-W324 HydrophobicContact CG-CB 3.45Å; Y133-W324 VanDerWaalsContact CG-CB 3.45Å; Y133-W324 HydrophobicContact CG-CG 4.22Å; Y133-W324 PolarHBondContact OH-O 3.15Å; I321-W324 PolarHBondContact O-N 3.44Å; T322-W324 PolarHBondContact O-N 2.87Å; W324-D326 PolarHBondContact O-N 3.22Å
325	Y	97.3	Very high	94.2	Very high	64 Å²	64	51.3 Å²	51.3	25%	0.251	29%	0.285	S	S	.	.			trans	-62.5	113.5	-169.5	-170	-86.4	0	0	0	111.5	L316 T322 P327 A330 E331	L316-Y325 HydrophobicContact CB-CD2 4.23Å; L316-Y325 HydrophobicContact CB-CE2 4.16Å; T322-Y325 WeakPolarHBondContact O-CB 3.46Å; T322-Y325 PolarHBondContact O-N 3.1Å; Y325-P327 HydrophobicContact CD1-CG 4.35Å; Y325-P327 HydrophobicContact CE1-CB 4.45Å; Y325-P327 HydrophobicContact CE1-CG 3.92Å; Y325-A330 HydrophobicContact CD2-CB 4.36Å; Y325-A330 HydrophobicContact CE2-CB 3.81Å; Y325-E331 PolarHBondContact OH-OE1 2.93Å
326	D	96.8	Very high	92.8	Very high	65 Å²	65	59.3 Å²	59.3	35%	0.348	32%	0.323	S	S	.	.			trans	-118.6	117.1	168.3	-178.4	-7.4	0	0	0	109.1	Y133 W324 A328 E329 A330	Y133-D326 PolarHBondContact OH-N 3.44Å; W324-D326 PolarHBondContact O-N 3.22Å; D326-A328 PolarHBondContact O-N 2.92Å; D326-A328 WeakPolarHBondContact OD1-CB 3.23Å; D326-A328 PolarHBondContact OD1-N 3.47Å; D326-E329 HydrophobicContact CB-CB 4.45Å; D326-E329 HydrophobicContact CB-CG 3.78Å; D326-E329 PolarHBondContact O-N 2.81Å; D326-A330 PolarHBondContact O-N 2.85Å
327	P	95.1	Very high	91.1	Very high	67 Å²	67	66.2 Å²	66.2	44%	0.435	36%	0.358	S	S	.	.	H	α-helix	trans	-53.5	-33.9	175.9	-22.3	29.4	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 3.92Å; P327-E329 PolarHBondContact O-N 3.31Å; P327-E331 WeakPolarHBondContact O-CA 3.45Å; P327-E331 VanDerWaalsContact O-CB 3.27Å; P327-E331 WeakPolarHBondContact O-CB 3.47Å; P327-E331 PolarHBondContact O-N 2.95Å
328	A	94.6	Very high	89.6	Confident	77 Å²	77	59.6 Å²	59.6	64%	0.636	33%	0.333	S	S	*	.	H	α-helix	trans	-64.1	-25.2	-179.9	0	0	0	0	0	112.5	D326	D326-A328 PolarHBondContact O-N 2.92Å; D326-A328 WeakPolarHBondContact OD1-CB 3.23Å; D326-A328 PolarHBondContact OD1-N 3.47Å
329	E	95.1	Very high	88.2	Confident	30 Å²	30	62.3 Å²	62.3	14%	0.14	35%	0.348	C	S	.	.	H	α-helix	trans	-96.5	-52.4	178.7	-43.8	-178.4	171.6	0	0	110.9	H82 K83 Y133 D326 P327 E331 A332	H82-E329 PolarHBondContact NE2-O 2.94Å; H82-E329 VanDerWaalsContact NE2-O 3.16Å; K83-E329 WeakPolarHBondContact CE-OE1 3.3Å; K83-E329 WeakPolarHBondContact CE-OE2 3.31Å; K83-E329 IonicContact NZ-OE1 3.94Å; K83-E329 PolarHBondContact NZ-OE1 2.95Å; K83-E329 IonicContact NZ-OE2 3.87Å; K83-E329 PolarHBondContact NZ-OE2 3.2Å; Y133-E329 WeakPolarHBondContact CE1-OE2 3.33Å; Y133-E329 VanDerWaalsContact CZ-OE2 3.31Å; Y133-E329 WeakPolarHBondContact OH-CB 3.48Å; Y133-E329 VanDerWaalsContact OH-CD 3.31Å; Y133-E329 PolarHBondContact OH-OE2 2.88Å; D326-E329 HydrophobicContact CB-CB 4.45Å; D326-E329 HydrophobicContact CB-CG 3.78Å; D326-E329 PolarHBondContact O-N 2.81Å; P327-E329 PolarHBondContact O-N 3.31Å; E329-E331 VanDerWaalsContact C-N 3.31Å; E329-E331 PolarHBondContact O-N 3.42Å; E329-A332 PolarHBondContact O-N 3.48Å
330	A	94.7	Very high	86.6	Confident	4 Å²	4	61 Å²	61	3%	0.033	34%	0.343	C	S	.	.	H	α-helix	trans	-67.7	-31.7	-176	0	0	0	0	0	112.4	K140 L316 Y325 D326	K140-A330 WeakPolarHBondContact CD-O 3.32Å; K140-A330 WeakPolarHBondContact CE-O 3.17Å; L316-A330 HydrophobicContact CD1-CB 4.32Å; Y325-A330 HydrophobicContact CD2-CB 4.36Å; Y325-A330 HydrophobicContact CE2-CB 3.81Å; D326-A330 PolarHBondContact O-N 2.85Å
331	E	92.7	Very high	84.9	Confident	118 Å²	118	66.4 Å²	66.4	55%	0.551	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	22.7	-176.7	-53.2	176.3	-153.3	0	0	112.1	Y325 P327 E329	Y325-E331 PolarHBondContact OH-OE1 2.93Å; P327-E331 WeakPolarHBondContact O-CA 3.45Å; P327-E331 VanDerWaalsContact O-CB 3.27Å; P327-E331 WeakPolarHBondContact O-CB 3.47Å; P327-E331 PolarHBondContact O-N 2.95Å; E329-E331 VanDerWaalsContact C-N 3.31Å; E329-E331 PolarHBondContact O-N 3.42Å
332	A	91.5	Very high	83.3	Confident	22 Å²	22	67.8 Å²	67.8	18%	0.182	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-52.3	134	175.3	0	0	0	0	0	110.9	E329	E329-A332 PolarHBondContact O-N 3.48Å
333	P	88.1	Confident	81.7	Confident	106 Å²	106	65.4 Å²	65.4	69%	0.688	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-52.8	139.4	-176.9	-26.5	33.4	0	0	0	111.8	H141	H141-P333 PolarHBondContact CE1-O 3.16Å
334	P	79.8	Confident	80.4	Confident	67 Å²	67	67.9 Å²	67.9	44%	0.435	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-61	152	178.2	26.5	-33.8	0	0	0	110.3
