A0A286YFD7_HUMAN 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 , UniProt , Accession A0A286YFD7, Species HUMAN (Homo sapiens, Human), Gene MAPK10, Length 426 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	33	Very low	57.7	Low	249 Å²	249	126.6 Å²	126.6	100%	1.227	65%	0.65	S	S	*	*				0	128.5	0	-79.6	174.3	170.2	0	0	108.9
2	S	35.8	Very low	60.9	Low	109 Å²	109	122.3 Å²	122.3	76%	0.762	64%	0.639	S	S	*	*			trans	-40.7	119	-173	151.7	0	0	0	0	116.5	S4	S2-S4 PolarHBondContact O-N 3.32Å
3	K	36.9	Very low	63.6	Low	206 Å²	206	116.6 Å²	116.6	90%	0.896	61%	0.613	S	S	*	*			trans	-82.7	103.2	155.7	-85.1	-175.6	175.9	179.6	0	109.2
4	S	36.1	Very low	65.9	Low	90 Å²	90	117 Å²	117	63%	0.629	61%	0.61	S	S	*	*			trans	47.1	92.1	150.9	66.5	0	0	0	0	118.7	S2 V6	S2-S4 PolarHBondContact O-N 3.32Å; S4-V6 PolarHBondContact O-N 3.19Å
5	K	36.2	Very low	67.6	Low	199 Å²	199	109.9 Å²	109.9	87%	0.865	57%	0.573	S	S	*	*			trans	-61.9	84.8	143.4	-72.7	179.9	176.2	-179	0	108	D7	K5-D7 PolarHBondContact O-N 3.17Å
6	V	45.1	Very low	68.7	Low	106 Å²	106	107.3 Å²	107.3	64%	0.642	58%	0.581	S	S	*	*			trans	-76.5	110.2	162.9	-178.2	0	0	0	0	105	S4 N8	S4-V6 PolarHBondContact O-N 3.19Å; V6-N8 PolarHBondContact O-N 3.26Å; V6-N8 VanDerWaalsContact O-N 3.1Å
7	D	51.4	Low	69.7	Low	128 Å²	128	111.6 Å²	111.6	68%	0.684	60%	0.604	S	S	*	*			trans	-49.2	120.7	174.9	-77.5	-41.1	0	0	0	109.3	K5 Q9	K5-D7 PolarHBondContact O-N 3.17Å; D7-Q9 PolarHBondContact O-N 3.26Å
8	N	78.9	Confident	70.8	Confident	110 Å²	110	107 Å²	107	59%	0.588	58%	0.582	S	S	*	*			trans	-59.5	109.5	174.3	-165.8	7.5	0	0	0	107.2	V6 F10 K24	V6-N8 PolarHBondContact O-N 3.26Å; V6-N8 VanDerWaalsContact O-N 3.1Å; N8-F10 PolarHBondContact O-N 3.22Å; N8-K24 WeakPolarHBondContact O-CE 3.5Å; N8-K24 PolarHBondContact O-NZ 3.43Å
9	Q	90.1	Very high	72.1	Confident	104 Å²	104	104.1 Å²	104.1	49%	0.486	57%	0.568	S	S	.	*			trans	-71.3	-15.3	-174.5	-69.3	-176	-9.6	0	0	112.2	D7 L23 K24	D7-Q9 PolarHBondContact O-N 3.26Å; Q9-L23 HydrophobicContact CB-CD2 4.32Å; Q9-K24 PolarHBondContact O-N 2.99Å
10	F	95.1	Very high	73.3	Confident	26 Å²	26	98.9 Å²	98.9	11%	0.114	54%	0.539	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	157.2	-178	-63	-92.8	0	0	0	111.7	N8 T21 V22 L23 F92 T93 P94	N8-F10 PolarHBondContact O-N 3.22Å; F10-T21 HydrophobicContact CB-CG2 3.89Å; F10-T21 HydrophobicContact CG-CG2 4.49Å; F10-V22 CarbonylContact C-O 3.57Å; F10-V22 WeakPolarHBondContact CA-O 3.33Å; F10-V22 VanDerWaalsContact CD1-C 3.44Å; F10-L23 HydrophobicContact CD1-CD2 4.14Å; F10-L23 HydrophobicContact CD1-CG 4.34Å; F10-L23 HydrophobicContact CE1-CD2 3.58Å; F10-L23 HydrophobicContact CE1-CG 3.76Å; F10-L23 HydrophobicContact CE2-CD2 4.01Å; F10-L23 HydrophobicContact CZ-CD2 3.51Å; F10-L23 HydrophobicContact CZ-CG 4.14Å; F10-F92 AromaticContact CE1-CD2 3.62Å; F10-F92 HydrophobicContact CE1-CD2 3.62Å; F10-F92 AromaticContact CE1-CE2 3.96Å; F10-F92 HydrophobicContact CE1-CE2 3.96Å; F10-F92 HydrophobicContact CZ-CD2 4.4Å; F10-T93 WeakPolarHBondContact CZ-O 3.36Å; F10-P94 HydrophobicContact CD1-CB 3.82Å; F10-P94 HydrophobicContact CE1-CB 4.02Å; F10-P94 HydrophobicContact CG-CB 4.13Å; F10-P94 HydrophobicContact CZ-CB 4.48Å
11	Y	96.3	Very high	74.4	Confident	66 Å²	66	95.6 Å²	95.6	26%	0.259	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	158	166.2	76.6	-73.2	0	0	0	109.3	V13 T21 V22 K24 Y26 L29	Y11-V13 HydrophobicContact CD2-CG2 3.76Å; Y11-V13 HydrophobicContact CE2-CG2 3.29Å; Y11-T21 CarbonylContact O-C 3.57Å; Y11-T21 WeakPolarHBondContact O-CA 3.38Å; Y11-V22 HydrophobicContact CD1-CG2 4.13Å; Y11-V22 WeakPolarHBondContact CD1-O 3.41Å; Y11-V22 HydrophobicContact CE1-CG2 3.51Å; Y11-V22 PolarHBondContact N-O 3.44Å; Y11-V22 PolarHBondContact O-N 3.21Å; Y11-K24 HydrophobicContact CD1-CG 4.12Å; Y11-Y26 VanDerWaalsContact CE1-O 3.23Å; Y11-Y26 WeakPolarHBondContact CE1-O 3.11Å; Y11-Y26 VanDerWaalsContact CZ-O 3.3Å; Y11-Y26 PolarHBondContact OH-O 3.42Å; Y11-L29 WeakPolarHBondContact OH-CD1 3.3Å
12	S	96.3	Very high	77.4	Confident	74 Å²	74	83.8 Å²	83.8	52%	0.517	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	140.7	-176.4	-59.6	0	0	0	0	111.5	F20 T21	S12-F20 CarbonylContact C-O 3.52Å; S12-F20 VanDerWaalsContact CA-O 3.24Å; S12-F20 WeakPolarHBondContact CA-O 3.42Å; S12-T21 PolarHBondContact OG-OG1 3.38Å
13	V	95.9	Very high	80.3	Confident	49 Å²	49	80 Å²	80	30%	0.297	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	137.3	175.5	178	0	0	0	0	108.8	Y11 V15 F20	Y11-V13 HydrophobicContact CD2-CG2 3.76Å; Y11-V13 HydrophobicContact CE2-CG2 3.29Å; V13-V15 HydrophobicContact CG1-CG2 4.43Å; V13-F20 PolarHBondContact N-O 3.1Å; V13-F20 PolarHBondContact O-N 3.37Å
14	E	95.6	Very high	83.1	Confident	122 Å²	122	75.3 Å²	75.3	57%	0.57	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	128.1	172.4	-66.4	-54.9	141.4	0	0	110.8	T19	E14-T19 WeakPolarHBondContact OE1-CB 3.42Å; E14-T19 WeakPolarHBondContact OE1-CG2 3.49Å; E14-T19 PolarHBondContact OE1-OG1 2.93Å; E14-T19 PolarHBondContact OE2-OG1 3.12Å
15	V	91.3	Very high	86	Confident	10 Å²	10	73.6 Å²	73.6	6%	0.061	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	93.3	179	-177.7	0	0	0	0	108.1	V13 D17 S18 F20 P31 I39	V13-V15 HydrophobicContact CG1-CG2 4.43Å; V15-D17 PolarHBondContact O-N 3.29Å; V15-S18 PolarHBondContact N-O 3.47Å; V15-S18 PolarHBondContact O-N 3.4Å; V15-F20 HydrophobicContact CB-CD2 3.72Å; V15-F20 HydrophobicContact CB-CE2 3.98Å; V15-F20 HydrophobicContact CG1-CD2 4.44Å; V15-F20 HydrophobicContact CG1-CE2 4.24Å; V15-F20 HydrophobicContact CG2-CB 4.16Å; V15-F20 HydrophobicContact CG2-CD2 3.62Å; V15-F20 HydrophobicContact CG2-CE2 4.21Å; V15-F20 HydrophobicContact CG2-CG 3.96Å; V15-P31 HydrophobicContact CG1-CB 3.68Å; V15-P31 HydrophobicContact CG1-CG 4.04Å; V15-I39 HydrophobicContact CG1-CG2 4.29Å
16	G	85.2	Confident	88.9	Confident	68 Å²	68	64.1 Å²	64.1	70%	0.701	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	-125.3	-170.2	0	0	0	0	0	110.2	S18	G16-S18 VanDerWaalsContact C-N 3.31Å; G16-S18 PolarHBondContact O-N 3.4Å
17	D	85.1	Confident	91.4	Very high	181 Å²	181	63 Å²	63	97%	0.968	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	16.6	179	-55.6	-37.7	0	0	0	113.2	V15	V15-D17 PolarHBondContact O-N 3.29Å
18	S	89.9	Confident	93.6	Very high	29 Å²	29	63 Å²	63	20%	0.203	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	135.3	-178	-158.2	0	0	0	0	113.2	V15 G16	V15-S18 PolarHBondContact N-O 3.47Å; V15-S18 PolarHBondContact O-N 3.4Å; G16-S18 VanDerWaalsContact C-N 3.31Å; G16-S18 PolarHBondContact O-N 3.4Å
19	T	94.6	Very high	94.5	Very high	51 Å²	51	59 Å²	59	31%	0.313	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	124.5	172.7	-45.5	0	0	0	0	111.2	E14 K56	E14-T19 WeakPolarHBondContact OE1-CB 3.42Å; E14-T19 WeakPolarHBondContact OE1-CG2 3.49Å; E14-T19 PolarHBondContact OE1-OG1 2.93Å; E14-T19 PolarHBondContact OE2-OG1 3.12Å; T19-K56 PolarHBondContact O-NZ 3.06Å
20	F	96.7	Very high	94.7	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	117.8	168.6	-87.9	-117.3	0	0	0	109.4	S12 V13 V15 V22 L29 I39 C41 K56 Y105	S12-F20 CarbonylContact C-O 3.52Å; S12-F20 VanDerWaalsContact CA-O 3.24Å; S12-F20 WeakPolarHBondContact CA-O 3.42Å; V13-F20 PolarHBondContact N-O 3.1Å; V13-F20 PolarHBondContact O-N 3.37Å; V15-F20 HydrophobicContact CB-CD2 3.72Å; V15-F20 HydrophobicContact CB-CE2 3.98Å; V15-F20 HydrophobicContact CG1-CD2 4.44Å; V15-F20 HydrophobicContact CG1-CE2 4.24Å; V15-F20 HydrophobicContact CG2-CB 4.16Å; V15-F20 HydrophobicContact CG2-CD2 3.62Å; V15-F20 HydrophobicContact CG2-CE2 4.21Å; V15-F20 HydrophobicContact CG2-CG 3.96Å; F20-V22 HydrophobicContact CB-CG1 4.23Å; F20-V22 HydrophobicContact CD1-CG1 4.18Å; F20-L29 HydrophobicContact CB-CD2 3.82Å; F20-L29 HydrophobicContact CD1-CD2 3.81Å; F20-L29 HydrophobicContact CG-CD2 4.09Å; F20-I39 HydrophobicContact CE2-CB 3.86Å; F20-I39 HydrophobicContact CE2-CD1 4.47Å; F20-I39 HydrophobicContact CE2-CG2 3.69Å; F20-I39 HydrophobicContact CZ-CB 3.77Å; F20-I39 HydrophobicContact CZ-CG2 3.68Å; F20-C41 HydrophobicContact CE1-CB 4.2Å; F20-K56 HydrophobicContact CD2-CD 4.39Å; F20-K56 HydrophobicContact CE1-CB 3.81Å; F20-K56 HydrophobicContact CE2-CB 4.24Å; F20-K56 HydrophobicContact CE2-CD 4.26Å; F20-K56 HydrophobicContact CZ-CB 3.66Å; F20-K56 HydrophobicContact CZ-CD 4.49Å; F20-Y105 HydrophobicContact CB-CE1 4.49Å; F20-Y105 HydrophobicContact CD1-CD1 4.26Å; F20-Y105 AromaticContact CD1-CE1 3.71Å; F20-Y105 HydrophobicContact CD1-CE1 3.71Å; F20-Y105 HydrophobicContact CE1-CD1 4.46Å; F20-Y105 HydrophobicContact CE1-CE1 4.17Å; F20-Y105 HydrophobicContact CG-CE1 4.18Å
21	T	96.8	Very high	94.6	Very high	31 Å²	31	63.5 Å²	63.5	19%	0.19	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	100.9	174.1	-57.8	0	0	0	0	108.6	F10 Y11 S12 P94 Y105	F10-T21 HydrophobicContact CB-CG2 3.89Å; F10-T21 HydrophobicContact CG-CG2 4.49Å; Y11-T21 CarbonylContact O-C 3.57Å; Y11-T21 WeakPolarHBondContact O-CA 3.38Å; S12-T21 PolarHBondContact OG-OG1 3.38Å; T21-P94 HydrophobicContact CG2-CB 3.53Å; T21-P94 HydrophobicContact CG2-CG 4.12Å; T21-Y105 PolarHBondContact N-OH 3.28Å