335	P	72.2	Confident	79.4	Confident	15 Å²	15	69.6 Å²	69.6	10%	0.097	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-61.3	168.6	167.1	31.7	-35.2	0	0	0	110.2	C79 V80 A145 I337	C79-P335 HydrophobicContact CB-CB 4.45Å; C79-P335 WeakPolarHBondContact O-CB 3.33Å; V80-P335 HydrophobicContact CG2-CG 4.16Å; A145-P335 HydrophobicContact CB-CG 3.41Å; A145-P335 VanDerWaalsContact CB-CG 3.41Å; P335-I337 PolarHBondContact O-N 3.48Å; P335-I337 VanDerWaalsContact O-N 3.07Å
336	Q	70	Confident	78.7	Confident	168 Å²	168	73.8 Å²	73.8	79%	0.785	39%	0.394	S	S	*	.	S	Bend	trans	-50.1	124.9	170.2	-80.3	-176.1	-8.1	0	0	109	Y338	Q336-Y338 PolarHBondContact O-N 3.07Å; Q336-Y338 VanDerWaalsContact O-N 3.12Å
337	I	62.7	Low	78.2	Confident	146 Å²	146	72.8 Å²	72.8	75%	0.749	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-49.2	122.3	-171.8	-63.1	173.6	0	0	0	108.4	P335 D339	P335-I337 PolarHBondContact O-N 3.48Å; P335-I337 VanDerWaalsContact O-N 3.07Å; I337-D339 PolarHBondContact O-N 3.29Å; I337-D339 VanDerWaalsContact O-N 3.15Å
338	Y	65.4	Low	78.1	Confident	14 Å²	14	71.9 Å²	71.9	6%	0.055	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-62.3	118.8	176.2	-178.5	-110.3	0	0	0	108.3	V75 L76 I147 Q336 A340 L342 E343	V75-Y338 HydrophobicContact CG1-CD2 4.25Å; V75-Y338 HydrophobicContact CG1-CE2 3.97Å; L76-Y338 HydrophobicContact CD2-CD2 3.3Å; L76-Y338 HydrophobicContact CD2-CE2 3.56Å; L76-Y338 HydrophobicContact CD2-CG 3.83Å; L76-Y338 HydrophobicContact CG-CD2 4.3Å; L76-Y338 HydrophobicContact CG-CE2 4.08Å; I147-Y338 HydrophobicContact CG1-CG 4.42Å; Q336-Y338 PolarHBondContact O-N 3.07Å; Q336-Y338 VanDerWaalsContact O-N 3.12Å; Y338-A340 PolarHBondContact O-N 2.68Å; Y338-L342 HydrophobicContact CE2-CD1 4.37Å; Y338-E343 HydrophobicContact CE1-CG 3.7Å
339	D	69	Low	78	Confident	64 Å²	64	70.8 Å²	70.8	34%	0.342	37%	0.368	S	S	.	.			trans	-64.7	102.2	179.7	176.8	13.6	0	0	0	108.9	I337 Q341 L342 R345	I337-D339 PolarHBondContact O-N 3.29Å; I337-D339 VanDerWaalsContact O-N 3.15Å; D339-Q341 PolarHBondContact O-N 3.41Å; D339-Q341 WeakPolarHBondContact OD1-CB 3.29Å; D339-Q341 VanDerWaalsContact OD1-CG 3.29Å; D339-Q341 WeakPolarHBondContact OD1-CG 3.07Å; D339-Q341 PolarHBondContact OD1-N 3.24Å; D339-L342 HydrophobicContact CB-CD1 3.8Å; D339-L342 HydrophobicContact CB-CG 4.03Å; D339-L342 VanDerWaalsContact O-CB 3.22Å; D339-L342 WeakPolarHBondContact O-CB 2.9Å; D339-L342 PolarHBondContact O-N 3.35Å; D339-R345 IonicContact OD2-NH2 3.61Å
340	A	65.2	Low	78	Confident	37 Å²	37	75 Å²	75	31%	0.306	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-27.6	177.3	0	0	0	0	0	112	T175 Y338 L342 E343	T175-A340 HydrophobicContact CG2-CB 3.83Å; Y338-A340 PolarHBondContact O-N 2.68Å; A340-L342 PolarHBondContact O-N 3.12Å; A340-E343 WeakPolarHBondContact O-CB 3.35Å; A340-E343 PolarHBondContact O-N 3.26Å
341	Q	61.9	Low	77.9	Confident	112 Å²	112	79 Å²	79	52%	0.523	41%	0.406	S	S	.	.	H	α-helix	trans	-65.5	-24.2	176.6	-56.2	-174.4	-12.6	0	0	112.4	D339 E343 E344 R345	D339-Q341 PolarHBondContact O-N 3.41Å; D339-Q341 WeakPolarHBondContact OD1-CB 3.29Å; D339-Q341 VanDerWaalsContact OD1-CG 3.29Å; D339-Q341 WeakPolarHBondContact OD1-CG 3.07Å; D339-Q341 PolarHBondContact OD1-N 3.24Å; Q341-E343 PolarHBondContact O-N 3.19Å; Q341-E344 PolarHBondContact O-N 3.22Å; Q341-R345 VanDerWaalsContact O-CG 3.32Å; Q341-R345 WeakPolarHBondContact O-CG 3.43Å; Q341-R345 PolarHBondContact O-N 2.63Å
342	L	65	Low	78	Confident	30 Å²	30	73.6 Å²	73.6	16%	0.157	38%	0.38	C	S	.	.	H	α-helix	trans	-62.9	-25.7	171.9	-69	162.7	0	0	0	111.7	Y71 Y338 D339 A340	Y71-L342 HydrophobicContact CE1-CD2 4.03Å; Y338-L342 HydrophobicContact CE2-CD1 4.37Å; D339-L342 HydrophobicContact CB-CD1 3.8Å; D339-L342 HydrophobicContact CB-CG 4.03Å; D339-L342 VanDerWaalsContact O-CB 3.22Å; D339-L342 WeakPolarHBondContact O-CB 2.9Å; D339-L342 PolarHBondContact O-N 3.35Å; A340-L342 PolarHBondContact O-N 3.12Å
343	E	64.8	Low	78.2	Confident	10 Å²	10	73.6 Å²	73.6	5%	0.047	38%	0.376	C	S	.	.	H	α-helix	trans	-78.2	-32.5	174.8	-56.8	-147.2	138.9	0	0	113.6	K68 R72 R174 T175 T178 Y338 A340 Q341	K68-E343 VanDerWaalsContact CE-O 3.28Å; K68-E343 WeakPolarHBondContact CE-O 3.4Å; K68-E343 PolarHBondContact NZ-O 3.05Å; R72-E343 IonicContact CZ-OE1 3.96Å; R72-E343 IonicContact NH1-OE1 3.51Å; R72-E343 PolarHBondContact NH1-OE1 3.36Å; R72-E343 IonicContact NH2-OE1 3.07Å; R72-E343 PolarHBondContact NH2-OE1 3.27Å; R174-E343 WeakPolarHBondContact CA-OE1 3.38Å; R174-E343 WeakPolarHBondContact CD-OE2 3.15Å; T175-E343 PolarHBondContact N-OE1 3.23Å; T175-E343 PolarHBondContact N-OE2 2.88Å; T178-E343 HydrophobicContact CG2-CB 4.07Å; T178-E343 WeakPolarHBondContact CG2-OE2 3.37Å; T178-E343 PolarHBondContact OG1-OE2 2.77Å; Y338-E343 HydrophobicContact CE1-CG 3.7Å; A340-E343 WeakPolarHBondContact O-CB 3.35Å; A340-E343 PolarHBondContact O-N 3.26Å; Q341-E343 PolarHBondContact O-N 3.19Å