22	V	96.9	Very high	94.2	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	159.5	-166.9	-58.5	0	0	0	0	112.2	F10 Y11 F20 L29 F92 Y105	F10-V22 CarbonylContact C-O 3.57Å; F10-V22 WeakPolarHBondContact CA-O 3.33Å; F10-V22 VanDerWaalsContact CD1-C 3.44Å; Y11-V22 HydrophobicContact CD1-CG2 4.13Å; Y11-V22 WeakPolarHBondContact CD1-O 3.41Å; Y11-V22 HydrophobicContact CE1-CG2 3.51Å; Y11-V22 PolarHBondContact N-O 3.44Å; Y11-V22 PolarHBondContact O-N 3.21Å; F20-V22 HydrophobicContact CB-CG1 4.23Å; F20-V22 HydrophobicContact CD1-CG1 4.18Å; V22-L29 HydrophobicContact CG1-CD2 4.08Å; V22-L29 HydrophobicContact CG2-CD1 4.04Å; V22-L29 HydrophobicContact CG2-CD2 4.03Å; V22-F92 HydrophobicContact CB-CE2 4.28Å; V22-F92 HydrophobicContact CB-CZ 3.91Å; V22-F92 HydrophobicContact CG1-CE2 4.33Å; V22-F92 HydrophobicContact CG1-CZ 3.92Å; V22-Y105 HydrophobicContact CG1-CD1 4.04Å; V22-Y105 HydrophobicContact CG1-CE1 3.92Å
23	L	96.3	Very high	93.4	Very high	30 Å²	30	62.6 Å²	62.6	16%	0.157	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	140.1	174.6	-68.7	169.8	0	0	0	110.7	Q9 F10 R25 Y26 F92	Q9-L23 HydrophobicContact CB-CD2 4.32Å; F10-L23 HydrophobicContact CD1-CD2 4.14Å; F10-L23 HydrophobicContact CD1-CG 4.34Å; F10-L23 HydrophobicContact CE1-CD2 3.58Å; F10-L23 HydrophobicContact CE1-CG 3.76Å; F10-L23 HydrophobicContact CE2-CD2 4.01Å; F10-L23 HydrophobicContact CZ-CD2 3.51Å; F10-L23 HydrophobicContact CZ-CG 4.14Å; L23-R25 HydrophobicContact CB-CG 3.93Å; L23-R25 PolarHBondContact O-N 2.92Å; L23-Y26 HydrophobicContact CB-CD2 3.9Å; L23-Y26 HydrophobicContact CB-CE2 3.98Å; L23-Y26 HydrophobicContact CD1-CE2 4.02Å; L23-Y26 HydrophobicContact CG-CE2 4.44Å; L23-Y26 PolarHBondContact O-N 3.31Å; L23-F92 HydrophobicContact CD1-CB 4.46Å; L23-F92 HydrophobicContact CD1-CD1 4.15Å; L23-F92 HydrophobicContact CD1-CG 4.23Å; L23-F92 HydrophobicContact CG-CD2 4.49Å; L23-F92 HydrophobicContact CG-CG 4.4Å
24	K	96.1	Very high	92.5	Very high	108 Å²	108	65.3 Å²	65.3	47%	0.47	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-19.8	178.9	-76.9	176.5	171.6	167.1	0	115.4	N8 Q9 Y11 Y26	N8-K24 WeakPolarHBondContact O-CE 3.5Å; N8-K24 PolarHBondContact O-NZ 3.43Å; Q9-K24 PolarHBondContact O-N 2.99Å; Y11-K24 HydrophobicContact CD1-CG 4.12Å; K24-Y26 VanDerWaalsContact C-N 3.26Å; K24-Y26 PolarHBondContact O-N 3.44Å
25	R	96.1	Very high	91.3	Very high	53 Å²	53	61.6 Å²	61.6	20%	0.2	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-28.2	174.2	69.1	-176.3	-71	173.7	-8.6	113	L23 D45 A46 V47	L23-R25 HydrophobicContact CB-CG 3.93Å; L23-R25 PolarHBondContact O-N 2.92Å; R25-D45 IonicContact CZ-OD1 3.68Å; R25-D45 IonicContact CZ-OD2 3.83Å; R25-D45 IonicContact NE-OD1 2.71Å; R25-D45 PolarHBondContact NE-OD1 3.29Å; R25-D45 IonicContact NE-OD2 2.9Å; R25-D45 PolarHBondContact NE-OD2 3.2Å; R25-D45 VanDerWaalsContact NH2-CG 3.3Å; R25-D45 IonicContact NH2-OD1 2.77Å; R25-D45 PolarHBondContact NH2-OD1 3.06Å; R25-D45 VanDerWaalsContact NH2-OD1 3.08Å; R25-D45 IonicContact NH2-OD2 3.99Å; R25-D45 PolarHBondContact NH2-OD2 3.08Å; R25-A46 PolarHBondContact O-N 3.2Å; R25-V47 HydrophobicContact CB-CG2 3.89Å
26	Y	97.9	Very high	90.1	Very high	1 Å²	1	66.1 Å²	66.1	0%	0.004	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	112.5	-179.9	-56.4	-55.7	0	0	0	109	Y11 L23 K24 Y44 D45 V52 I54 N90 F92 V107	Y11-Y26 VanDerWaalsContact CE1-O 3.23Å; Y11-Y26 WeakPolarHBondContact CE1-O 3.11Å; Y11-Y26 VanDerWaalsContact CZ-O 3.3Å; Y11-Y26 PolarHBondContact OH-O 3.42Å; L23-Y26 HydrophobicContact CB-CD2 3.9Å; L23-Y26 HydrophobicContact CB-CE2 3.98Å; L23-Y26 HydrophobicContact CD1-CE2 4.02Å; L23-Y26 HydrophobicContact CG-CE2 4.44Å; L23-Y26 PolarHBondContact O-N 3.31Å; K24-Y26 VanDerWaalsContact C-N 3.26Å; K24-Y26 PolarHBondContact O-N 3.44Å; Y26-Y44 CarbonylContact C-O 3.6Å; Y26-Y44 WeakPolarHBondContact CA-O 3.23Å; Y26-D45 HydrophobicContact CD1-CB 4.01Å; Y26-D45 HydrophobicContact CE1-CB 4.02Å; Y26-D45 WeakPolarHBondContact CE1-OD2 3.43Å; Y26-V52 HydrophobicContact CD1-CG2 3.96Å; Y26-V52 HydrophobicContact CE1-CG2 4.16Å; Y26-I54 HydrophobicContact CD1-CD1 3.93Å; Y26-I54 HydrophobicContact CD2-CD1 3.84Å; Y26-I54 HydrophobicContact CG-CD1 3.5Å; Y26-N90 WeakPolarHBondContact OH-CB 3.35Å; Y26-N90 PolarHBondContact OH-ND2 3.23Å; Y26-F92 AromaticContact CD2-CE1 3.99Å; Y26-F92 HydrophobicContact CD2-CE1 3.99Å; Y26-F92 HydrophobicContact CD2-CZ 4.26Å; Y26-F92 HydrophobicContact CE2-CD1 4.08Å; Y26-F92 AromaticContact CE2-CE1 3.46Å; Y26-F92 HydrophobicContact CE2-CE1 3.46Å; Y26-F92 VanDerWaalsContact CE2-CE1 3.46Å; Y26-F92 HydrophobicContact CE2-CZ 4.16Å; Y26-V107 HydrophobicContact CE1-CG1 3.9Å; Y26-V107 HydrophobicContact CE1-CG2 4.4Å; Y26-V107 HydrophobicContact CE2-CG2 3.96Å
27	Q	97.4	Very high	89.3	Confident	81 Å²	81	65 Å²	65	38%	0.379	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	163.8	-172.7	-61.8	172.3	5.5	0	0	110.2	L29 A43 Y44	Q27-L29 PolarHBondContact O-N 3.3Å; Q27-A43 WeakPolarHBondContact O-CA 3.4Å; Q27-Y44 PolarHBondContact N-O 3.44Å; Q27-Y44 PolarHBondContact O-N 2.82Å
28	N	96.8	Very high	89.1	Confident	129 Å²	129	56.6 Å²	56.6	69%	0.69	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	56.1	47.1	172.4	-53.1	-24.3	0	0	0	113.7	K30	N28-K30 PolarHBondContact O-N 3.34Å
29	L	97.3	Very high	89.1	Confident	27 Å²	27	56.6 Å²	56.6	14%	0.141	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	126.8	179.7	-87.5	68.2	0	0	0	110.7	Y11 F20 V22 Q27 C41 A42 A43	Y11-L29 WeakPolarHBondContact OH-CD1 3.3Å; F20-L29 HydrophobicContact CB-CD2 3.82Å; F20-L29 HydrophobicContact CD1-CD2 3.81Å; F20-L29 HydrophobicContact CG-CD2 4.09Å; V22-L29 HydrophobicContact CG1-CD2 4.08Å; V22-L29 HydrophobicContact CG2-CD1 4.04Å; V22-L29 HydrophobicContact CG2-CD2 4.03Å; Q27-L29 PolarHBondContact O-N 3.3Å; L29-C41 HydrophobicContact CB-CB 4.43Å; L29-C41 HydrophobicContact CD2-CB 4.48Å; L29-C41 HydrophobicContact CG-CB 4.28Å; L29-A42 CarbonylContact C-O 3.56Å; L29-A42 VanDerWaalsContact CA-O 3.32Å; L29-A42 WeakPolarHBondContact CA-O 3.42Å; L29-A43 HydrophobicContact CD1-CB 3.87Å; L29-A43 HydrophobicContact CG-CB 4.2Å
30	K	95.3	Very high	88.9	Confident	145 Å²	145	55.6 Å²	55.6	63%	0.63	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.2	124.9	175.3	-173	-179.3	179.5	-176.8	0	109.8	N28 I32 C41 A42	N28-K30 PolarHBondContact O-N 3.34Å; K30-I32 PolarHBondContact O-N 3.47Å; K30-C41 CarbonylContact O-C 3.57Å; K30-C41 WeakPolarHBondContact O-CA 3.5Å; K30-A42 PolarHBondContact N-O 3.31Å; K30-A42 PolarHBondContact O-N 2.5Å
31	P	92.5	Very high	88.9	Confident	78 Å²	78	55.6 Å²	55.6	51%	0.506	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	131.2	176.3	24	-31.1	0	0	0	110.7	V15	V15-P31 HydrophobicContact CG1-CB 3.68Å; V15-P31 HydrophobicContact CG1-CG 4.04Å
32	I	87.8	Confident	88.9	Confident	90 Å²	90	55 Å²	55	46%	0.462	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	-15.7	177.4	60.6	172.8	0	0	0	113	K30 V40 A42 A53 L110	K30-I32 PolarHBondContact O-N 3.47Å; I32-V40 HydrophobicContact CD1-CG1 3.9Å; I32-V40 HydrophobicContact CG1-CB 4.17Å; I32-V40 HydrophobicContact CG1-CG1 3.86Å; I32-V40 WeakPolarHBondContact CG1-O 3.49Å; I32-V40 PolarHBondContact N-O 2.84Å; I32-A42 HydrophobicContact CD1-CB 4.25Å; I32-A42 HydrophobicContact CG2-CB 3.73Å; I32-A53 HydrophobicContact CD1-CB 4.49Å; I32-L110 HydrophobicContact CD1-CD1 3.6Å
33	G	80.9	Confident	88.9	Confident	32 Å²	32	55.1 Å²	55.1	33%	0.33	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163	149.5	176.4	0	0	0	0	0	112.5	V40	G33-V40 PolarHBondContact N-O 2.98Å; G33-V40 PolarHBondContact O-N 2.9Å
34	S	76.4	Confident	89	Confident	106 Å²	106	57.1 Å²	57.1	74%	0.741	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.1	137.5	171.6	-178.7	0	0	0	0	108.5
35	G	69.2	Low	89.1	Confident	43 Å²	43	52 Å²	52	44%	0.443	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	178.8	178.9	0	0	0	0	0	112.2	Q37 G38	G35-Q37 PolarHBondContact O-N 2.93Å; G35-G38 PolarHBondContact N-O 3.38Å; G35-G38 PolarHBondContact O-N 3.11Å; G35-G38 VanDerWaalsContact O-N 3.14Å
36	A	66.9	Low	89.1	Confident	106 Å²	106	51.7 Å²	51.7	88%	0.876	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-20.9	-176.6	0	0	0	0	0	114.4
37	Q	69.6	Low	89	Confident	44 Å²	44	56.3 Å²	56.3	21%	0.206	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-13.5	-174.1	-58.3	167.9	30.5	0	0	113.4	G35 S58 D169	G35-Q37 PolarHBondContact O-N 2.93Å; Q37-S58 PolarHBondContact O-N 3.21Å; Q37-D169 PolarHBondContact NE2-OD2 3.16Å; Q37-D169 PolarHBondContact OE1-OD1 3.09Å; Q37-D169 PolarHBondContact OE1-OD2 3.17Å
38	G	80.8	Confident	88.8	Confident	4 Å²	4	56.2 Å²	56.2	4%	0.041	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.2	169.5	-168.2	0	0	0	0	0	114.3	G35 K56 S58	G35-G38 PolarHBondContact N-O 3.38Å; G35-G38 PolarHBondContact O-N 3.11Å; G35-G38 VanDerWaalsContact O-N 3.14Å; G38-K56 WeakPolarHBondContact CA-O 3.43Å; G38-S58 VanDerWaalsContact CA-OG 3.25Å; G38-S58 WeakPolarHBondContact CA-OG 3.36Å; G38-S58 PolarHBondContact N-OG 2.71Å
39	I	88.3	Confident	88.8	Confident	29 Å²	29	55.9 Å²	55.9	15%	0.149	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	138.2	170	-59	167.9	0	0	0	107.3	V15 F20 K55 K56	V15-I39 HydrophobicContact CG1-CG2 4.29Å; F20-I39 HydrophobicContact CE2-CB 3.86Å; F20-I39 HydrophobicContact CE2-CD1 4.47Å; F20-I39 HydrophobicContact CE2-CG2 3.69Å; F20-I39 HydrophobicContact CZ-CB 3.77Å; F20-I39 HydrophobicContact CZ-CG2 3.68Å; I39-K55 CarbonylContact O-C 3.57Å; I39-K55 WeakPolarHBondContact O-CA 3.28Å; I39-K56 PolarHBondContact N-O 3.08Å; I39-K56 PolarHBondContact O-N 2.99Å
40	V	91.6	Very high	88.7	Confident	31 Å²	31	58.5 Å²	58.5	19%	0.188	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	127.8	-179.9	-169.4	0	0	0	0	109.6	I32 G33 A53 I54 K55	I32-V40 HydrophobicContact CD1-CG1 3.9Å; I32-V40 HydrophobicContact CG1-CB 4.17Å; I32-V40 HydrophobicContact CG1-CG1 3.86Å; I32-V40 WeakPolarHBondContact CG1-O 3.49Å; I32-V40 PolarHBondContact N-O 2.84Å; G33-V40 PolarHBondContact N-O 2.98Å; G33-V40 PolarHBondContact O-N 2.9Å; V40-A53 HydrophobicContact CG1-CB 4.2Å; V40-I54 WeakPolarHBondContact CA-O 3.45Å; V40-K55 HydrophobicContact CG2-CB 4.07Å; V40-K55 HydrophobicContact CG2-CG 4.02Å