344	E	69.5	Low	78.5	Confident	138 Å²	138	73.6 Å²	73.6	65%	0.645	37%	0.367	S	S	*	.	H	α-helix	trans	-82.4	-23.6	-175.7	-66.8	-175.8	169.9	0	0	112.3	Q341 E346	Q341-E344 PolarHBondContact O-N 3.22Å; E344-E346 PolarHBondContact O-N 2.7Å
345	R	76.7	Confident	79.2	Confident	108 Å²	108	73 Å²	73	41%	0.408	36%	0.359	S	S	.	.			trans	-65.8	129.5	177	-69	171.1	-163.2	172.8	11.9	111.2	K68 D339 Q341	K68-R345 PolarHBondContact NZ-O 3.15Å; D339-R345 IonicContact OD2-NH2 3.61Å; Q341-R345 VanDerWaalsContact O-CG 3.32Å; Q341-R345 WeakPolarHBondContact O-CG 3.43Å; Q341-R345 PolarHBondContact O-N 2.63Å
346	E	81.9	Confident	80.2	Confident	151 Å²	151	72.3 Å²	72.3	71%	0.706	36%	0.355	S	S	*	.			trans	-103.5	124.3	166.5	-65.2	-166	158.1	0	0	108	E344	E344-E346 PolarHBondContact O-N 2.7Å
347	H	87.1	Confident	81.4	Confident	45 Å²	45	66.1 Å²	66.1	21%	0.208	33%	0.325	C	S	.	.			trans	-122.3	150.5	179.4	-70.9	-64.2	0	0	0	109.9	E351 W352	H347-E351 VanDerWaalsContact CA-OE2 3.23Å; H347-E351 WeakPolarHBondContact CA-OE2 3.32Å; H347-E351 HydrophobicContact CB-CB 3.88Å; H347-E351 WeakPolarHBondContact CB-OE2 3.22Å; H347-E351 IonicContact CG-OE2 2.8Å; H347-E351 IonicContact ND1-OE2 2.69Å; H347-E351 PolarHBondContact ND1-OE2 3.11Å; H347-E351 VanDerWaalsContact ND1-OE2 3.09Å; H347-W352 HydrophobicContact CB-CD2 3.95Å; H347-W352 HydrophobicContact CB-CG 4.04Å; H347-W352 HydrophobicContact CB-CZ2 4.08Å; H347-W352 AromaticContact CD2-CH2 3.69Å; H347-W352 AromaticContact CD2-CZ2 3.71Å; H347-W352 PolarHBondContact O-NE1 3.41Å
348	A	92.6	Very high	82.9	Confident	47 Å²	47	65.1 Å²	65.1	39%	0.388	32%	0.315	S	S	.	.			trans	-63.2	162	167.2	0	0	0	0	0	110.5	E350 E351 W352	A348-E350 VanDerWaalsContact C-N 3.28Å; A348-E350 PolarHBondContact O-N 3.2Å; A348-E351 HydrophobicContact CB-CG 4.22Å; A348-E351 PolarHBondContact N-OE2 3.19Å; A348-E351 PolarHBondContact O-N 2.8Å; A348-W352 VanDerWaalsContact O-CD1 3.31Å; A348-W352 PolarHBondContact O-N 3.22Å
349	I	93.1	Very high	84.1	Confident	55 Å²	55	66.3 Å²	66.3	28%	0.282	32%	0.321	S	S	.	.	H	α-helix	trans	-60.2	-41.1	-179.7	-64	172.6	0	0	0	110.9	F61 Q64 W352 K353	F61-I349 HydrophobicContact CB-CG2 4.06Å; F61-I349 VanDerWaalsContact O-CG2 3.27Å; F61-I349 WeakPolarHBondContact O-CG2 3.15Å; Q64-I349 HydrophobicContact CG-CG1 3.84Å; I349-W352 PolarHBondContact O-N 3.01Å; I349-K353 WeakPolarHBondContact O-CB 3.45Å; I349-K353 PolarHBondContact O-N 2.95Å
350	E	93.4	Very high	85.4	Confident	118 Å²	118	63.3 Å²	63.3	55%	0.551	31%	0.305	S	S	*	.	H	α-helix	trans	-65.8	-39	178.7	-61.7	-54.8	151.5	0	0	112.3	A348 K353 E354	A348-E350 VanDerWaalsContact C-N 3.28Å; A348-E350 PolarHBondContact O-N 3.2Å; E350-K353 WeakPolarHBondContact O-CB 3.48Å; E350-K353 PolarHBondContact O-N 3.46Å; E350-E354 WeakPolarHBondContact O-CG 3.48Å; E350-E354 PolarHBondContact O-N 3.4Å
351	E	93.9	Very high	86.7	Confident	89 Å²	89	63.9 Å²	63.9	42%	0.416	30%	0.302	S	S	.	.	H	α-helix	trans	-64.9	-41.8	174.3	-67.4	175.5	165.9	0	0	111.4	H347 A348 K353 E354 L355	H347-E351 VanDerWaalsContact CA-OE2 3.23Å; H347-E351 WeakPolarHBondContact CA-OE2 3.32Å; H347-E351 HydrophobicContact CB-CB 3.88Å; H347-E351 WeakPolarHBondContact CB-OE2 3.22Å; H347-E351 IonicContact CG-OE2 2.8Å; H347-E351 IonicContact ND1-OE2 2.69Å; H347-E351 PolarHBondContact ND1-OE2 3.11Å; H347-E351 VanDerWaalsContact ND1-OE2 3.09Å; A348-E351 HydrophobicContact CB-CG 4.22Å; A348-E351 PolarHBondContact N-OE2 3.19Å; A348-E351 PolarHBondContact O-N 2.8Å; E351-K353 VanDerWaalsContact C-N 3.29Å; E351-K353 PolarHBondContact O-N 2.84Å; E351-E354 WeakPolarHBondContact O-CB 3.39Å; E351-E354 PolarHBondContact O-N 3.01Å; E351-L355 VanDerWaalsContact O-CG 3.3Å; E351-L355 WeakPolarHBondContact O-CG 3.35Å; E351-L355 PolarHBondContact O-N 2.98Å
352	W	94.1	Very high	88	Confident	4 Å²	4	60.9 Å²	60.9	2%	0.015	29%	0.29	C	S	.	.	