41	C	95.7	Very high	88.8	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	140.1	172.6	-69.8	0	0	0	0	110.8	F20 L29 K30 A53 I54	F20-C41 HydrophobicContact CE1-CB 4.2Å; L29-C41 HydrophobicContact CB-CB 4.43Å; L29-C41 HydrophobicContact CD2-CB 4.48Å; L29-C41 HydrophobicContact CG-CB 4.28Å; K30-C41 CarbonylContact O-C 3.57Å; K30-C41 WeakPolarHBondContact O-CA 3.5Å; C41-A53 CarbonylContact O-C 3.6Å; C41-A53 WeakPolarHBondContact O-CA 3.32Å; C41-I54 PolarHBondContact N-O 2.84Å; C41-I54 PolarHBondContact O-N 2.93Å
42	A	96.8	Very high	89	Confident	17 Å²	17	52.5 Å²	52.5	14%	0.14	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	143.9	155.5	0	0	0	0	0	108.7	L29 K30 I32 V52 L110	L29-A42 CarbonylContact C-O 3.56Å; L29-A42 VanDerWaalsContact CA-O 3.32Å; L29-A42 WeakPolarHBondContact CA-O 3.42Å; K30-A42 PolarHBondContact N-O 3.31Å; K30-A42 PolarHBondContact O-N 2.5Å; I32-A42 HydrophobicContact CD1-CB 4.25Å; I32-A42 HydrophobicContact CG2-CB 3.73Å; A42-V52 CarbonylContact C-O 3.59Å; A42-V52 WeakPolarHBondContact CA-O 3.21Å; A42-L110 HydrophobicContact CB-CD1 4.02Å; A42-L110 HydrophobicContact CB-CD2 3.96Å
43	A	98.1	Very high	89.4	Confident	3 Å²	3	48.7 Å²	48.7	3%	0.025	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	157.9	172.2	0	0	0	0	0	109.6	Q27 L29 N51 V52 I54	Q27-A43 WeakPolarHBondContact O-CA 3.4Å; L29-A43 HydrophobicContact CD1-CB 3.87Å; L29-A43 HydrophobicContact CG-CB 4.2Å; A43-N51 CarbonylContact O-C 3.56Å; A43-N51 WeakPolarHBondContact O-CA 3.48Å; A43-V52 HydrophobicContact CB-CG2 4.21Å; A43-V52 PolarHBondContact N-O 3.46Å; A43-V52 PolarHBondContact O-N 3.1Å; A43-I54 HydrophobicContact CB-CD1 3.66Å; A43-I54 HydrophobicContact CB-CG1 4.22Å
44	Y	98.2	Very high	90.1	Very high	72 Å²	72	47.1 Å²	47.1	28%	0.282	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	124.8	169.7	176.1	-104.3	0	0	0	109.4	Y26 Q27 A46 D49	Y26-Y44 CarbonylContact C-O 3.6Å; Y26-Y44 WeakPolarHBondContact CA-O 3.23Å; Q27-Y44 PolarHBondContact N-O 3.44Å; Q27-Y44 PolarHBondContact O-N 2.82Å; Y44-A46 HydrophobicContact CD1-CB 4.42Å; Y44-A46 HydrophobicContact CE1-CB 4.11Å; Y44-D49 PolarHBondContact OH-OD1 2.87Å
45	D	97.9	Very high	90.9	Very high	1 Å²	1	43 Å²	43	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	101.3	175.4	-174.8	-8.6	0	0	0	110	R25 Y26 V47 L48 D49 R50 V52	R25-D45 IonicContact CZ-OD1 3.68Å; R25-D45 IonicContact CZ-OD2 3.83Å; R25-D45 IonicContact NE-OD1 2.71Å; R25-D45 PolarHBondContact NE-OD1 3.29Å; R25-D45 IonicContact NE-OD2 2.9Å; R25-D45 PolarHBondContact NE-OD2 3.2Å; R25-D45 VanDerWaalsContact NH2-CG 3.3Å; R25-D45 IonicContact NH2-OD1 2.77Å; R25-D45 PolarHBondContact NH2-OD1 3.06Å; R25-D45 VanDerWaalsContact NH2-OD1 3.08Å; R25-D45 IonicContact NH2-OD2 3.99Å; R25-D45 PolarHBondContact NH2-OD2 3.08Å; Y26-D45 HydrophobicContact CD1-CB 4.01Å; Y26-D45 HydrophobicContact CE1-CB 4.02Å; Y26-D45 WeakPolarHBondContact CE1-OD2 3.43Å; D45-V47 PolarHBondContact O-N 3.08Å; D45-V47 VanDerWaalsContact O-N 3.11Å; D45-V47 PolarHBondContact OD1-N 3.33Å; D45-V47 VanDerWaalsContact OD1-N 3.09Å; D45-L48 HydrophobicContact CB-CB 4.34Å; D45-L48 PolarHBondContact O-N 3.45Å; D45-L48 WeakPolarHBondContact OD2-CD1 3.3Å; D45-L48 WeakPolarHBondContact OD2-CG 2.99Å; D45-D49 WeakPolarHBondContact O-CA 3.41Å; D45-D49 PolarHBondContact O-N 2.96Å; D45-R50 WeakPolarHBondContact CB-O 3.08Å; D45-R50 PolarHBondContact N-O 2.57Å; D45-R50 PolarHBondContact O-N 2.87Å; D45-V52 HydrophobicContact CB-CG1 3.98Å; D45-V52 HydrophobicContact CB-CG2 4.18Å
46	A	96.8	Very high	92.1	Very high	46 Å²	46	42.1 Å²	42.1	38%	0.38	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-13.6	-176.5	0	0	0	0	0	114.2	R25 Y44	R25-A46 PolarHBondContact O-N 3.2Å; Y44-A46 HydrophobicContact CD1-CB 4.42Å; Y44-A46 HydrophobicContact CE1-CB 4.11Å
47	V	94.9	Very high	93.2	Very high	99 Å²	99	37.4 Å²	37.4	60%	0.6	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-35.6	176.7	172.5	0	0	0	0	111.5	R25 D45	R25-V47 HydrophobicContact CB-CG2 3.89Å; D45-V47 PolarHBondContact O-N 3.08Å; D45-V47 VanDerWaalsContact O-N 3.11Å; D45-V47 PolarHBondContact OD1-N 3.33Å; D45-V47 VanDerWaalsContact OD1-N 3.09Å
48	L	93.3	Very high	93.8	Very high	79 Å²	79	37.6 Å²	37.6	41%	0.414	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-3.6	178.6	-65.6	-179.8	0	0	0	113.3	D45 R50	D45-L48 HydrophobicContact CB-CB 4.34Å; D45-L48 PolarHBondContact O-N 3.45Å; D45-L48 WeakPolarHBondContact OD2-CD1 3.3Å; D45-L48 WeakPolarHBondContact OD2-CG 2.99Å; L48-R50 VanDerWaalsContact C-N 3.26Å; L48-R50 HydrophobicContact CB-CG 3.84Å; L48-R50 PolarHBondContact O-N 2.84Å
49	D	95.8	Very high	93.9	Very high	122 Å²	122	45.9 Å²	45.9	65%	0.652	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.8	47.5	-175.3	-168.8	20	0	0	0	112.5	Y44 D45	Y44-D49 PolarHBondContact OH-OD1 2.87Å; D45-D49 WeakPolarHBondContact O-CA 3.41Å; D45-D49 PolarHBondContact O-N 2.96Å
50	R	95.5	Very high	93.9	Very high	82 Å²	82	44.8 Å²	44.8	31%	0.309	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	157.1	179.5	69.3	-178.9	-178.6	174.7	-5.9	112.7	D45 L48 V52	D45-R50 WeakPolarHBondContact CB-O 3.08Å; D45-R50 PolarHBondContact N-O 2.57Å; D45-R50 PolarHBondContact O-N 2.87Å; L48-R50 VanDerWaalsContact C-N 3.26Å; L48-R50 HydrophobicContact CB-CG 3.84Å; L48-R50 PolarHBondContact O-N 2.84Å; R50-V52 HydrophobicContact CG-CG1 4.33Å
51	N	97.3	Very high	94	Very high	97 Å²	97	44.8 Å²	44.8	52%	0.519	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	142.8	170.7	-64.3	-42.3	0	0	0	111.4	A43 L110	A43-N51 CarbonylContact O-C 3.56Å; A43-N51 WeakPolarHBondContact O-CA 3.48Å; N51-L110 HydrophobicContact CB-CB 4.22Å; N51-L110 HydrophobicContact CB-CD2 3.57Å
52	V	97.4	Very high	93.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	157.1	-178.9	-63.1	0	0	0	0	110.6	Y26 A42 A43 D45 R50 I54 L89 V107 M108	Y26-V52 HydrophobicContact CD1-CG2 3.96Å; Y26-V52 HydrophobicContact CE1-CG2 4.16Å; A42-V52 CarbonylContact C-O 3.59Å; A42-V52 WeakPolarHBondContact CA-O 3.21Å; A43-V52 HydrophobicContact CB-CG2 4.21Å; A43-V52 PolarHBondContact N-O 3.46Å; A43-V52 PolarHBondContact O-N 3.1Å; D45-V52 HydrophobicContact CB-CG1 3.98Å; D45-V52 HydrophobicContact CB-CG2 4.18Å; R50-V52 HydrophobicContact CG-CG1 4.33Å; V52-I54 HydrophobicContact CG2-CD1 4.45Å; V52-I54 HydrophobicContact CG2-CG1 4.17Å; V52-L89 HydrophobicContact CG1-CD1 3.79Å; V52-V107 HydrophobicContact CB-CG1 3.85Å; V52-V107 HydrophobicContact CG1-CG1 4.23Å; V52-V107 HydrophobicContact CG2-CG1 3.88Å; V52-M108 WeakPolarHBondContact CA-O 3.46Å; V52-M108 WeakPolarHBondContact CB-O 3.33Å
53	A	96.1	Very high	93.2	Very high	9 Å²	9	51.2 Å²	51.2	7%	0.074	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	129	169	0	0	0	0	0	109.5	I32 V40 C41 V107 M108 L110	I32-A53 HydrophobicContact CD1-CB 4.49Å; V40-A53 HydrophobicContact CG1-CB 4.2Å; C41-A53 CarbonylContact O-C 3.6Å; C41-A53 WeakPolarHBondContact O-CA 3.32Å; A53-V107 CarbonylContact O-C 3.6Å; A53-V107 WeakPolarHBondContact O-CA 3.23Å; A53-M108 PolarHBondContact N-O 2.95Å; A53-M108 PolarHBondContact O-N 3.1Å; A53-L110 HydrophobicContact CB-CD1 4Å
54	I	96.1	Very high	92.7	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	110.3	178.6	-53.2	-177.7	0	0	0	108.6	Y26 V40 C41 A43 V52 Y105 L106 V107	Y26-I54 HydrophobicContact CD1-CD1 3.93Å; Y26-I54 HydrophobicContact CD2-CD1 3.84Å; Y26-I54 HydrophobicContact CG-CD1 3.5Å; V40-I54 WeakPolarHBondContact CA-O 3.45Å; C41-I54 PolarHBondContact N-O 2.84Å; C41-I54 PolarHBondContact O-N 2.93Å; A43-I54 HydrophobicContact CB-CD1 3.66Å; A43-I54 HydrophobicContact CB-CG1 4.22Å; V52-I54 HydrophobicContact CG2-CD1 4.45Å; V52-I54 HydrophobicContact CG2-CG1 4.17Å; I54-Y105 HydrophobicContact CG2-CD1 3.94Å; I54-L106 CarbonylContact C-O 3.57Å; I54-L106 WeakPolarHBondContact CA-O 3.43Å; I54-V107 HydrophobicContact CG1-CG1 4.36Å; I54-V107 HydrophobicContact CG1-CG2 4.22Å; I54-V107 HydrophobicContact CG2-CG2 4.43Å
55	K	93.6	Very high	92	Very high	20 Å²	20	57 Å²	57	9%	0.087	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	116.8	175	-179.3	179.5	-179	-174.5	0	109.6	I39 V40 L57 E73 Y105 L106 M108	I39-K55 CarbonylContact O-C 3.57Å; I39-K55 WeakPolarHBondContact O-CA 3.28Å; V40-K55 HydrophobicContact CG2-CB 4.07Å; V40-K55 HydrophobicContact CG2-CG 4.02Å; K55-L57 HydrophobicContact CD-CD2 4.23Å; K55-L57 HydrophobicContact CG-CD2 4.32Å; K55-E73 IonicContact NZ-OE1 3.71Å; K55-E73 PolarHBondContact NZ-OE1 3.22Å; K55-E73 IonicContact NZ-OE2 2.71Å; K55-Y105 WeakPolarHBondContact O-CA 3.4Å; K55-L106 HydrophobicContact CB-CB 4.41Å; K55-L106 PolarHBondContact N-O 2.88Å; K55-L106 PolarHBondContact O-N 2.9Å; K55-M108 HydrophobicContact CB-CE 3.71Å
56	K	93.8	Very high	91.4	Very high	23 Å²	23	60.3 Å²	60.3	10%	0.1	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	119.8	167.5	-176.5	-176.3	-177.8	-178.5	0	108.8	T19 F20 G38 I39 S58 D103 Y105	T19-K56 PolarHBondContact O-NZ 3.06Å; F20-K56 HydrophobicContact CD2-CD 4.39Å; F20-K56 HydrophobicContact CE1-CB 3.81Å; F20-K56 HydrophobicContact CE2-CB 4.24Å; F20-K56 HydrophobicContact CE2-CD 4.26Å; F20-K56 HydrophobicContact CZ-CB 3.66Å; F20-K56 HydrophobicContact CZ-CD 4.49Å; G38-K56 WeakPolarHBondContact CA-O 3.43Å; I39-K56 PolarHBondContact N-O 3.08Å; I39-K56 PolarHBondContact O-N 2.99Å; K56-S58 PolarHBondContact O-N 2.97Å; K56-D103 WeakPolarHBondContact CE-OD1 3.39Å; K56-D103 IonicContact NZ-OD1 2.57Å; K56-D103 PolarHBondContact NZ-OD1 3.12Å; K56-Y105 HydrophobicContact CB-CD1 3.88Å; K56-Y105 HydrophobicContact CB-CE1 3.68Å; K56-Y105 HydrophobicContact CD-CE1 3.8Å; K56-Y105 WeakPolarHBondContact CD-OH 3.03Å; K56-Y105 WeakPolarHBondContact CE-OH 3.23Å; K56-Y105 HydrophobicContact CG-CD1 4.15Å; K56-Y105 HydrophobicContact CG-CE1 3.65Å; K56-Y105 HydrophobicContact CG-CE2 4.46Å