H	α-helix	trans	-62.5	-39.1	172.5	-78.2	120	0	0	0	112.2	A67 K68 Y71 H347 A348 I349 L355 I356	A67-W352 HydrophobicContact CB-CB 3.57Å; A67-W352 HydrophobicContact CB-CG 3.81Å; K68-W352 HydrophobicContact CB-CH2 4.44Å; K68-W352 HydrophobicContact CB-CZ2 3.88Å; K68-W352 HydrophobicContact CD-CH2 4.39Å; K68-W352 HydrophobicContact CD-CZ2 3.79Å; K68-W352 HydrophobicContact CG-CH2 3.99Å; K68-W352 HydrophobicContact CG-CZ2 3.68Å; Y71-W352 HydrophobicContact CD1-CE3 4.14Å; Y71-W352 HydrophobicContact CD1-CH2 4.4Å; Y71-W352 AromaticContact CD1-CZ3 3.47Å; Y71-W352 HydrophobicContact CD1-CZ3 3.47Å; Y71-W352 VanDerWaalsContact CD1-CZ3 3.47Å; Y71-W352 HydrophobicContact CE1-CZ3 4.06Å; Y71-W352 AromaticContact CG-CE3 3.94Å; Y71-W352 HydrophobicContact CG-CE3 3.94Å; Y71-W352 AromaticContact CG-CZ3 3.77Å; Y71-W352 HydrophobicContact CG-CZ3 3.77Å; H347-W352 HydrophobicContact CB-CD2 3.95Å; H347-W352 HydrophobicContact CB-CG 4.04Å; H347-W352 HydrophobicContact CB-CZ2 4.08Å; H347-W352 AromaticContact CD2-CH2 3.69Å; H347-W352 AromaticContact CD2-CZ2 3.71Å; H347-W352 PolarHBondContact O-NE1 3.41Å; A348-W352 VanDerWaalsContact O-CD1 3.31Å; A348-W352 PolarHBondContact O-N 3.22Å; I349-W352 PolarHBondContact O-N 3.01Å; W352-L355 HydrophobicContact CE3-CD1 3.81Å; W352-L355 HydrophobicContact CZ3-CD1 3.91Å; W352-L355 PolarHBondContact O-N 3.28Å; W352-I356 VanDerWaalsContact O-CG1 3.28Å; W352-I356 WeakPolarHBondContact O-CG1 3.49Å; W352-I356 PolarHBondContact O-N 2.9Å
353	K	95.2	Very high	89.2	Confident	22 Å²	22	61.5 Å²	61.5	10%	0.096	29%	0.29	C	S	.	.	H	α-helix	trans	-61.9	-45	177.4	-173.8	-174.9	-177.7	-170.7	0	110.8	F61 L98 E99 F101 I349 E350 E351 I356 Y357	F61-K353 HydrophobicContact CD1-CB 3.86Å; F61-K353 HydrophobicContact CD1-CG 4.01Å; F61-K353 HydrophobicContact CD2-CG 4.35Å; F61-K353 HydrophobicContact CE1-CB 3.98Å; F61-K353 HydrophobicContact CE1-CG 3.95Å; F61-K353 HydrophobicContact CE2-CG 4.29Å; F61-K353 HydrophobicContact CG-CB 4.41Å; F61-K353 HydrophobicContact CG-CG 4.24Å; F61-K353 HydrophobicContact CZ-CG 4.13Å; L98-K353 HydrophobicContact CD1-CD 4.49Å; L98-K353 HydrophobicContact CD1-CG 4.12Å; L98-K353 WeakPolarHBondContact O-CE 3.34Å; L98-K353 PolarHBondContact O-NZ 3.1Å; E99-K353 PolarHBondContact O-NZ 3.48Å; E99-K353 VanDerWaalsContact O-NZ 3.16Å; F101-K353 HydrophobicContact CD1-CG 3.77Å; F101-K353 HydrophobicContact CE1-CG 4.34Å; F101-K353 WeakPolarHBondContact O-CE 3.49Å; F101-K353 PolarHBondContact O-NZ 3.32Å; I349-K353 WeakPolarHBondContact O-CB 3.45Å; I349-K353 PolarHBondContact O-N 2.95Å; E350-K353 WeakPolarHBondContact O-CB 3.48Å; E350-K353 PolarHBondContact O-N 3.46Å; E351-K353 VanDerWaalsContact C-N 3.29Å; E351-K353 PolarHBondContact O-N 2.84Å; K353-I356 PolarHBondContact O-N 3.43Å; K353-Y357 VanDerWaalsContact O-CB 3.22Å; K353-Y357 WeakPolarHBondContact O-CB 3.38Å; K353-Y357 PolarHBondContact O-N 2.77Å
354	E	95.1	Very high	90.1	Very high	106 Å²	106	62.6 Å²	62.6	50%	0.495	30%	0.295	S	S	.	.	H	α-helix	trans	-58.7	-47.9	172.9	-77.9	176.4	-163.9	0	0	112.4	L98 E350 E351 Y357 K358	L98-E354 HydrophobicContact CD1-CG 4.05Å; L98-E354 HydrophobicContact CD2-CG 3.48Å; L98-E354 VanDerWaalsContact CD2-CG 3.48Å; L98-E354 HydrophobicContact CG-CG 4.37Å; E350-E354 WeakPolarHBondContact O-CG 3.48Å; E350-E354 PolarHBondContact O-N 3.4Å; E351-E354 WeakPolarHBondContact O-CB 3.39Å; E351-E354 PolarHBondContact O-N 3.01Å; E354-Y357 PolarHBondContact O-N 2.92Å; E354-K358 WeakPolarHBondContact O-CB 3.45Å; E354-K358 PolarHBondContact O-N 3.49Å
355	L	93.6	Very high	90.8	Very high	53 Å²	53	61.6 Å²	61.6	28%	0.277	29%	0.29	S	S	.	.	H	α-helix	trans	-61.2	-46.9	179.1	-72.4	172.8	0	0	0	111.9	Y71 E351 W352 K358 E359	Y71-L355 HydrophobicContact CD2-CB 3.94Å; Y71-L355 HydrophobicContact CE2-CB 3.74Å; E351-L355 VanDerWaalsContact O-CG 3.3Å; E351-L355 WeakPolarHBondContact O-CG 3.35Å; E351-L355 PolarHBondContact O-N 2.98Å; W352-L355 HydrophobicContact CE3-CD1 3.81Å; W352-L355 HydrophobicContact CZ3-CD1 3.91Å; W352-L355 PolarHBondContact O-N 3.28Å; L355-K358 PolarHBondContact O-N 3.3Å; L355-E359 WeakPolarHBondContact O-CG 3.46Å; L355-E359 PolarHBondContact O-N 2.87Å; L355-E359 VanDerWaalsContact O-N 3.08Å
356	I	93.9	Very high	91	Very high	1 Å²	1	62 Å²	62	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-64.5	-45.8	177.7	-65.9	166.7	0	0	0	109.9	F61 A67 A70 Y71 L74 F101 V104 W352 K353 K358 E359 V360	F61-I356 HydrophobicContact CD1-CD1 4.4Å; F61-I356 HydrophobicContact CE1-CB 4.25Å; F61-I356 HydrophobicContact CE1-CD1 3.59Å; F61-I356 HydrophobicContact CE1-CG1 4.48Å; F61-I356 HydrophobicContact CE1-CG2 4.49Å; F61-I356 HydrophobicContact CZ-CD1 4.41Å; F61-I356 HydrophobicContact CZ-CG2 4.37Å; A67-I356 WeakPolarHBondContact O-CD1 3.49Å; A70-I356 HydrophobicContact CB-CD1 3.99Å; Y71-I356 HydrophobicContact CD2-CG1 3.74Å; Y71-I356 HydrophobicContact CG-CG1 4.17Å; L74-I356 HydrophobicContact CD2-CG2 4.31Å; F101-I356 HydrophobicContact CE1-CB 4.26Å; F101-I356 HydrophobicContact CE1-CG2 4.03Å; F101-I356 HydrophobicContact CZ-CG2 3.82Å; V104-I356 HydrophobicContact CG2-CG2 4Å; W352-I356 VanDerWaalsContact O-CG1 3.28Å; W352-I356 WeakPolarHBondContact O-CG1 3.49Å; W352-I356 PolarHBondContact O-N 2.9Å; K353-I356 PolarHBondContact O-N 3.43Å; I356-K358 VanDerWaalsContact C-N 3.3Å; I356-K358 PolarHBondContact O-N 2.9Å; I356-E359 PolarHBondContact O-N 2.96Å; I356-V360 HydrophobicContact CG2-CG2 4.32Å; I356-V360 VanDerWaalsContact O-CG2 3.29Å; I356-V360 WeakPolarHBondContact O-CG2 3.36Å; I356-V360 PolarHBondContact O-N 2.98Å
357	Y	95.3	Very high	90.7	Very high	39 Å²	39	57.8 Å²	57.8	15%	0.153	28%	0.279	C	S	.	.	H	α-helix	trans	-57.7	-45.7	179.9	-175.2	-108.5	0	0	0	111.3	T93 K96 L98 F101 K353 E354 E359 V360 M361	T93-Y357 HydrophobicContact CG2-CE2 4.39Å; K96-Y357 PolarHBondContact O-OH 3.36Å; L98-Y357 HydrophobicContact CB-CD1 4.23Å; L98-Y357 HydrophobicContact CB-CE1 4.28Å; L98-Y357 HydrophobicContact CD1-CD1 4.07Å; L98-Y357 HydrophobicContact CD1-CG 3.92Å; F101-Y357 HydrophobicContact CB-CD2 3.89Å; F101-Y357 HydrophobicContact CB-CE2 4.25Å; F101-Y357 AromaticContact CD1-CD2 3.67Å; F101-Y357 HydrophobicContact CD1-CD2 3.67Å; F101-Y357 HydrophobicContact CD1-CG 4.06Å; F101-Y357 AromaticContact CD2-CD2 3.87Å; F101-Y357 HydrophobicContact CD2-CD2 3.87Å; F101-Y357 HydrophobicContact CD2-CE2 4.45Å; F101-Y357 HydrophobicContact CE1-CD2 4.05Å; F101-Y357 HydrophobicContact CE1-CG 4.33Å; F101-Y357 HydrophobicContact CE2-CD2 4.26Å; F101-Y357 AromaticContact CG-CD2 3.55Å; F101-Y357 HydrophobicContact CG-CD2 3.55Å; F101-Y357 HydrophobicContact CG-CE2 4.28Å; F101-Y357 HydrophobicContact CG-CG 4.37Å; F101-Y357 HydrophobicContact CZ-CD2 4.33Å; K353-Y357 VanDerWaalsContact O-CB 3.22Å; K353-Y357 WeakPolarHBondContact O-CB 3.38Å; K353-Y357 PolarHBondContact O-N 2.77Å; E354-Y357 PolarHBondContact O-N 2.92Å; Y357-E359 PolarHBondContact O-N 2.67Å; Y357-V360 PolarHBondContact O-N 2.86Å; Y357-M361 HydrophobicContact CD1-CG 4.1Å; Y357-M361 HydrophobicContact CD2-CE 4.4Å; Y357-M361 HydrophobicContact CD2-CG 4.42Å; Y357-M361 HydrophobicContact CE1-CG 3.75Å; Y357-M361 HydrophobicContact CE1-SD 4.45Å; Y357-M361 HydrophobicContact CE2-CE 3.85Å; Y357-M361 HydrophobicContact CE2-CG 4.1Å; Y357-M361 HydrophobicContact CE2-SD 4.16Å; Y357-M361 HydrophobicContact CG-CG 4.43Å; Y357-M361 VanDerWaalsContact O-CG 3.31Å; Y357-M361 WeakPolarHBondContact O-CG 3.26Å; Y357-M361 PolarHBondContact O-N 3.31Å
358	K	93.9	Very high	89.9	Confident	124 Å²	124	62.7 Å²	62.7	54%	0.539	30%	0.3	S	S	.	.	H	α-helix	trans	-58.6	-48.2	175.4	-175.1	-179	177.2	-176.3	0	112.1	E354 L355 I356 V360 M361 D362	E354-K358 WeakPolarHBondContact O-CB 3.45Å; E354-K358 PolarHBondContact O-N 3.49Å; L355-K358 PolarHBondContact O-N 3.3Å; I356-K358 VanDerWaalsContact C-N 3.3Å; I356-K358 PolarHBondContact O-N 2.9Å; K358-V360 VanDerWaalsContact C-N 3.27Å; K358-V360 PolarHBondContact O-N 3.01Å; K358-M361 PolarHBondContact O-N 2.7Å; K358-D362 VanDerWaalsContact O-CB 3.31Å; K358-D362 WeakPolarHBondContact O-CB 3.32Å; K358-D362 PolarHBondContact O-N 3.3Å
359	E	92	Very high	88.5	Confident	40 Å²	40	65.8 Å²	65.8	19%	0.187	31%	0.31	C	S	.	.	H	α-helix	trans	-60.7	-35.2	179.1	-72.7	-63.6	155.2	0	0	113.4	Y71 L74 K78 L355 I356 Y357 W363	Y71-E359 HydrophobicContact CD2-CG 4.39Å; Y71-E359 HydrophobicContact CE2-CG 3.64Å; L74-E359 HydrophobicContact CD2-CB 3.54Å; L74-E359 HydrophobicContact CD2-CG 4.49Å; L74-E359 HydrophobicContact CG-CB 4.3Å; K78-E359 PolarHBondContact NZ-O 3.11Å; K78-E359 IonicContact NZ-OE2 3.44Å; K78-E359 PolarHBondContact NZ-OE2 3.49Å; L355-E359 WeakPolarHBondContact O-CG 3.46Å; L355-E359 PolarHBondContact O-N 2.87Å; L355-E359 VanDerWaalsContact O-N 3.08Å; I356-E359 PolarHBondContact O-N 2.96Å; Y357-E359 PolarHBondContact O-N 2.67Å; E359-W363 PolarHBondContact O-N 3.12Å
360	V	94.2	Very high	86.6	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-70.4	-49.1	175.7	177.3	0	0	0	0	110.6	L74 V91 T93 F101 V104 I356 Y357 K358 W363 E364	L74-V360 HydrophobicContact CD2-CG2 3.98Å; V91-V360 HydrophobicContact CG2-CB 4.46Å; V91-V360 HydrophobicContact CG2-CG1 4.2Å; V91-V360 HydrophobicContact CG2-CG2 3.83Å; T93-V360 HydrophobicContact CG2-CG1 4.03Å; F101-V360 HydrophobicContact CZ-CG2 4.49Å; V104-V360 HydrophobicContact CG1-CG2 4.29Å; I356-V360 HydrophobicContact CG2-CG2 4.32Å; I356-V360 VanDerWaalsContact O-CG2 3.29Å; I356-V360 WeakPolarHBondContact O-CG2 3.36Å; I356-V360 PolarHBondContact O-N 2.98Å; Y357-V360 PolarHBondContact O-N 2.86Å; K358-V360 VanDerWaalsContact C-N 3.27Å; K358-V360 PolarHBondContact O-N 3.01Å; V360-W363 WeakPolarHBondContact O-CB 3.18Å; V360-W363 PolarHBondContact O-N 2.75Å; V360-E364 PolarHBondContact O-N 3.04Å