57	L	90.1	Very high	91.1	Very high	8 Å²	8	58.1 Å²	58.1	4%	0.042	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	128.5	177.4	-62.3	-171.1	0	0	0	110.8	K55 R59 P60 A70 V104 L106	K55-L57 HydrophobicContact CD-CD2 4.23Å; K55-L57 HydrophobicContact CG-CD2 4.32Å; L57-R59 PolarHBondContact O-N 3.2Å; L57-P60 HydrophobicContact CB-CB 4.41Å; L57-P60 HydrophobicContact CB-CG 4.34Å; L57-A70 HydrophobicContact CD1-CB 3.83Å; L57-V104 HydrophobicContact CB-CB 4.43Å; L57-V104 HydrophobicContact CD1-CB 3.99Å; L57-V104 HydrophobicContact CD1-CG1 4.09Å; L57-V104 HydrophobicContact CG-CB 4.23Å; L57-V104 HydrophobicContact CG-CG1 4.49Å; L57-V104 PolarHBondContact N-O 3.49Å; L57-L106 HydrophobicContact CD2-CD1 3.97Å; L57-L106 HydrophobicContact CG-CD1 4.41Å
58	S	81.4	Confident	90.7	Very high	48 Å²	48	54.7 Å²	54.7	34%	0.336	27%	0.268	S	S	.	.	S	Bend	trans	-82.9	110.3	179.5	-69.6	0	0	0	0	111.3	Q37 G38 K56	Q37-S58 PolarHBondContact O-N 3.21Å; G38-S58 VanDerWaalsContact CA-OG 3.25Å; G38-S58 WeakPolarHBondContact CA-OG 3.36Å; G38-S58 PolarHBondContact N-OG 2.71Å; K56-S58 PolarHBondContact O-N 2.97Å
59	R	83.5	Confident	90.2	Very high	178 Å²	178	53.7 Å²	53.7	67%	0.672	26%	0.259	S	S	*	.			trans	47.5	56.9	174	-58.6	-179.9	-72	-172.5	-5.3	113.2	L57 F61 Q62	L57-R59 PolarHBondContact O-N 3.2Å; R59-F61 PolarHBondContact O-N 2.64Å; R59-F61 VanDerWaalsContact O-N 3.1Å; R59-Q62 HydrophobicContact CB-CB 4.13Å; R59-Q62 WeakPolarHBondContact O-CB 3.49Å; R59-Q62 PolarHBondContact O-N 2.57Å; R59-Q62 VanDerWaalsContact O-N 3.14Å
60	P	88.8	Confident	89.8	Confident	5 Å²	5	48.1 Å²	48.1	3%	0.032	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-25	-176.5	25	-34	0	0	0	112.9	L57 H66 A67 A70	L57-P60 HydrophobicContact CB-CB 4.41Å; L57-P60 HydrophobicContact CB-CG 4.34Å; P60-H66 CarbonylContact O-C 3.55Å; P60-H66 WeakPolarHBondContact O-CB 3.31Å; P60-A67 WeakPolarHBondContact O-CA 3.42Å; P60-A67 PolarHBondContact O-N 2.85Å; P60-A70 HydrophobicContact CB-CB 3.7Å
61	F	92.2	Very high	89.5	Confident	31 Å²	31	45.5 Å²	45.5	14%	0.136	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	15.6	-178.5	-44.2	-60.1	0	0	0	114.2	R59 N63 F101 I349 K353 I356	R59-F61 PolarHBondContact O-N 2.64Å; R59-F61 VanDerWaalsContact O-N 3.1Å; F61-N63 VanDerWaalsContact C-N 3.3Å; F61-N63 PolarHBondContact O-N 3.02Å; F61-F101 HydrophobicContact CE1-CE1 4.07Å; F61-F101 AromaticContact CE2-CD1 3.94Å; F61-F101 HydrophobicContact CE2-CD1 3.94Å; F61-F101 AromaticContact CE2-CE1 3.79Å; F61-F101 HydrophobicContact CE2-CE1 3.79Å; F61-F101 HydrophobicContact CE2-CG 4.43Å; F61-F101 HydrophobicContact CE2-CZ 4.13Å; F61-F101 AromaticContact CZ-CD1 3.78Å; F61-F101 HydrophobicContact CZ-CD1 3.78Å; F61-F101 AromaticContact CZ-CE1 3.2Å; F61-F101 HydrophobicContact CZ-CE1 3.2Å; F61-F101 HydrophobicContact CZ-CE2 4.43Å; F61-F101 AromaticContact CZ-CZ 3.6Å; F61-F101 HydrophobicContact CZ-CZ 3.6Å; F61-I349 HydrophobicContact CB-CG2 3.94Å; F61-I349 VanDerWaalsContact O-CG2 3.26Å; F61-I349 WeakPolarHBondContact O-CG2 3.29Å; F61-K353 HydrophobicContact CD1-CB 3.79Å; F61-K353 HydrophobicContact CD1-CG 4.04Å; F61-K353 HydrophobicContact CD2-CD 4.26Å; F61-K353 HydrophobicContact CD2-CG 4.31Å; F61-K353 HydrophobicContact CE1-CB 3.92Å; F61-K353 HydrophobicContact CE1-CG 3.96Å; F61-K353 HydrophobicContact CE2-CG 4.23Å; F61-K353 HydrophobicContact CG-CB 4.32Å; F61-K353 HydrophobicContact CG-CD 4.3Å; F61-K353 HydrophobicContact CG-CG 4.24Å; F61-K353 HydrophobicContact CZ-CG 4.1Å; F61-I356 HydrophobicContact CD1-CD1 4.43Å; F61-I356 HydrophobicContact CE1-CB 4.31Å; F61-I356 HydrophobicContact CE1-CD1 3.61Å; F61-I356 HydrophobicContact CZ-CD1 4.43Å; F61-I356 HydrophobicContact CZ-CG2 4.4Å
62	Q	88.6	Confident	88.9	Confident	101 Å²	101	41 Å²	41	47%	0.472	20%	0.196	S	C	.	.	S	Bend	trans	-63.8	-35.8	-178.5	-177.9	-179.8	-16.9	0	0	112.9	R59	R59-Q62 HydrophobicContact CB-CB 4.13Å; R59-Q62 WeakPolarHBondContact O-CB 3.49Å; R59-Q62 PolarHBondContact O-N 2.57Å; R59-Q62 VanDerWaalsContact O-N 3.14Å
63	N	87.8	Confident	88.3	Confident	52 Å²	52	41.3 Å²	41.3	28%	0.278	20%	0.198	S	C	.	.	S	Bend	trans	-156.9	167.5	177.8	60.8	59.6	0	0	0	109.8	F61 T65 H66 A67	F61-N63 VanDerWaalsContact C-N 3.3Å; F61-N63 PolarHBondContact O-N 3.02Å; N63-T65 PolarHBondContact O-N 3.18Å; N63-T65 WeakPolarHBondContact OD1-CA 3.29Å; N63-T65 WeakPolarHBondContact OD1-CB 3.22Å; N63-T65 PolarHBondContact OD1-N 2.71Å; N63-H66 PolarHBondContact O-N 3.29Å; N63-H66 PolarHBondContact OD1-N 2.78Å; N63-A67 PolarHBondContact O-N 2.82Å
64	Q	87.9	Confident	87.9	Confident	95 Å²	95	41.1 Å²	41.1	44%	0.444	20%	0.195	S	C	.	.	H	α-helix	trans	-57.7	-35.4	-178.7	-67.3	176.4	6.1	0	0	113	A67 K68 I349	Q64-A67 PolarHBondContact O-N 2.95Å; Q64-K68 VanDerWaalsContact O-CB 3.23Å; Q64-K68 WeakPolarHBondContact O-CB 2.86Å; Q64-K68 PolarHBondContact O-N 3.28Å; Q64-I349 HydrophobicContact CG-CG1 3.91Å
65	T	83.9	Confident	87.4	Confident	102 Å²	102	42 Å²	42	63%	0.626	20%	0.2	S	C	*	.	H	α-helix	trans	-67.2	-43.7	179.2	-60.5	0	0	0	0	111.9	N63 A67 R69	N63-T65 PolarHBondContact O-N 3.18Å; N63-T65 WeakPolarHBondContact OD1-CA 3.29Å; N63-T65 WeakPolarHBondContact OD1-CB 3.22Å; N63-T65 PolarHBondContact OD1-N 2.71Å; T65-A67 VanDerWaalsContact C-N 3.35Å; T65-R69 VanDerWaalsContact O-CB 3.22Å; T65-R69 WeakPolarHBondContact O-CB 3.41Å; T65-R69 PolarHBondContact O-N 3.09Å
66	H	84.9	Confident	86.9	Confident	69 Å²	69	41 Å²	41	32%	0.319	20%	0.196	S	C	.	.	H	α-helix	trans	-64.6	-41.3	175	-70.5	-177.9	0	0	0	111.2	P60 N63 R69 A70	P60-H66 CarbonylContact O-C 3.55Å; P60-H66 WeakPolarHBondContact O-CB 3.31Å; N63-H66 PolarHBondContact O-N 3.29Å; N63-H66 PolarHBondContact OD1-N 2.78Å; H66-R69 PolarHBondContact O-N 3.27Å; H66-A70 WeakPolarHBondContact O-CB 3.32Å; H66-A70 PolarHBondContact O-N 3.01Å
67	A	89.7	Confident	86.5	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-68.5	-48.6	-177	0	0	0	0	0	111.3	P60 N63 Q64 T65 R69 A70 Y71 W352	P60-A67 WeakPolarHBondContact O-CA 3.42Å; P60-A67 PolarHBondContact O-N 2.85Å; N63-A67 PolarHBondContact O-N 2.82Å; Q64-A67 PolarHBondContact O-N 2.95Å; T65-A67 VanDerWaalsContact C-N 3.35Å; A67-R69 VanDerWaalsContact C-N 3.28Å; A67-R69 PolarHBondContact O-N 3.14Å; A67-A70 PolarHBondContact O-N 2.81Å; A67-Y71 PolarHBondContact O-N 3.4Å; A67-W352 HydrophobicContact CB-CB 3.57Å; A67-W352 HydrophobicContact CB-CG 3.81Å
68	K	86.6	Confident	86.1	Confident	28 Å²	28	43.3 Å²	43.3	12%	0.122	21%	0.206	C	C	.	.	H	α-helix	trans	-58	-40.2	173.6	-173.5	164.7	-177.1	160	0	111.9	Q64 R72 D343 R345 E346 W352	Q64-K68 VanDerWaalsContact O-CB 3.23Å; Q64-K68 WeakPolarHBondContact O-CB 2.86Å; Q64-K68 PolarHBondContact O-N 3.28Å; K68-R72 WeakPolarHBondContact O-CB 3.09Å; K68-R72 PolarHBondContact O-N 3.48Å; K68-D343 VanDerWaalsContact CE-O 3.28Å; K68-D343 WeakPolarHBondContact CE-O 3.34Å; K68-D343 PolarHBondContact NZ-O 3.29Å; K68-R345 PolarHBondContact NZ-O 2.88Å; K68-E346 IonicContact NZ-OE1 2.81Å; K68-E346 PolarHBondContact NZ-OE1 3.42Å; K68-W352 HydrophobicContact CB-CZ2 3.8Å; K68-W352 HydrophobicContact CD-CZ2 3.79Å; K68-W352 HydrophobicContact CG-CH2 4.11Å; K68-W352 HydrophobicContact CG-CZ2 3.6Å
69	R	83.6	Confident	86.1	Confident	57 Å²	57	43.2 Å²	43.2	22%	0.215	21%	0.205	C	C	.	.	H	α-helix	trans	-63.5	-49.3	175.5	175.1	172.6	-174.5	154.5	19.8	112.2	T65 H66 A67 Y71 R72 E73 D169 G171	T65-R69 VanDerWaalsContact O-CB 3.22Å; T65-R69 WeakPolarHBondContact O-CB 3.41Å; T65-R69 PolarHBondContact O-N 3.09Å; H66-R69 PolarHBondContact O-N 3.27Å; A67-R69 VanDerWaalsContact C-N 3.28Å; A67-R69 PolarHBondContact O-N 3.14Å; R69-Y71 VanDerWaalsContact C-N 3.35Å; R69-R72 PolarHBondContact O-N 3.5Å; R69-E73 WeakPolarHBondContact O-CB 3.17Å; R69-E73 PolarHBondContact O-N 2.96Å; R69-D169 IonicContact CZ-OD1 2.67Å; R69-D169 IonicContact NH2-OD1 2.91Å; R69-D169 PolarHBondContact NH2-OD1 3.4Å; R69-D169 IonicContact NH2-OD2 3.62Å; R69-D169 PolarHBondContact NH2-OD2 3.41Å; R69-G171 WeakPolarHBondContact CD-O 3.45Å; R69-G171 WeakPolarHBondContact CG-O 3.44Å; R69-G171 PolarHBondContact NE-O 2.81Å
70	A	87.6	Confident	86.1	Confident	6 Å²	6	35 Å²	35	5%	0.05	17%	0.174	C	C	.	.	H	α-helix	trans	-62	-43.6	-179.6	0	0	0	0	0	111.5	L57 P60 H66 A67 E73 L74 I356	L57-A70 HydrophobicContact CD1-CB 3.83Å; P60-A70 HydrophobicContact CB-CB 3.7Å; H66-A70 WeakPolarHBondContact O-CB 3.32Å; H66-A70 PolarHBondContact O-N 3.01Å; A67-A70 PolarHBondContact O-N 2.81Å; A70-E73 PolarHBondContact O-N 3.08Å; A70-L74 WeakPolarHBondContact O-CB 3.31Å; A70-L74 PolarHBondContact O-N 3.03Å; A70-I356 HydrophobicContact CB-CD1 4.03Å