361	M	92.9	Very high	84.1	Confident	49 Å²	49	64.4 Å²	64.4	24%	0.241	32%	0.323	C	S	.	.	H	α-helix	trans	-63.1	-43	179.3	-67.3	-61.3	107	0	0	112.1	T93 Y357 K358 W363 E364 E365	T93-M361 HydrophobicContact CG2-CE 3.42Å; T93-M361 VanDerWaalsContact CG2-CE 3.42Å; Y357-M361 HydrophobicContact CD1-CG 4.1Å; Y357-M361 HydrophobicContact CD2-CE 4.4Å; Y357-M361 HydrophobicContact CD2-CG 4.42Å; Y357-M361 HydrophobicContact CE1-CG 3.75Å; Y357-M361 HydrophobicContact CE1-SD 4.45Å; Y357-M361 HydrophobicContact CE2-CE 3.85Å; Y357-M361 HydrophobicContact CE2-CG 4.1Å; Y357-M361 HydrophobicContact CE2-SD 4.16Å; Y357-M361 HydrophobicContact CG-CG 4.43Å; Y357-M361 VanDerWaalsContact O-CG 3.31Å; Y357-M361 WeakPolarHBondContact O-CG 3.26Å; Y357-M361 PolarHBondContact O-N 3.31Å; K358-M361 PolarHBondContact O-N 2.7Å; M361-W363 PolarHBondContact O-N 3.24Å; M361-E364 PolarHBondContact O-N 3.09Å; M361-E365 PolarHBondContact O-N 3.22Å
362	D	90.7	Very high	81.6	Confident	50 Å²	50	68.3 Å²	68.3	27%	0.267	34%	0.339	S	S	.	.	H	α-helix	trans	-59.3	-36.6	176.9	-74.3	-2.3	0	0	0	111.2	K358 R366	K358-D362 VanDerWaalsContact O-CB 3.31Å; K358-D362 WeakPolarHBondContact O-CB 3.32Å; K358-D362 PolarHBondContact O-N 3.3Å; D362-R366 WeakPolarHBondContact O-CG 3.35Å; D362-R366 PolarHBondContact O-N 3.17Å
363	W	89	Confident	79.2	Confident	43 Å²	43	74.4 Å²	74.4	16%	0.163	37%	0.372	C	S	.	.	H	α-helix	trans	-70.2	-44.5	175.7	-176.6	-83.5	0	0	0	112.5	K78 L88 N90 V91 E359 V360 M361 E365 R366 S367	K78-W363 HydrophobicContact CB-CZ3 4.42Å; K78-W363 HydrophobicContact CD-CE3 4Å; K78-W363 HydrophobicContact CD-CZ3 4.41Å; K78-W363 HydrophobicContact CG-CE3 3.85Å; K78-W363 HydrophobicContact CG-CZ3 3.77Å; L88-W363 HydrophobicContact CB-CH2 4.48Å; L88-W363 HydrophobicContact CD2-CE3 4.44Å; L88-W363 HydrophobicContact CD2-CH2 4.13Å; L88-W363 HydrophobicContact CD2-CZ2 4.32Å; L88-W363 HydrophobicContact CD2-CZ3 4.21Å; L88-W363 HydrophobicContact CG-CH2 4.38Å; L88-W363 HydrophobicContact CG-CZ2 4.34Å; N90-W363 PolarHBondContact OD1-NE1 3.17Å; V91-W363 HydrophobicContact CG1-CB 3.49Å; V91-W363 VanDerWaalsContact CG1-CB 3.49Å; V91-W363 VanDerWaalsContact CG1-CD1 3.42Å; V91-W363 HydrophobicContact CG1-CD2 3.83Å; V91-W363 HydrophobicContact CG1-CG 3.27Å; E359-W363 PolarHBondContact O-N 3.12Å; V360-W363 WeakPolarHBondContact O-CB 3.18Å; V360-W363 PolarHBondContact O-N 2.75Å; M361-W363 PolarHBondContact O-N 3.24Å; W363-E365 VanDerWaalsContact C-N 3.27Å; W363-E365 PolarHBondContact O-N 2.98Å; W363-R366 PolarHBondContact O-N 3.47Å; W363-S367 PolarHBondContact NE1-OG 3.15Å; W363-S367 WeakPolarHBondContact O-CB 3.37Å; W363-S367 PolarHBondContact O-N 3.42Å; W363-S367 PolarHBondContact O-OG 2.74Å
364	E	84.3	Confident	76.4	Confident	32 Å²	32	79.5 Å²	79.5	15%	0.15	40%	0.396	C	S	.	.	H	α-helix	trans	-60.9	-38.4	177.4	-73.4	-167.7	-176.6	0	0	111.8	F92 V360 M361 S367 K368	F92-E364 WeakPolarHBondContact CA-OE1 3.15Å; F92-E364 WeakPolarHBondContact CB-OE1 3.28Å; V360-E364 PolarHBondContact O-N 3.04Å; M361-E364 PolarHBondContact O-N 3.09Å; E364-S367 PolarHBondContact O-N 3.22Å; E364-K368 WeakPolarHBondContact O-CD 3.43Å; E364-K368 VanDerWaalsContact O-CG 3.27Å; E364-K368 WeakPolarHBondContact O-CG 3.42Å; E364-K368 PolarHBondContact O-N 3.11Å; E364-K368 IonicContact OE2-NZ 3.09Å
365	E	83.2	Confident	73.3	Confident	117 Å²	117	79 Å²	79	55%	0.547	40%	0.402	S	S	.	.	H	α-helix	trans	-65.8	-45.9	176.9	-172.4	171.5	-163.6	0	0	111.9	M361 W363 S367 K368 N369	M361-E365 PolarHBondContact O-N 3.22Å; W363-E365 VanDerWaalsContact C-N 3.27Å; W363-E365 PolarHBondContact O-N 2.98Å; E365-S367 VanDerWaalsContact C-N 3.3Å; E365-S367 PolarHBondContact O-N 3.3Å; E365-K368 PolarHBondContact O-N 3.06Å; E365-N369 PolarHBondContact O-N 3.15Å; E365-N369 PolarHBondContact O-ND2 3.44Å
366	R	81.3	Confident	70.2	Confident	117 Å²	117	81.3 Å²	81.3	44%	0.442	42%	0.422	S	S	.	.	H	α-helix	trans	-59.5	-41.5	174.6	-71.4	177.3	-165.5	-173.1	5.2	112.3	D362 W363 N369 G370 V371	D362-R366 WeakPolarHBondContact O-CG 3.35Å; D362-R366 PolarHBondContact O-N 3.17Å; W363-R366 PolarHBondContact O-N 3.47Å; R366-N369 PolarHBondContact O-N 3.47Å; R366-G370 PolarHBondContact O-N 3.45Å; R366-V371 PolarHBondContact O-N 2.85Å
367	S	76	Confident	67.3	Low	62 Å²	62	89.4 Å²	89.4	43%	0.434	47%	0.466	S	S	.	.	H	α-helix	trans	-65.5	-38.5	178.8	-61.9	0	0	0	0	112.3	W363 E364 E365 G370	W363-S367 PolarHBondContact NE1-OG 3.15Å; W363-S367 WeakPolarHBondContact O-CB 3.37Å; W363-S367 PolarHBondContact O-N 3.42Å; W363-S367 PolarHBondContact O-OG 2.74Å; E364-S367 PolarHBondContact O-N 3.22Å; E365-S367 VanDerWaalsContact C-N 3.3Å; E365-S367 PolarHBondContact O-N 3.3Å; S367-G370 PolarHBondContact O-N 3.13Å