71	Y	88.6	Confident	86	Confident	26 Å²	26	39.7 Å²	39.7	10%	0.102	20%	0.199	C	C	.	.	H	α-helix	trans	-61.8	-47.2	175.9	-176.3	-111.3	0	0	0	111.7	A67 R69 E73 L74 V75 L342 W352 L355 I356 E359	A67-Y71 PolarHBondContact O-N 3.4Å; R69-Y71 VanDerWaalsContact C-N 3.35Å; Y71-E73 PolarHBondContact O-N 3.2Å; Y71-L74 PolarHBondContact O-N 3.21Å; Y71-V75 HydrophobicContact CD1-CG2 4.24Å; Y71-V75 HydrophobicContact CD2-CG2 4.3Å; Y71-V75 HydrophobicContact CE1-CG2 3.87Å; Y71-V75 HydrophobicContact CE2-CG2 3.91Å; Y71-V75 HydrophobicContact CG-CG2 4.46Å; Y71-V75 WeakPolarHBondContact O-CG2 3.26Å; Y71-V75 PolarHBondContact O-N 3.25Å; Y71-L342 HydrophobicContact CD1-CD1 4.45Å; Y71-L342 HydrophobicContact CD1-CD2 3.83Å; Y71-L342 HydrophobicContact CD1-CG 4.32Å; Y71-L342 HydrophobicContact CE1-CD1 3.63Å; Y71-L342 HydrophobicContact CE1-CD2 3.83Å; Y71-L342 HydrophobicContact CE1-CG 3.82Å; Y71-W352 AromaticContact CD1-CE3 3.87Å; Y71-W352 HydrophobicContact CD1-CE3 3.87Å; Y71-W352 HydrophobicContact CD1-CH2 4.15Å; Y71-W352 AromaticContact CD1-CZ3 3.25Å; Y71-W352 HydrophobicContact CD1-CZ3 3.25Å; Y71-W352 AromaticContact CE1-CZ3 3.76Å; Y71-W352 HydrophobicContact CE1-CZ3 3.76Å; Y71-W352 AromaticContact CG-CE3 3.91Å; Y71-W352 HydrophobicContact CG-CE3 3.91Å; Y71-W352 AromaticContact CG-CZ3 3.79Å; Y71-W352 HydrophobicContact CG-CZ3 3.79Å; Y71-L355 HydrophobicContact CD2-CB 4.05Å; Y71-L355 HydrophobicContact CE2-CB 3.74Å; Y71-I356 HydrophobicContact CD2-CG1 3.63Å; Y71-I356 HydrophobicContact CG-CG1 4.08Å; Y71-E359 HydrophobicContact CE2-CG 3.73Å
72	R	84.9	Confident	86	Confident	4 Å²	4	38.7 Å²	38.7	2%	0.015	20%	0.195	C	C	.	.	H	α-helix	trans	-63	-44.4	178.3	-170.9	179	73	-125.1	-8.4	112.2	K68 R69 L74 V75 L76 F170 G171 A173 R174 Y338 L342 D343	K68-R72 WeakPolarHBondContact O-CB 3.09Å; K68-R72 PolarHBondContact O-N 3.48Å; R69-R72 PolarHBondContact O-N 3.5Å; R72-L74 VanDerWaalsContact C-N 3.26Å; R72-L74 PolarHBondContact O-N 3.15Å; R72-V75 PolarHBondContact O-N 2.68Å; R72-L76 HydrophobicContact CG-CD1 3.59Å; R72-L76 HydrophobicContact CG-CG 3.8Å; R72-L76 VanDerWaalsContact O-CB 3.31Å; R72-L76 WeakPolarHBondContact O-CB 3.42Å; R72-L76 VanDerWaalsContact O-CG 3.3Å; R72-L76 WeakPolarHBondContact O-CG 3.34Å; R72-L76 PolarHBondContact O-N 2.85Å; R72-F170 PolarHBondContact NE-O 3.13Å; R72-F170 VanDerWaalsContact NE-O 3.15Å; R72-F170 PolarHBondContact NH2-O 3.47Å; R72-G171 PolarHBondContact NH2-O 3.48Å; R72-A173 PolarHBondContact NE-O 3.46Å; R72-A173 PolarHBondContact NH1-O 3.38Å; R72-A173 PolarHBondContact NH2-O 3.16Å; R72-R174 VanDerWaalsContact CZ-NH1 3.34Å; R72-R174 VanDerWaalsContact NH1-CZ 3.35Å; R72-Y338 WeakPolarHBondContact CD-OH 3.45Å; R72-Y338 HydrophobicContact CG-CE2 4.05Å; R72-Y338 VanDerWaalsContact CG-OH 3.24Å; R72-Y338 WeakPolarHBondContact CG-OH 3.37Å; R72-L342 HydrophobicContact CB-CD2 4.45Å; R72-L342 HydrophobicContact CG-CD2 4.49Å; R72-D343 IonicContact NH1-OD1 3.49Å
73	E	85.4	Confident	86.3	Confident	6 Å²	6	38 Å²	38	3%	0.028	19%	0.19	C	C	.	.	H	α-helix	trans	-55.6	-45.4	177.3	-173.8	172.9	177.9	0	0	110.6	K55 R69 A70 Y71 M77 L106	K55-E73 IonicContact NZ-OE1 3.71Å; K55-E73 PolarHBondContact NZ-OE1 3.22Å; K55-E73 IonicContact NZ-OE2 2.71Å; R69-E73 WeakPolarHBondContact O-CB 3.17Å; R69-E73 PolarHBondContact O-N 2.96Å; A70-E73 PolarHBondContact O-N 3.08Å; Y71-E73 PolarHBondContact O-N 3.2Å; E73-M77 HydrophobicContact CG-SD 4.06Å; E73-M77 WeakPolarHBondContact O-CB 3.42Å; E73-M77 VanDerWaalsContact O-CG 3.24Å; E73-M77 WeakPolarHBondContact O-CG 3.32Å; E73-M77 PolarHBondContact O-N 3.49Å; E73-L106 HydrophobicContact CG-CD1 4.42Å
74	L	87.7	Confident	86.8	Confident	4 Å²	4	35.6 Å²	35.6	2%	0.021	18%	0.177	C	C	.	.	H	α-helix	trans	-62.2	-49	176.8	-179.1	58.9	0	0	0	112.8	A70 Y71 R72 K78 L88 V91 L106 I356 E359 V360	A70-L74 WeakPolarHBondContact O-CB 3.31Å; A70-L74 PolarHBondContact O-N 3.03Å; Y71-L74 PolarHBondContact O-N 3.21Å; R72-L74 VanDerWaalsContact C-N 3.26Å; R72-L74 PolarHBondContact O-N 3.15Å; L74-K78 HydrophobicContact CD1-CD 4.21Å; L74-K78 HydrophobicContact CG-CD 4.39Å; L74-K78 WeakPolarHBondContact O-CG 3.13Å; L74-K78 PolarHBondContact O-N 3.41Å; L74-L88 HydrophobicContact CD1-CD2 4.02Å; L74-V91 HydrophobicContact CD1-CB 4.19Å; L74-V91 HydrophobicContact CD1-CG1 4.12Å; L74-V91 HydrophobicContact CD1-CG2 3.87Å; L74-L106 HydrophobicContact CD1-CD2 3.98Å; L74-I356 HydrophobicContact CD2-CG2 4.31Å; L74-E359 HydrophobicContact CD2-CB 3.6Å; L74-E359 HydrophobicContact CG-CB 4.39Å; L74-V360 HydrophobicContact CD2-CG2 4.06Å
75	V	85.1	Confident	87.1	Confident	18 Å²	18	31.1 Å²	31.1	11%	0.109	16%	0.157	C	C	.	.	H	α-helix	trans	-63.3	-46.4	-179.4	171.3	0	0	0	0	110.9	Y71 R72 M77 K78 C79 Y338 L342	Y71-V75 HydrophobicContact CD1-CG2 4.24Å; Y71-V75 HydrophobicContact CD2-CG2 4.3Å; Y71-V75 HydrophobicContact CE1-CG2 3.87Å; Y71-V75 HydrophobicContact CE2-CG2 3.91Å; Y71-V75 HydrophobicContact CG-CG2 4.46Å; Y71-V75 WeakPolarHBondContact O-CG2 3.26Å; Y71-V75 PolarHBondContact O-N 3.25Å; R72-V75 PolarHBondContact O-N 2.68Å; V75-M77 PolarHBondContact O-N 2.94Å; V75-K78 PolarHBondContact O-N 2.97Å; V75-K78 VanDerWaalsContact O-N 3.15Å; V75-C79 PolarHBondContact O-N 3.19Å; V75-C79 PolarHBondContact O-SG 2.66Å; V75-Y338 HydrophobicContact CG1-CD2 4.45Å; V75-Y338 HydrophobicContact CG1-CE2 4.34Å; V75-L342 HydrophobicContact CG1-CD1 4.13Å; V75-L342 HydrophobicContact CG2-CD1 4.35Å
76	L	82.4	Confident	87.5	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-63.4	-44.3	-179.1	-72.5	-176.7	0	0	0	112.2	R72 K78 C79 V80 I147 F170 A173 Y338	R72-L76 HydrophobicContact CG-CD1 3.59Å; R72-L76 HydrophobicContact CG-CG 3.8Å; R72-L76 VanDerWaalsContact O-CB 3.31Å; R72-L76 WeakPolarHBondContact O-CB 3.42Å; R72-L76 VanDerWaalsContact O-CG 3.3Å; R72-L76 WeakPolarHBondContact O-CG 3.34Å; R72-L76 PolarHBondContact O-N 2.85Å; L76-K78 PolarHBondContact O-N 3.12Å; L76-C79 PolarHBondContact O-N 3.31Å; L76-V80 WeakPolarHBondContact O-CB 3.42Å; L76-V80 VanDerWaalsContact O-CG2 3.23Å; L76-V80 WeakPolarHBondContact O-CG2 3.41Å; L76-V80 PolarHBondContact O-N 3.45Å; L76-I147 HydrophobicContact CD1-CG2 4.35Å; L76-I147 HydrophobicContact CD2-CD1 3.39Å; L76-I147 HydrophobicContact CD2-CG1 3.97Å; L76-F170 HydrophobicContact CB-CB 4.08Å; L76-F170 HydrophobicContact CB-CD2 4.18Å; L76-F170 HydrophobicContact CB-CG 4.24Å; L76-F170 HydrophobicContact CD1-CB 3.43Å; L76-F170 VanDerWaalsContact CD1-CB 3.43Å; L76-F170 HydrophobicContact CD1-CG 4.18Å; L76-F170 HydrophobicContact CG-CB 4.4Å; L76-A173 HydrophobicContact CD1-CB 4.1Å; L76-Y338 HydrophobicContact CD2-CD2 3.24Å; L76-Y338 HydrophobicContact CD2-CE2 3.52Å; L76-Y338 HydrophobicContact CD2-CG 3.91Å; L76-Y338 HydrophobicContact CG-CD2 4.19Å; L76-Y338 HydrophobicContact CG-CE2 3.98Å
77	M	86.1	Confident	87.7	Confident	8 Å²	8	23.8 Å²	23.8	4%	0.039	12%	0.117	C	C	.	.	H	α-helix	trans	-65.9	-21.7	177.4	-71.3	179.8	71.8	0	0	113.6	E73 V75 I86 L88 L106 M108 F170	E73-M77 HydrophobicContact CG-SD 4.06Å; E73-M77 WeakPolarHBondContact O-CB 3.42Å; E73-M77 VanDerWaalsContact O-CG 3.24Å; E73-M77 WeakPolarHBondContact O-CG 3.32Å; E73-M77 PolarHBondContact O-N 3.49Å; V75-M77 PolarHBondContact O-N 2.94Å; M77-I86 HydrophobicContact CE-CG2 4.32Å; M77-L88 HydrophobicContact CB-CB 4.1Å; M77-L88 HydrophobicContact CE-CB 4.12Å; M77-L88 HydrophobicContact CE-CD1 3.82Å; M77-L106 HydrophobicContact SD-CD1 4.14Å; M77-M108 HydrophobicContact CE-CG 3.5Å; M77-M108 HydrophobicContact CE-SD 3.47Å; M77-M108 WeakPolarHBondContact CE-SD 3.24Å; M77-F170 HydrophobicContact CG-CD2 4.06Å; M77-F170 HydrophobicContact CG-CE2 4.21Å
78	K	82.4	Confident	87.8	Confident	71 Å²	71	25.5 Å²	25.5	31%	0.309	13%	0.126	S	C	.	.	H	α-helix	trans	-83.3	-32.8	174.2	-73.5	177.3	71.3	173.3	0	112.9	L74 V75 L76 L88 E359 S363	L74-K78 HydrophobicContact CD1-CD 4.21Å; L74-K78 HydrophobicContact CG-CD 4.39Å; L74-K78 WeakPolarHBondContact O-CG 3.13Å; L74-K78 PolarHBondContact O-N 3.41Å; V75-K78 PolarHBondContact O-N 2.97Å; V75-K78 VanDerWaalsContact O-N 3.15Å; L76-K78 PolarHBondContact O-N 3.12Å; K78-L88 HydrophobicContact CG-CD2 3.76Å; K78-E359 PolarHBondContact NZ-O 3.26Å; K78-E359 IonicContact NZ-OE2 2.74Å; K78-E359 PolarHBondContact NZ-OE2 3.47Å; K78-S363 WeakPolarHBondContact CE-OG 3.26Å; K78-S363 PolarHBondContact NZ-OG 2.92Å
79	C	79.9	Confident	88	Confident	45 Å²	45	25.9 Å²	25.9	30%	0.304	13%	0.129	S	C	.	.	H	α-helix	trans	-81	-42.6	-178.4	-66.8	0	0	0	0	111.4	V75 L76 P335	V75-C79 PolarHBondContact O-N 3.19Å; V75-C79 PolarHBondContact O-SG 2.66Å; L76-C79 PolarHBondContact O-N 3.31Å; C79-P335 VanDerWaalsContact C-CB 3.46Å; C79-P335 HydrophobicContact CB-CB 4.32Å; C79-P335 WeakPolarHBondContact O-CB 3.43Å
80	V	83.7	Confident	88.5	Confident	6 Å²	6	23.7 Å²	23.7	4%	0.036	12%	0.122	C	C	.	.			trans	-79.4	128	-169.8	-178.3	0	0	0	0	111.9	L76 I85 L142 I147 P335	L76-V80 WeakPolarHBondContact O-CB 3.42Å; L76-V80 VanDerWaalsContact O-CG2 3.23Å; L76-V80 WeakPolarHBondContact O-CG2 3.41Å; L76-V80 PolarHBondContact O-N 3.45Å; V80-I85 HydrophobicContact CB-CG2 4.37Å; V80-I85 HydrophobicContact CG1-CB 4.09Å; V80-I85 HydrophobicContact CG1-CD1 3.38Å; V80-I85 HydrophobicContact CG1-CG1 4.31Å; V80-I85 HydrophobicContact CG1-CG2 3.57Å; V80-L142 HydrophobicContact CG1-CD2 4.35Å; V80-L142 HydrophobicContact CG2-CD2 4.24Å; V80-I147 HydrophobicContact CG2-CD1 4.04Å; V80-P335 HydrophobicContact CG2-CG 4.17Å
81	N	86.9	Confident	88.9	Confident	103 Å²	103	23.5 Å²	23.5	55%	0.551	12%	0.12	S	C	*	.			trans	-135.5	93.1	178.2	-175.7	27.9	0	0	0	111.1	H141	N81-H141 PolarHBondContact O-CE1 2.98Å; N81-H141 PolarHBondContact O-NE2 3.32Å
82	H	92.9	Very high	89.2	Confident	10 Å²	10	22.2 Å²	22.2	5%	0.046	12%	0.115	C	C	.	.			trans	-147.3	144.3	177.9	-173.3	-101.2	0	0	0	110.5	N84 I85 H141 E329	H82-N84 PolarHBondContact CE1-OD1 3.13Å; H82-N84 PolarHBondContact ND1-N 2.94Å; H82-N84 VanDerWaalsContact ND1-N 3.12Å; H82-N84 PolarHBondContact O-N 3.25Å; H82-I85 HydrophobicContact CB-CB 4.25Å; H82-I85 HydrophobicContact CB-CD1 3.97Å; H82-I85 HydrophobicContact CB-CG1 4.22Å; H82-I85 PolarHBondContact O-N 3.5Å; H82-H141 HydrophobicContact CB-CB 4.22Å; H82-H141 VanDerWaalsContact CB-CD2 3.49Å; H82-H141 WeakPolarHBondContact CB-CD2 3.36Å; H82-H141 AromaticContact CD2-CG 3.91Å; H82-H141 AromaticContact CD2-ND1 3.79Å; H82-H141 AromaticContact CG-CG 3.81Å; H82-E329 PolarHBondContact NE2-O 3.06Å; H82-E329 VanDerWaalsContact NE2-O 3.09Å
83	K	94.8	Very high	89.8	Confident	86 Å²	86	22.2 Å²	22.2	37%	0.374	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-28.8	-175.7	68.2	171.3	-167.1	159.3	0	113.3	I85 K166 E329	K83-I85 VanDerWaalsContact C-N 3.32Å; K83-K166 WeakPolarHBondContact O-CE 3.47Å; K83-K166 VanDerWaalsContact O-CG 3.22Å; K83-K166 WeakPolarHBondContact O-CG 3.4Å; K83-K166 PolarHBondContact O-NZ 3.38Å; K83-E329 WeakPolarHBondContact CE-OE1 3.4Å; K83-E329 WeakPolarHBondContact CE-OE2 3.33Å; K83-E329 IonicContact NZ-OE1 3.58Å; K83-E329 PolarHBondContact NZ-OE1 3.05Å; K83-E329 IonicContact NZ-OE2 2.65Å; K83-E329 PolarHBondContact NZ-OE2 3.1Å
84	N	96.9	Very high	90.2	Very high	2 Å²	2	23 Å²	23	1%	0.011	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	14.8	177	-54.6	113.8	0	0	0	114.5	H82 Q134 L165 K166 I167	H82-N84 PolarHBondContact CE1-OD1 3.13Å; H82-N84 PolarHBondContact ND1-N 2.94Å; H82-N84 VanDerWaalsContact ND1-N 3.12Å; H82-N84 PolarHBondContact O-N 3.25Å; N84-Q134 VanDerWaalsContact CB-O 3.27Å; N84-Q134 WeakPolarHBondContact CB-O 3.24Å; N84-Q134 WeakPolarHBondContact ND2-CB 3.35Å; N84-Q134 WeakPolarHBondContact ND2-CG 3.22Å; N84-Q134 PolarHBondContact ND2-OE1 3.28Å; N84-Q134 VanDerWaalsContact ND2-OE1 3.16Å; N84-L165 VanDerWaalsContact CA-O 3.26Å; N84-L165 WeakPolarHBondContact CA-O 3.45Å; N84-L165 PolarHBondContact ND2-O 3.44Å; N84-K166 WeakPolarHBondContact O-CA 3.21Å; N84-I167 PolarHBondContact O-N 2.94Å
85	I	94.1	Very high	90.5	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.005	13%	0.127	C	C	.	.	B	Isolated β-bridge	trans	-124	142.5	173.4	-66.8	172.5	0	0	0	107.8	V80 H82 K83 S87 H141 L142 K166 F170	V80-I85 HydrophobicContact CB-CG2 4.37Å; V80-I85 HydrophobicContact CG1-CB 4.09Å; V80-I85 HydrophobicContact CG1-CD1 3.38Å; V80-I85 HydrophobicContact CG1-CG1 4.31Å; V80-I85 HydrophobicContact CG1-CG2 3.57Å; H82-I85 HydrophobicContact CB-CB 4.25Å; H82-I85 HydrophobicContact CB-CD1 3.97Å; H82-I85 HydrophobicContact CB-CG1 4.22Å; H82-I85 PolarHBondContact O-N 3.5Å; K83-I85 VanDerWaalsContact C-N 3.32Å; I85-S87 PolarHBondContact O-N 3.09Å; I85-H141 HydrophobicContact CD1-CB 4.24Å; I85-L142 HydrophobicContact CD1-CD1 4.45Å; I85-L142 HydrophobicContact CD1-CD2 3.76Å; I85-L142 HydrophobicContact CD1-CG 3.71Å; I85-K166 PolarHBondContact O-NZ 2.99Å; I85-F170 HydrophobicContact CG2-CE2 4.01Å; I85-F170 HydrophobicContact CG2-CZ 3.48Å; I85-F170 VanDerWaalsContact CG2-CZ 3.48Å
86	I	92.4	Very high	90.7	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.021	16%	0.157	C	C	.	.	P	Polyproline II helix	trans	-65.9	131	176.6	-165.2	63.4	0	0	0	111	M77 M108 E109 K166 I167 L168 F170	M77-I86 HydrophobicContact CE-CG2 4.32Å; I86-M108 HydrophobicContact CD1-CB 4.11Å; I86-M108 HydrophobicContact CG1-CB 3.89Å; I86-M108 HydrophobicContact CG1-CG 4.05Å; I86-M108 HydrophobicContact CG1-SD 3.94Å; I86-E109 HydrophobicContact CD1-CB 4.17Å; I86-K166 HydrophobicContact CD1-CD 4.17Å; I86-I167 WeakPolarHBondContact CG2-O 3.35Å; I86-I167 PolarHBondContact N-O 3.35Å; I86-L168 HydrophobicContact CB-CD2 3.63Å; I86-L168 HydrophobicContact CD1-CD2 4.23Å; I86-L168 HydrophobicContact CG1-CD2 3.74Å; I86-L168 HydrophobicContact CG2-CD2 3.73Å; I86-F170 HydrophobicContact CG2-CE2 4.46Å
87	S	90	Very high	91.3	Very high	14 Å²	14	33.9 Å²	33.9	10%	0.098	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-97.5	140.1	179.7	-56.4	0	0	0	0	111	I85	I85-S87 PolarHBondContact O-N 3.09Å
88	L	91.4	Very high	91.6	Very high	35 Å²	35	35.6 Å²	35.6	18%	0.183	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	118.2	170.1	-169.8	68	0	0	0	109.6	L74 M77 K78 N90 V91 L106	L74-L88 HydrophobicContact CD1-CD2 4.02Å; M77-L88 HydrophobicContact CB-CB 4.1Å; M77-L88 HydrophobicContact CE-CB 4.12Å; M77-L88 HydrophobicContact CE-CD1 3.82Å; K78-L88 HydrophobicContact CG-CD2 3.76Å; L88-N90 VanDerWaalsContact CD1-O 3.29Å; L88-N90 WeakPolarHBondContact CD1-O 3.37Å; L88-V91 HydrophobicContact CD2-CB 4.17Å; L88-V91 HydrophobicContact CD2-CG1 4.16Å; L88-L106 HydrophobicContact CD1-CB 4.04Å; L88-L106 HydrophobicContact CD1-CD2 4.05Å
89	L	92.2	Very high	92.2	Very high	37 Å²	37	39.1 Å²	39.1	19%	0.194	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	-37.6	177.1	-57	-177.1	0	0	0	111.9	V52 V107 M108 E109	V52-L89 HydrophobicContact CG1-CD1 3.79Å; L89-V107 HydrophobicContact CB-CG1 4.36Å; L89-V107 WeakPolarHBondContact CB-O 3.47Å; L89-V107 PolarHBondContact N-O 2.94Å; L89-M108 VanDerWaalsContact CD1-C 3.49Å; L89-E109 HydrophobicContact CD1-CG 4.1Å; L89-E109 HydrophobicContact CD2-CG 4.01Å; L89-E109 HydrophobicContact CG-CG 4.25Å
90	N	94.2	Very high	92.9	Very high	11 Å²	11	42.2 Å²	42.2	6%	0.059	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	157.7	177.8	-165.7	4.1	0	0	0	109.6	Y26 L88 V107	Y26-N90 WeakPolarHBondContact OH-CB 3.35Å; Y26-N90 PolarHBondContact OH-ND2 3.23Å; L88-N90 VanDerWaalsContact CD1-O 3.29Å; L88-N90 WeakPolarHBondContact CD1-O 3.37Å; N90-V107 HydrophobicContact CB-CB 3.9Å; N90-V107 HydrophobicContact CB-CG2 4.08Å; N90-V107 PolarHBondContact N-O 2.94Å; N90-V107 WeakPolarHBondContact O-CB 3.4Å; N90-V107 PolarHBondContact O-N 2.92Å
91	V	95.3	Very high	93.4	Very high	1 Å²	1	42 Å²	42	1%	0.006	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	137.5	169.2	56.5	0	0	0	0	108.3	L74 L88 V104 Y105 L106 V360	L74-V91 HydrophobicContact CD1-CB 4.19Å; L74-V91 HydrophobicContact CD1-CG1 4.12Å; L74-V91 HydrophobicContact CD1-CG2 3.87Å; L88-V91 HydrophobicContact CD2-CB 4.17Å; L88-V91 HydrophobicContact CD2-CG1 4.16Å; V91-V104 HydrophobicContact CG2-CG1 3.99Å; V91-Y105 VanDerWaalsContact CA-O 3.29Å; V91-Y105 WeakPolarHBondContact CA-O 3.37Å; V91-L106 HydrophobicContact CB-CD2 4.24Å; V91-L106 HydrophobicContact CG2-CD2 3.75Å; V91-V360 HydrophobicContact CG2-CB 4.49Å; V91-V360 HydrophobicContact CG2-CG1 4.24Å; V91-V360 HydrophobicContact CG2-CG2 3.87Å
92	F	95.5	Very high	93.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	165.8	-178.5	65.3	-93.7	0	0	0	112.3	F10 V22 L23 Y26 Y105 V107 E364	F10-F92 AromaticContact CE1-CD2 3.62Å; F10-F92 HydrophobicContact CE1-CD2 3.62Å; F10-F92 AromaticContact CE1-CE2 3.96Å; F10-F92 HydrophobicContact CE1-CE2 3.96Å; F10-F92 HydrophobicContact CZ-CD2 4.4Å; V22-F92 HydrophobicContact CB-CE2 4.28Å; V22-F92 HydrophobicContact CB-CZ 3.91Å; V22-F92 HydrophobicContact CG1-CE2 4.33Å; V22-F92 HydrophobicContact CG1-CZ 3.92Å; L23-F92 HydrophobicContact CD1-CB 4.46Å; L23-F92 HydrophobicContact CD1-CD1 4.15Å; L23-F92 HydrophobicContact CD1-CG 4.23Å; L23-F92 HydrophobicContact CG-CD2 4.49Å; L23-F92 HydrophobicContact CG-CG 4.4Å; Y26-F92 AromaticContact CD2-CE1 3.99Å; Y26-F92 HydrophobicContact CD2-CE1 3.99Å; Y26-F92 HydrophobicContact CD2-CZ 4.26Å; Y26-F92 HydrophobicContact CE2-CD1 4.08Å; Y26-F92 AromaticContact CE2-CE1 3.46Å; Y26-F92 HydrophobicContact CE2-CE1 3.46Å; Y26-F92 VanDerWaalsContact CE2-CE1 3.46Å; Y26-F92 HydrophobicContact CE2-CZ 4.16Å; F92-Y105 AromaticContact CD2-CD2 3.97Å; F92-Y105 HydrophobicContact CD2-CD2 3.97Å; F92-Y105 HydrophobicContact CD2-CG 4.16Å; F92-Y105 HydrophobicContact CE1-CG 4.39Å; F92-Y105 VanDerWaalsContact CE2-CB 3.5Å; F92-Y105 HydrophobicContact CE2-CD1 4.2Å; F92-Y105 AromaticContact CE2-CD2 3.53Å; F92-Y105 HydrophobicContact CE2-CD2 3.53Å; F92-Y105 HydrophobicContact CE2-CE2 4.3Å; F92-Y105 AromaticContact CE2-CG 3.47Å; F92-Y105 HydrophobicContact CE2-CG 3.47Å; F92-Y105 VanDerWaalsContact CE2-CG 3.47Å; F92-Y105 HydrophobicContact CZ-CD1 4.08Å; F92-Y105 HydrophobicContact CZ-CD2 4.17Å; F92-Y105 AromaticContact CZ-CG 3.62Å; F92-Y105 HydrophobicContact CZ-CG 3.62Å; F92-Y105 PolarHBondContact N-O 2.93Å; F92-Y105 VanDerWaalsContact N-O 3.08Å; F92-Y105 PolarHBondContact O-N 2.87Å; F92-V107 HydrophobicContact CD1-CG2 4.08Å; F92-V107 HydrophobicContact CE1-CG2 3.63Å; F92-E364 VanDerWaalsContact CA-OE1 3.31Å; F92-E364 WeakPolarHBondContact CA-OE1 3.41Å; F92-E364 HydrophobicContact CB-CG 4.38Å; F92-E364 WeakPolarHBondContact CB-OE1 3.31Å
93	T	95.6	Very high	93.7	Very high	3 Å²	3	44.1 Å²	44.1	2%	0.018	21%	0.214	C	C	.	.			trans	-133.4	140.7	166.8	179.9	0	0	0	0	109.7	F10 Q95 F101 D103 Y357 V360 M361 E364	F10-T93 WeakPolarHBondContact CZ-O 3.36Å; T93-Q95 VanDerWaalsContact C-N 3.25Å; T93-Q95 PolarHBondContact OG1-N 3.35Å; T93-Q95 PolarHBondContact OG1-OE1 3.22Å; T93-F101 HydrophobicContact CG2-CD2 3.96Å; T93-F101 HydrophobicContact CG2-CE2 3.96Å; T93-F101 WeakPolarHBondContact OG1-CD2 3.38Å; T93-D103 WeakPolarHBondContact CB-O 3.26Å; T93-D103 PolarHBondContact OG1-O 2.94Å; T93-Y357 HydrophobicContact CG2-CE2 4.31Å; T93-V360 HydrophobicContact CG2-CG1 3.96Å; T93-M361 HydrophobicContact CG2-CE 3.3Å; T93-E364 PolarHBondContact N-OE1 2.84Å
94	P	94.2	Very high	93.7	Very high	22 Å²	22	40 Å²	40	14%	0.143	20%	0.197	C	C	.	.	S	Bend	trans	-76.2	-14.6	176.5	31.6	-35.9	0	0	0	113	F10 T21 Y105	F10-P94 HydrophobicContact CD1-CB 3.82Å; F10-P94 HydrophobicContact CE1-CB 4.02Å; F10-P94 HydrophobicContact CG-CB 4.13Å; F10-P94 HydrophobicContact CZ-CB 4.48Å; T21-P94 HydrophobicContact CG2-CB 3.53Å; T21-P94 HydrophobicContact CG2-CG 4.12Å; P94-Y105 HydrophobicContact CG-CE2 4.02Å