368	K	69.5	Low	64.2	Low	148 Å²	148	91.3 Å²	91.3	64%	0.643	49%	0.489	S	S	*	.	H	α-helix	trans	-67.6	-36.2	174.9	-74.7	164.9	-172.1	156.9	0	112.1	E364 E365 G370	E364-K368 WeakPolarHBondContact O-CD 3.43Å; E364-K368 VanDerWaalsContact O-CG 3.27Å; E364-K368 WeakPolarHBondContact O-CG 3.42Å; E364-K368 PolarHBondContact O-N 3.11Å; E364-K368 IonicContact OE2-NZ 3.09Å; E365-K368 PolarHBondContact O-N 3.06Å; K368-G370 PolarHBondContact O-N 3.39Å
369	N	63.8	Low	61.1	Low	112 Å²	112	90.1 Å²	90.1	60%	0.599	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	1.9	-179.9	-67.7	-22.1	0	0	0	113.6	E365 R366 V371	E365-N369 PolarHBondContact O-N 3.15Å; E365-N369 PolarHBondContact O-ND2 3.44Å; R366-N369 PolarHBondContact O-N 3.47Å; N369-V371 HydrophobicContact CB-CG2 4.17Å; N369-V371 PolarHBondContact O-N 3.24Å
370	G	52.8	Low	58.4	Low	58 Å²	58	94.3 Å²	94.3	60%	0.598	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	17.2	176.4	0	0	0	0	0	114.1	R366 S367 K368 K372	R366-G370 PolarHBondContact O-N 3.45Å; S367-G370 PolarHBondContact O-N 3.13Å; K368-G370 PolarHBondContact O-N 3.39Å; G370-K372 PolarHBondContact O-N 2.69Å
371	V	42	Very low	55.2	Low	86 Å²	86	99.9 Å²	99.9	52%	0.521	57%	0.57	S	S	.	*			trans	-77.6	91.1	176.7	-173.9	0	0	0	0	107.5	R366 N369 D373	R366-V371 PolarHBondContact O-N 2.85Å; N369-V371 HydrophobicContact CB-CG2 4.17Å; N369-V371 PolarHBondContact O-N 3.24Å; V371-D373 PolarHBondContact O-N 3.38Å
372	K	41.7	Very low	52.5	Low	172 Å²	172	102.1 Å²	102.1	75%	0.748	59%	0.59	S	S	*	*			trans	-75.5	103.6	172.5	-75.5	-171.5	175.4	-173	0	109.4	G370 Q374	G370-K372 PolarHBondContact O-N 2.69Å; K372-Q374 PolarHBondContact O-N 3.29Å; K372-Q374 VanDerWaalsContact O-N 3.08Å
373	D	42.7	Very low	49.8	Very low	132 Å²	132	109.2 Å²	109.2	71%	0.706	62%	0.619	S	S	*	*			trans	-78.1	70.8	154.7	-72	-32.7	0	0	0	108.1	V371	V371-D373 PolarHBondContact O-N 3.38Å
374	Q	35.8	Very low	46.9	Very low	129 Å²	129	112.1 Å²	112.1	60%	0.603	65%	0.652	S	S	*	*			trans	-126.9	123	163.7	-83.5	-172.5	0.7	0	0	107.7	K372 S376	K372-Q374 PolarHBondContact O-N 3.29Å; K372-Q374 VanDerWaalsContact O-N 3.08Å; Q374-S376 PolarHBondContact O-N 3.36Å
375	P	30.5	Very low	44.5	Very low	94 Å²	94	117 Å²	117	61%	0.61	68%	0.684	S	S	*	*			trans	-65.3	123.3	161.4	-3.8	20	0	0	0	106.9	D377	P375-D377 PolarHBondContact O-N 2.68Å
376	S	28.9	Very low	42	Very low	102 Å²	102	117.3 Å²	117.3	71%	0.713	70%	0.696	S	S	*	*			trans	-58.4	120.8	167.1	52.5	0	0	0	0	108.9	Q374 A378	Q374-S376 PolarHBondContact O-N 3.36Å; S376-A378 PolarHBondContact O-N 3.2Å
377	D	32.5	Very low	39.9	Very low	172 Å²	172	117 Å²	117	92%	0.92	71%	0.712	S	S	*	*			trans	-60.7	95.4	154.4	-81.1	-32.3	0	0	0	106.9	P375 A379	P375-D377 PolarHBondContact O-N 2.68Å; D377-A379 PolarHBondContact O-N 3.06Å
378	A	31.4	Very low	37.8	Very low	78 Å²	78	123 Å²	123	65%	0.645	73%	0.733	S	S	*	*			trans	-69	112	174.2	0	0	0	0	0	107.5	S376 V380	S376-A378 PolarHBondContact O-N 3.2Å; A378-V380 PolarHBondContact O-N 3.29Å
379	A	28.8	Very low	36.1	Very low	99 Å²	99	121.6 Å²	121.6	82%	0.818	74%	0.742	S	S	*	*			trans	-44.8	105.6	166.8	0	0	0	0	0	110.8	D377 S381	D377-A379 PolarHBondContact O-N 3.06Å; A379-S381 VanDerWaalsContact C-N 3.33Å; A379-S381 PolarHBondContact O-N 3.4Å; A379-S381 VanDerWaalsContact O-N 3.1Å
380	V	33.5	Very low	34.7	Very low	128 Å²	128	121.3 Å²	121.3	78%	0.776	75%	0.749	S	S	*	*			trans	-80.5	90.2	165.9	-179.7	0	0	0	0	107.4	A378 S382	A378-V380 PolarHBondContact O-N 3.29Å; V380-S382 PolarHBondContact O-N 3.24Å
381	S	28.1	Very low	33.7	Very low	118 Å²	118	123.6 Å²	123.6	83%	0.825	76%	0.755	S	S	*	*			trans	-73.2	106.8	156.7	-179.1	0	0	0	0	108.2	A379	A379-S381 VanDerWaalsContact C-N 3.33Å; A379-S381 PolarHBondContact O-N 3.4Å; A379-S381 VanDerWaalsContact O-N 3.1Å
382	S	36	Very low	33.4	Very low	96 Å²	96	127 Å²	127	67%	0.671	77%	0.769	S	S	*	*			trans	-137.2	95.9	164.5	61.3	0	0	0	0	111.2	V380	V380-S382 PolarHBondContact O-N 3.24Å
383	K	33.2	Very low	33.1	Very low	199 Å²	199	125.3 Å²	125.3	87%	0.865	77%	0.768	S	S	*	*			trans	15.9	113.5	148.9	-70.3	177	176.6	176.6	0	117.5
384	A	29.8	Very low	32.4	Very low	103 Å²	103	126 Å²	126	85%	0.851	77%	0.772	S	S	*	*			trans	-56.8	137.3	161.3	0	0	0	0	0	112.7
385	T	33.4	Very low	32.3	Very low	135 Å²	135	128.1 Å²	128.1	83%	0.828	79%	0.786	S	S	*	*			trans	-139.7	132.9	153.1	-27	0	0	0	0	107.6
386	P	30.1	Very low	32.1	Very low	123 Å²	123	128.5 Å²	128.5	80%	0.799	79%	0.791	S	S	*	*			trans	-101.4	138.6	-165	35.7	-29.7	0	0	0	113.5
387	S	37	Very low	32.1	Very low	111 Å²	111	128.6 Å²	128.6	78%	0.776	79%	0.791	S	S	*	*			trans	-159.7	96.1	156.2	62	0	0	0	0	109.1
388	Q	32.7	Very low	31.9	Very low	187 Å²	187	129.3 Å²	129.3	87%	0.874	79%	0.791	S	S	*	*				84.2	111.5	98.7	-83.6	-168.1	-0.6	0	0	116
389	S	33.6	Very low	31.7	Very low	120 Å²	120	130.9 Å²	130.9	84%	0.839	80%	0.798	S	S	*	*			trans	70.5	133.3	156	72.1	0	0	0	0	117.2