95	Q	93.9	Very high	93.6	Very high	35 Å²	35	40 Å²	40	16%	0.164	20%	0.196	C	C	.	.			trans	-84.6	142	-178.8	-64.9	100.1	19	0	0	111.5	T93 E100 D103	T93-Q95 VanDerWaalsContact C-N 3.25Å; T93-Q95 PolarHBondContact OG1-N 3.35Å; T93-Q95 PolarHBondContact OG1-OE1 3.22Å; Q95-E100 HydrophobicContact CB-CB 3.99Å; Q95-E100 HydrophobicContact CG-CB 4.2Å; Q95-E100 WeakPolarHBondContact CG-O 3.27Å; Q95-D103 PolarHBondContact NE2-OD2 3Å
96	K	90.1	Very high	93.6	Very high	166 Å²	166	40 Å²	40	72%	0.722	20%	0.196	S	C	*	.			trans	-96.2	-17.6	-169.1	-66.3	-176	-179.4	177.2	0	114.5	Y357	K96-Y357 PolarHBondContact O-OH 2.65Å
97	T	93.9	Very high	93.7	Very high	51 Å²	51	39.8 Å²	39.8	31%	0.313	20%	0.195	S	C	.	.	S	Bend	trans	-129.6	159.1	-178.1	84.6	0	0	0	0	110.3	E99 E100 F101	T97-E99 WeakPolarHBondContact CB-OE2 3.1Å; T97-E99 PolarHBondContact O-N 3.24Å; T97-E99 PolarHBondContact OG1-N 2.78Å; T97-E99 PolarHBondContact OG1-OE2 2.8Å; T97-E100 PolarHBondContact O-N 2.87Å; T97-E100 PolarHBondContact OG1-N 3.38Å; T97-F101 WeakPolarHBondContact O-CB 3.26Å; T97-F101 PolarHBondContact O-N 2.81Å
98	L	94.3	Very high	94	Very high	45 Å²	45	39.9 Å²	39.9	24%	0.236	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-35.8	177.3	176.2	66.3	0	0	0	111.4	E100 F101 K353 E354 Y357	L98-E100 VanDerWaalsContact C-N 3.34Å; L98-E100 PolarHBondContact O-N 3.28Å; L98-F101 WeakPolarHBondContact O-CB 3.47Å; L98-F101 PolarHBondContact O-N 3.16Å; L98-K353 HydrophobicContact CD1-CG 4.1Å; L98-K353 WeakPolarHBondContact O-CE 3.22Å; L98-K353 PolarHBondContact O-NZ 3.01Å; L98-E354 HydrophobicContact CD1-CG 4.01Å; L98-E354 HydrophobicContact CD2-CG 3.48Å; L98-E354 VanDerWaalsContact CD2-CG 3.48Å; L98-E354 HydrophobicContact CG-CG 4.35Å; L98-Y357 HydrophobicContact CB-CD1 4.26Å; L98-Y357 HydrophobicContact CB-CE1 4.32Å; L98-Y357 HydrophobicContact CD1-CD1 4.15Å; L98-Y357 HydrophobicContact CD1-CG 3.98Å
99	E	94	Very high	94	Very high	144 Å²	144	39.5 Å²	39.5	67%	0.673	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-44.6	-179	-59	71.7	-153	0	0	110.3	T97 K353	T97-E99 WeakPolarHBondContact CB-OE2 3.1Å; T97-E99 PolarHBondContact O-N 3.24Å; T97-E99 PolarHBondContact OG1-N 2.78Å; T97-E99 PolarHBondContact OG1-OE2 2.8Å; E99-K353 PolarHBondContact O-NZ 3.25Å
100	E	93.7	Very high	94.1	Very high	111 Å²	111	39.5 Å²	39.5	52%	0.519	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-20.2	179.1	-64.4	178.7	171.1	0	0	113.6	Q95 T97 L98 Q102	Q95-E100 HydrophobicContact CB-CB 3.99Å; Q95-E100 HydrophobicContact CG-CB 4.2Å; Q95-E100 WeakPolarHBondContact CG-O 3.27Å; T97-E100 PolarHBondContact O-N 2.87Å; T97-E100 PolarHBondContact OG1-N 3.38Å; L98-E100 VanDerWaalsContact C-N 3.34Å; L98-E100 PolarHBondContact O-N 3.28Å; E100-Q102 WeakPolarHBondContact O-CG 3.39Å; E100-Q102 PolarHBondContact O-N 3.23Å
101	F	95.1	Very high	94.2	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.194	C	C	.	.			trans	-57.8	120.7	-172	176.6	-132.2	0	0	0	113	F61 T93 T97 L98 D103 V104 K353 I356 Y357 V360	F61-F101 HydrophobicContact CE1-CE1 4.07Å; F61-F101 AromaticContact CE2-CD1 3.94Å; F61-F101 HydrophobicContact CE2-CD1 3.94Å; F61-F101 AromaticContact CE2-CE1 3.79Å; F61-F101 HydrophobicContact CE2-CE1 3.79Å; F61-F101 HydrophobicContact CE2-CG 4.43Å; F61-F101 HydrophobicContact CE2-CZ 4.13Å; F61-F101 AromaticContact CZ-CD1 3.78Å; F61-F101 HydrophobicContact CZ-CD1 3.78Å; F61-F101 AromaticContact CZ-CE1 3.2Å; F61-F101 HydrophobicContact CZ-CE1 3.2Å; F61-F101 HydrophobicContact CZ-CE2 4.43Å; F61-F101 AromaticContact CZ-CZ 3.6Å; F61-F101 HydrophobicContact CZ-CZ 3.6Å; T93-F101 HydrophobicContact CG2-CD2 3.96Å; T93-F101 HydrophobicContact CG2-CE2 3.96Å; T93-F101 WeakPolarHBondContact OG1-CD2 3.38Å; T97-F101 WeakPolarHBondContact O-CB 3.26Å; T97-F101 PolarHBondContact O-N 2.81Å; L98-F101 WeakPolarHBondContact O-CB 3.47Å; L98-F101 PolarHBondContact O-N 3.16Å; F101-D103 WeakPolarHBondContact CE2-O 3.49Å; F101-V104 HydrophobicContact CE2-CG2 3.63Å; F101-V104 HydrophobicContact CZ-CG2 3.42Å; F101-V104 VanDerWaalsContact CZ-CG2 3.42Å; F101-K353 HydrophobicContact CD1-CD 4.42Å; F101-K353 HydrophobicContact CD1-CG 3.66Å; F101-K353 HydrophobicContact CE1-CG 4.19Å; F101-K353 WeakPolarHBondContact O-CE 3.35Å; F101-K353 PolarHBondContact O-NZ 3.24Å; F101-I356 HydrophobicContact CE1-CB 4.28Å; F101-I356 HydrophobicContact CE1-CG2 4.05Å; F101-I356 HydrophobicContact CZ-CG2 3.8Å; F101-Y357 HydrophobicContact CB-CD2 3.83Å; F101-Y357 HydrophobicContact CB-CE2 4.15Å; F101-Y357 AromaticContact CD1-CD2 3.65Å; F101-Y357 HydrophobicContact CD1-CD2 3.65Å; F101-Y357 HydrophobicContact CD1-CG 4.07Å; F101-Y357 AromaticContact CD2-CD2 3.85Å; F101-Y357 HydrophobicContact CD2-CD2 3.85Å; F101-Y357 HydrophobicContact CD2-CE2 4.41Å; F101-Y357 HydrophobicContact CE1-CD2 4.07Å; F101-Y357 HydrophobicContact CE1-CG 4.37Å; F101-Y357 HydrophobicContact CE2-CD2 4.27Å; F101-Y357 AromaticContact CG-CD2 3.52Å; F101-Y357 HydrophobicContact CG-CD2 3.52Å; F101-Y357 HydrophobicContact CG-CE2 4.22Å; F101-Y357 HydrophobicContact CG-CG 4.36Å; F101-Y357 HydrophobicContact CZ-CD2 4.36Å; F101-V360 HydrophobicContact CZ-CG2 4.49Å
102	Q	92	Very high	94	Very high	127 Å²	127	44.6 Å²	44.6	59%	0.593	22%	0.219	S	C	*	.			trans	-141.3	-36.6	-178.2	-72.2	-177.4	11.2	0	0	112.7	E100	E100-Q102 WeakPolarHBondContact O-CG 3.39Å; E100-Q102 PolarHBondContact O-N 3.23Å
103	D	93.3	Very high	93.7	Very high	31 Å²	31	45.8 Å²	45.8	17%	0.166	23%	0.228	C	C	.	.			trans	-108.3	136.6	-173.9	-61.2	-58.6	0	0	0	111.5	K56 T93 Q95 F101 Y105	K56-D103 WeakPolarHBondContact CE-OD1 3.39Å; K56-D103 IonicContact NZ-OD1 2.57Å; K56-D103 PolarHBondContact NZ-OD1 3.12Å; T93-D103 WeakPolarHBondContact CB-O 3.26Å; T93-D103 PolarHBondContact OG1-O 2.94Å; Q95-D103 PolarHBondContact NE2-OD2 3Å; F101-D103 WeakPolarHBondContact CE2-O 3.49Å; D103-Y105 HydrophobicContact CB-CD2 4.37Å; D103-Y105 HydrophobicContact CB-CE2 3.65Å
104	V	94.9	Very high	93.5	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.006	24%	0.241	C	C	.	.			trans	-121.8	129.1	171.3	-179.7	0	0	0	0	108.3	L57 V91 F101 L106 I356 V360	L57-V104 HydrophobicContact CB-CB 4.43Å; L57-V104 HydrophobicContact CD1-CB 3.99Å; L57-V104 HydrophobicContact CD1-CG1 4.09Å; L57-V104 HydrophobicContact CG-CB 4.23Å; L57-V104 HydrophobicContact CG-CG1 4.49Å; L57-V104 PolarHBondContact N-O 3.49Å; V91-V104 HydrophobicContact CG2-CG1 3.99Å; F101-V104 HydrophobicContact CE2-CG2 3.63Å; F101-V104 HydrophobicContact CZ-CG2 3.42Å; F101-V104 VanDerWaalsContact CZ-CG2 3.42Å; V104-L106 HydrophobicContact CG1-CD2 4.13Å; V104-I356 HydrophobicContact CG2-CG2 3.97Å; V104-V360 HydrophobicContact CG1-CG2 4.22Å; V104-V360 HydrophobicContact CG2-CG2 4.47Å
105	Y	95.3	Very high	93.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	122.8	176.3	-65.1	-98.1	0	0	0	109.5	F20 T21 V22 I54 K55 K56 V91 F92 P94 D103	F20-Y105 HydrophobicContact CB-CE1 4.49Å; F20-Y105 HydrophobicContact CD1-CD1 4.26Å; F20-Y105 AromaticContact CD1-CE1 3.71Å; F20-Y105 HydrophobicContact CD1-CE1 3.71Å; F20-Y105 HydrophobicContact CE1-CD1 4.46Å; F20-Y105 HydrophobicContact CE1-CE1 4.17Å; F20-Y105 HydrophobicContact CG-CE1 4.18Å; T21-Y105 PolarHBondContact N-OH 3.28Å; V22-Y105 HydrophobicContact CG1-CD1 4.04Å; V22-Y105 HydrophobicContact CG1-CE1 3.92Å; I54-Y105 HydrophobicContact CG2-CD1 3.94Å; K55-Y105 WeakPolarHBondContact O-CA 3.4Å; K56-Y105 HydrophobicContact CB-CD1 3.88Å; K56-Y105 HydrophobicContact CB-CE1 3.68Å; K56-Y105 HydrophobicContact CD-CE1 3.8Å; K56-Y105 WeakPolarHBondContact CD-OH 3.03Å; K56-Y105 WeakPolarHBondContact CE-OH 3.23Å; K56-Y105 HydrophobicContact CG-CD1 4.15Å; K56-Y105 HydrophobicContact CG-CE1 3.65Å; K56-Y105 HydrophobicContact CG-CE2 4.46Å; V91-Y105 VanDerWaalsContact CA-O 3.29Å; V91-Y105 WeakPolarHBondContact CA-O 3.37Å; F92-Y105 AromaticContact CD2-CD2 3.97Å; F92-Y105 HydrophobicContact CD2-CD2 3.97Å; F92-Y105 HydrophobicContact CD2-CG 4.16Å; F92-Y105 HydrophobicContact CE1-CG 4.39Å; F92-Y105 VanDerWaalsContact CE2-CB 3.5Å; F92-Y105 HydrophobicContact CE2-CD1 4.2Å; F92-Y105 AromaticContact CE2-CD2 3.53Å; F92-Y105 HydrophobicContact CE2-CD2 3.53Å; F92-Y105 HydrophobicContact CE2-CE2 4.3Å; F92-Y105 AromaticContact CE2-CG 3.47Å; F92-Y105 HydrophobicContact CE2-CG 3.47Å; F92-Y105 VanDerWaalsContact CE2-CG 3.47Å; F92-Y105 HydrophobicContact CZ-CD1 4.08Å; F92-Y105 HydrophobicContact CZ-CD2 4.17Å; F92-Y105 AromaticContact CZ-CG 3.62Å; F92-Y105 HydrophobicContact CZ-CG 3.62Å; F92-Y105 PolarHBondContact N-O 2.93Å; F92-Y105 VanDerWaalsContact N-O 3.08Å; F92-Y105 PolarHBondContact O-N 2.87Å; P94-Y105 HydrophobicContact CG-CE2 4.02Å; D103-Y105 HydrophobicContact CB-CD2 4.37Å; D103-Y105 HydrophobicContact CB-CE2 3.65Å
106	L	94.1	Very high	93.3	Very high	1 Å²	1	48 Å²	48	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	123.7	175.1	-54.9	176.5	0	0	0	108.7	I54 K55 L57 E73 L74 M77 L88 V91 V104	I54-L106 CarbonylContact C-O 3.57Å; I54-L106 WeakPolarHBondContact CA-O 3.43Å; K55-L106 HydrophobicContact CB-CB 4.41Å; K55-L106 PolarHBondContact N-O 2.88Å; K55-L106 PolarHBondContact O-N 2.9Å; L57-L106 HydrophobicContact CD2-CD1 3.97Å; L57-L106 HydrophobicContact CG-CD1 4.41Å; E73-L106 HydrophobicContact CG-CD1 4.42Å; L74-L106 HydrophobicContact CD1-CD2 3.98Å; M77-L106 HydrophobicContact SD-CD1 4.14Å; L88-L106 HydrophobicContact CD1-CB 4.04Å; L88-L106 HydrophobicContact CD1-CD2 4.05Å; V91-L106 HydrophobicContact CB-CD2 4.24Å; V91-L106 HydrophobicContact CG2-CD2 3.75Å; V104-L106 HydrophobicContact CG1-CD2 4.13Å