390	S	35.2	Very low	31.9	Very low	105 Å²	105	132.4 Å²	132.4	73%	0.734	80%	0.797	S	S	*	*			cis	-157.9	136.2	23.4	43.8	0	0	0	0	111.5
391	S	30.8	Very low	31.7	Very low	106 Å²	106	135 Å²	135	74%	0.741	80%	0.801	S	S	*	*			trans	25	123.6	141.6	-27.4	0	0	0	0	120.1
392	I	35.9	Very low	31.7	Very low	157 Å²	157	138 Å²	138	81%	0.805	80%	0.802	S	S	*	*				-175.5	110.5	109.3	-86	152.1	0	0	0	110.1
393	N	34.4	Very low	31.4	Very low	137 Å²	137	140 Å²	140	73%	0.733	81%	0.809	S	S	*	*			trans	31.9	116.4	142.2	-56.1	-12	0	0	0	122
394	D	28.9	Very low	31	Very low	146 Å²	146	138 Å²	138	78%	0.781	81%	0.808	S	S	*	*				24.1	123.1	121.4	-62.4	-39.5	0	0	0	118.7
395	I	33	Very low	30.9	Very low	174 Å²	174	137.7 Å²	137.7	89%	0.892	81%	0.805	S	S	*	*				-153.6	116.7	123	-89.4	140.3	0	0	0	108.3
396	S	27.3	Very low	30.9	Very low	103 Å²	103	136.6 Å²	136.6	72%	0.72	80%	0.803	S	S	*	*			trans	-86.6	166.8	168.1	51.7	0	0	0	0	110.6
397	S	27.6	Very low	30.8	Very low	104 Å²	104	138.2 Å²	138.2	73%	0.727	81%	0.805	S	S	*	*			trans	95.5	103.6	163.1	78.6	0	0	0	0	117.5
398	M	29.8	Very low	30.7	Very low	186 Å²	186	139.9 Å²	139.9	92%	0.916	81%	0.811	S	S	*	*			trans	-135.3	100.3	132.3	-73.4	-152.5	94.2	0	0	108.2
399	S	27.8	Very low	30.5	Very low	112 Å²	112	138.2 Å²	138.2	78%	0.783	81%	0.808	S	S	*	*			trans	-90	121	162.6	-50	0	0	0	0	106.9
400	T	31.4	Very low	30.7	Very low	130 Å²	130	138 Å²	138	80%	0.798	81%	0.806	S	S	*	*			trans	-100.6	106	165.6	45	0	0	0	0	108.8
401	E	29	Very low	30.5	Very low	184 Å²	184	137.6 Å²	137.6	86%	0.86	80%	0.803	S	S	*	*			trans	-73.6	136.5	168.1	-77.8	-175.7	147.7	0	0	110.9
402	H	28.5	Very low	30.9	Very low	181 Å²	181	139.6 Å²	139.6	84%	0.838	81%	0.805	S	S	*	*			trans	-67.7	138.6	164.9	-88.9	-87.8	0	0	0	110.6
403	T	29.9	Very low	30.8	Very low	136 Å²	136	139 Å²	139	83%	0.834	80%	0.803	S	S	*	*			trans	-141.5	124.9	154.9	-41.1	0	0	0	0	110.5
404	L	26	Very low	30.8	Very low	158 Å²	158	136.4 Å²	136.4	83%	0.827	80%	0.801	S	S	*	*			trans	-107.8	155.9	176	-98.8	158.4	0	0	0	109.3
405	A	27.6	Very low	31	Very low	96 Å²	96	134.3 Å²	134.3	79%	0.793	80%	0.798	S	S	*	*			trans	76	141.4	168	0	0	0	0	0	115.5
406	S	33.1	Very low	31.3	Very low	112 Å²	112	132.9 Å²	132.9	78%	0.783	80%	0.797	S	S	*	*			cis	-162.7	148.2	32.4	49.6	0	0	0	0	112.1
407	D	27	Very low	31.7	Very low	157 Å²	157	131.5 Å²	131.5	84%	0.84	80%	0.799	S	S	*	*			trans	-61.5	143.4	168.2	-61.6	-56.2	0	0	0	113
408	T	36.2	Very low	32	Very low	147 Å²	147	132.7 Å²	132.7	90%	0.902	80%	0.804	S	S	*	*			trans	-150	131.2	140.4	38.7	0	0	0	0	111.6
409	D	28.2	Very low	32.5	Very low	152 Å²	152	132 Å²	132	81%	0.813	80%	0.804	S	S	*	*			trans	-80.5	147.3	-177.6	-161.8	-0.7	0	0	0	111.6
410	S	37.2	Very low	33	Very low	115 Å²	115	135.4 Å²	135.4	80%	0.804	81%	0.807	S	S	*	*			trans	-171	107.6	148.5	31.4	0	0	0	0	111.8
411	S	31.8	Very low	33.1	Very low	96 Å²	96	132.6 Å²	132.6	67%	0.671	80%	0.804	S	S	*	*			trans	-50.4	149.5	162.2	54.8	0	0	0	0	114.7
412	L	37.3	Very low	33.6	Very low	149 Å²	149	130.2 Å²	130.2	78%	0.78	81%	0.806	S	S	*	*				178.9	117.6	118.6	-92.4	156.3	0	0	0	112.4
413	D	35.3	Very low	34.4	Very low	143 Å²	143	137 Å²	137	77%	0.765	82%	0.824	S	S	*	*			trans	54.7	112.6	134.5	-70.6	-18.1	0	0	0	123.5
414	A	34.2	Very low	34.6	Very low	83 Å²	83	137.1 Å²	137.1	69%	0.686	82%	0.824	S	S	*	*				84	119.7	112.5	0	0	0	0	0	121
415	S	33.8	Very low	35.1	Very low	103 Å²	103	136 Å²	136	72%	0.72	82%	0.824	S	S	*	*				99	119.7	123.5	63.1	0	0	0	0	120.6
416	T	38.6	Very low	35.5	Very low	143 Å²	143	138.2 Å²	138.2	88%	0.877	83%	0.825	S	S	*	*			trans	87.1	111.4	138.8	52.2	0	0	0	0	121.4
417	G	34.9	Very low	35.7	Very low	74 Å²	74	139.8 Å²	139.8	76%	0.763	83%	0.828	S	S	*	*				112.8	117.8	121.8	0	0	0	0	0	117.4
418	P	35.4	Very low	36.2	Very low	129 Å²	129	138.7 Å²	138.7	84%	0.838	83%	0.827	S	S	*	*			trans	-95.2	147.3	177.8	36.3	-28.8	0	0	0	112.1
419	L	39.8	Very low	36.2	Very low	172 Å²	172	138.1 Å²	138.1	90%	0.901	82%	0.822	S	S	*	*			trans	-139.2	143.3	163.8	-90	171.3	0	0	0	111.6
420	E	36.9	Very low	36.8	Very low	184 Å²	184	137.1 Å²	137.1	86%	0.86	82%	0.823	S	S	*	*			trans	-71.1	155.4	-166.9	-59.4	165.4	128	0	0	114.9
421	G	33.7	Very low	36.7	Very low	70 Å²	70	138.8 Å²	138.8	72%	0.722	82%	0.824	S	S	*	*				82.5	113.7	128	0	0	0	0	0	119.1
422	C	41	Very low	37.2	Very low	134 Å²	134	142.4 Å²	142.4	91%	0.905	84%	0.837	S	S	*	*				-175.2	127.6	120.8	-98.2	0	0	0	0	112.2
423	R	45	Very low	37.1	Very low	325 Å²	325	141.8 Å²	141.8	100%	1.226	84%	0.842	S	S	*	*			trans	89.2	0	170.8	-64	-170.6	172.5	-172.8	-1.6	118.7

Retrieved 423 of 423 residues in 294.6 ms (Link to these results)

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