107	V	95.8	Very high	93.2	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	-106	125.7	178.3	-173.1	0	0	0	0	108.8	Y26 V52 A53 I54 L89 N90 F92	Y26-V107 HydrophobicContact CE1-CG1 3.9Å; Y26-V107 HydrophobicContact CE1-CG2 4.4Å; Y26-V107 HydrophobicContact CE2-CG2 3.96Å; V52-V107 HydrophobicContact CB-CG1 3.85Å; V52-V107 HydrophobicContact CG1-CG1 4.23Å; V52-V107 HydrophobicContact CG2-CG1 3.88Å; A53-V107 CarbonylContact O-C 3.6Å; A53-V107 WeakPolarHBondContact O-CA 3.23Å; I54-V107 HydrophobicContact CG1-CG1 4.36Å; I54-V107 HydrophobicContact CG1-CG2 4.22Å; I54-V107 HydrophobicContact CG2-CG2 4.43Å; L89-V107 HydrophobicContact CB-CG1 4.36Å; L89-V107 WeakPolarHBondContact CB-O 3.47Å; L89-V107 PolarHBondContact N-O 2.94Å; N90-V107 HydrophobicContact CB-CB 3.9Å; N90-V107 HydrophobicContact CB-CG2 4.08Å; N90-V107 PolarHBondContact N-O 2.94Å; N90-V107 WeakPolarHBondContact O-CB 3.4Å; N90-V107 PolarHBondContact O-N 2.92Å; F92-V107 HydrophobicContact CD1-CG2 4.08Å; F92-V107 HydrophobicContact CE1-CG2 3.63Å
108	M	94.6	Very high	93.1	Very high	17 Å²	17	43.6 Å²	43.6	8%	0.084	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	168.5	-172.7	-62.3	167.4	-69.5	0	0	110	V52 A53 K55 M77 I86 L89 L110	V52-M108 WeakPolarHBondContact CA-O 3.46Å; V52-M108 WeakPolarHBondContact CB-O 3.33Å; A53-M108 PolarHBondContact N-O 2.95Å; A53-M108 PolarHBondContact O-N 3.1Å; K55-M108 HydrophobicContact CB-CE 3.71Å; M77-M108 HydrophobicContact CE-CG 3.5Å; M77-M108 HydrophobicContact CE-SD 3.47Å; M77-M108 WeakPolarHBondContact CE-SD 3.24Å; I86-M108 HydrophobicContact CD1-CB 4.11Å; I86-M108 HydrophobicContact CG1-CB 3.89Å; I86-M108 HydrophobicContact CG1-CG 4.05Å; I86-M108 HydrophobicContact CG1-SD 3.94Å; L89-M108 VanDerWaalsContact CD1-C 3.49Å; M108-L110 PolarHBondContact O-N 3.14Å
109	E	92.9	Very high	92.9	Very high	26 Å²	26	41.6 Å²	41.6	12%	0.121	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	135.6	169.7	-57.8	179	113.8	0	0	110.4	I86 L89 K166	I86-E109 HydrophobicContact CD1-CB 4.17Å; L89-E109 HydrophobicContact CD1-CG 4.1Å; L89-E109 HydrophobicContact CD2-CG 4.01Å; L89-E109 HydrophobicContact CG-CG 4.25Å; E109-K166 WeakPolarHBondContact OE2-CE 3.39Å; E109-K166 IonicContact OE2-NZ 2.71Å; E109-K166 PolarHBondContact OE2-NZ 3.45Å
110	L	94.5	Very high	92.7	Very high	38 Å²	38	41.6 Å²	41.6	20%	0.199	21%	0.212	C	C	.	.			trans	-77.9	135.9	171.9	-172.5	64.5	0	0	0	109.9	I32 A42 N51 A53 M108	I32-L110 HydrophobicContact CD1-CD1 3.6Å; A42-L110 HydrophobicContact CB-CD1 4.02Å; A42-L110 HydrophobicContact CB-CD2 3.96Å; N51-L110 HydrophobicContact CB-CB 4.22Å; N51-L110 HydrophobicContact CB-CD2 3.57Å; A53-L110 HydrophobicContact CB-CD1 4Å; M108-L110 PolarHBondContact O-N 3.14Å
111	M	94.6	Very high	92.5	Very high	20 Å²	20	42 Å²	42	10%	0.099	22%	0.215	C	C	.	.			trans	-118.7	157.4	176	-57	-66.4	-73.6	0	0	108.9	V158 K160 K166	M111-V158 HydrophobicContact CB-CB 3.74Å; M111-V158 HydrophobicContact CB-CG1 4.5Å; M111-V158 HydrophobicContact CB-CG2 3.98Å; M111-V158 HydrophobicContact CE-CG2 4.33Å; M111-V158 HydrophobicContact CG-CB 3.94Å; M111-V158 HydrophobicContact CG-CG2 3.57Å; M111-K160 HydrophobicContact CE-CD 4.41Å; M111-K160 HydrophobicContact CE-CG 3.76Å; M111-K160 HydrophobicContact SD-CD 4.19Å; M111-K160 HydrophobicContact SD-CG 3.87Å; M111-K166 HydrophobicContact CE-CB 4.23Å; M111-K166 HydrophobicContact CE-CD 4.08Å; M111-K166 HydrophobicContact CE-CG 4.24Å; M111-K166 HydrophobicContact SD-CD 3.95Å
112	D	91.6	Very high	92.1	Very high	99 Å²	99	51.1 Å²	51.1	53%	0.529	26%	0.258	S	S	.	.	S	Bend	trans	-80.9	-38	-169.3	-61.7	-26.1	0	0	0	112.1	V159 K160 S161	D112-V159 PolarHBondContact N-O 3.24Å; D112-K160 WeakPolarHBondContact OD2-CA 3.13Å; D112-S161 WeakPolarHBondContact OD2-CB 3.18Å; D112-S161 PolarHBondContact OD2-N 2.71Å; D112-S161 PolarHBondContact OD2-OG 2.8Å
113	A	89.8	Confident	92.1	Very high	25 Å²	25	46.1 Å²	46.1	21%	0.207	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	164.4	-173.6	0	0	0	0	0	111.8	Q117 V158 V159	A113-Q117 VanDerWaalsContact CA-OE1 3.29Å; A113-Q117 HydrophobicContact CB-CB 4.45Å; A113-V158 CarbonylContact O-C 3.2Å; A113-V158 VanDerWaalsContact O-CA 3.28Å; A113-V158 WeakPolarHBondContact O-CA 3.48Å; A113-V158 WeakPolarHBondContact O-CB 3.36Å; A113-V159 HydrophobicContact CB-CG2 4.03Å; A113-V159 PolarHBondContact N-O 3Å; A113-V159 VanDerWaalsContact N-O 3.13Å; A113-V159 PolarHBondContact O-N 2.82Å
114	N	90.3	Very high	92.1	Very high	52 Å²	52	47.5 Å²	47.5	28%	0.278	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	165.3	162.2	65.9	46.5	0	0	0	110.8	C116 Q117 I157 V158	N114-C116 PolarHBondContact O-N 3.22Å; N114-C116 WeakPolarHBondContact OD1-CB 3.32Å; N114-C116 PolarHBondContact OD1-N 2.94Å; N114-Q117 PolarHBondContact O-N 2.81Å; N114-Q117 VanDerWaalsContact O-N 3.15Å; N114-Q117 PolarHBondContact OD1-N 2.82Å; N114-I157 CarbonylContact C-O 3.13Å; N114-I157 VanDerWaalsContact CA-O 3.29Å; N114-I157 WeakPolarHBondContact CA-O 3.5Å; N114-V158 HydrophobicContact CB-CG1 4.24Å
115	L	93.1	Very high	92.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-67.4	-17.9	-175.9	-161.6	71.9	0	0	0	112.9	Q117 V118 I119 L131 M135 P154 I157 V159 I214 M218	L115-Q117 VanDerWaalsContact C-N 3.25Å; L115-Q117 PolarHBondContact O-N 3.01Å; L115-V118 HydrophobicContact CD1-CB 4.02Å; L115-V118 HydrophobicContact CD1-CG1 4.15Å; L115-V118 HydrophobicContact CD1-CG2 4.31Å; L115-V118 PolarHBondContact O-N 2.85Å; L115-I119 HydrophobicContact CG-CD1 4.45Å; L115-I119 WeakPolarHBondContact O-CD1 3.4Å; L115-I119 VanDerWaalsContact O-CG1 3.3Å; L115-I119 WeakPolarHBondContact O-CG1 3.15Å; L115-I119 PolarHBondContact O-N 3.32Å; L115-L131 HydrophobicContact CD1-CD1 4.38Å; L115-M135 HydrophobicContact CD2-SD 4.23Å; L115-P154 HydrophobicContact CB-CB 4Å; L115-P154 WeakPolarHBondContact CB-O 3.46Å; L115-P154 HydrophobicContact CD2-CB 4.47Å; L115-P154 PolarHBondContact N-O 3.19Å; L115-I157 HydrophobicContact CB-CB 4.03Å; L115-I157 HydrophobicContact CB-CG2 4.11Å; L115-I157 HydrophobicContact CD2-CB 4.17Å; L115-I157 HydrophobicContact CD2-CD1 3.95Å; L115-I157 HydrophobicContact CD2-CG2 4.02Å; L115-I157 HydrophobicContact CG-CG2 4.48Å; L115-I157 PolarHBondContact N-O 3.12Å; L115-V159 HydrophobicContact CD1-CG1 4.19Å; L115-I214 HydrophobicContact CD2-CG2 3.46Å; L115-I214 VanDerWaalsContact CD2-CG2 3.46Å; L115-M218 HydrophobicContact CD1-CE 4.3Å; L115-M218 HydrophobicContact CD2-CE 3.9Å; L115-M218 HydrophobicContact CG-CE 4.42Å
116	C	90.8	Very high	92.2	Very high	53 Å²	53	53.8 Å²	53.8	36%	0.358	27%	0.272	S	S	.	.	H	α-helix	trans	-60.1	-38.6	173.2	-52.7	0	0	0	0	111.4	N114 P154	N114-C116 PolarHBondContact O-N 3.22Å; N114-C116 WeakPolarHBondContact OD1-CB 3.32Å; N114-C116 PolarHBondContact OD1-N 2.94Å; C116-P154 HydrophobicContact CB-CB 4.49Å
117	Q	89.5	Confident	92.4	Very high	112 Å²	112	59.7 Å²	59.7	52%	0.523	29%	0.294	S	S	.	.	H	α-helix	trans	-71.5	-38.6	178.7	-64.6	169	-65.3	0	0	110.8	A113 N114 L115 Q120	A113-Q117 VanDerWaalsContact CA-OE1 3.29Å; A113-Q117 HydrophobicContact CB-CB 4.45Å; N114-Q117 PolarHBondContact O-N 2.81Å; N114-Q117 VanDerWaalsContact O-N 3.15Å; N114-Q117 PolarHBondContact OD1-N 2.82Å; L115-Q117 VanDerWaalsContact C-N 3.25Å; L115-Q117 PolarHBondContact O-N 3.01Å; Q117-Q120 PolarHBondContact O-N 3.04Å
118	V	91.3	Very high	92.4	Very high	13 Å²	13	60 Å²	60	8%	0.079	30%	0.296	C	S	.	.	H	α-helix	trans	-65.7	-38.1	178.7	-177.6	0	0	0	0	112	L115 Q120 M121 L123 L131 V159	L115-V118 HydrophobicContact CD1-CB 4.02Å; L115-V118 HydrophobicContact CD1-CG1 4.15Å; L115-V118 HydrophobicContact CD1-CG2 4.31Å; L115-V118 PolarHBondContact O-N 2.85Å; V118-Q120 PolarHBondContact O-N 3.26Å; V118-M121 WeakPolarHBondContact O-CB 3.36Å; V118-M121 PolarHBondContact O-N 3.43Å; V118-L123 HydrophobicContact CG1-CD1 3.94Å; V118-L123 HydrophobicContact CG1-CD2 4.03Å; V118-L131 HydrophobicContact CG1-CD1 3.95Å; V118-V159 HydrophobicContact CG2-CG1 4.44Å; V118-V159 HydrophobicContact CG2-CG2 3.42Å; V118-V159 VanDerWaalsContact CG2-CG2 3.42Å
119	I	90.4	Very high	92.6	Very high	4 Å²	4	59.4 Å²	59.4	2%	0.021	29%	0.293	C	S	.	.	H	α-helix	trans	-59.7	-26.7	177	-79.5	164.2	0	0	0	112.8	L115 M121 P154 E217 M218	L115-I119 HydrophobicContact CG-CD1 4.45Å; L115-I119 WeakPolarHBondContact O-CD1 3.4Å; L115-I119 VanDerWaalsContact O-CG1 3.3Å; L115-I119 WeakPolarHBondContact O-CG1 3.15Å; L115-I119 PolarHBondContact O-N 3.32Å; I119-M121 VanDerWaalsContact C-N 3.27Å; I119-P154 HydrophobicContact CD1-CB 3.67Å; I119-P154 HydrophobicContact CD1-CG 3.45Å; I119-P154 VanDerWaalsContact CD1-CG 3.45Å; I119-E217 HydrophobicContact CD1-CG 4Å; I119-E217 HydrophobicContact CG1-CG 4.5Å; I119-E217 HydrophobicContact CG2-CG 3.69Å; I119-M218 HydrophobicContact CG1-CG 3.73Å
120	Q	88.7	Confident	92.9	Very high	143 Å²	143	60.8 Å²	60.8	67%	0.668	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-4.5	178.5	-60.2	-61	-47	0	0	112.8	Q117 V118	Q117-Q120 PolarHBondContact O-N 3.04Å; V118-Q120 PolarHBondContact O-N 3.26Å
121	M	90.1	Very high	93.1	Very high	119 Å²	119	59.2 Å²	59.2	59%	0.586	29%	0.289	S	S	*	.	S	Bend	trans	-94.9	151.7	178	-57.2	173.9	63.9	0	0	110.1	V118 I119 L123	V118-M121 WeakPolarHBondContact O-CB 3.36Å; V118-M121 PolarHBondContact O-N 3.43Å; I119-M121 VanDerWaalsContact C-N 3.27Å; M121-L123 PolarHBondContact O-N 3.34Å
122	E	86.7	Confident	93.3	Very high	193 Å²	193	58.2 Å²	58.2	90%	0.902	29%	0.285	S	S	*	.			trans	-73	117.1	166.6	-67.6	-174.7	170.8	0	0	109.4
123	L	91.3	Very high	93.6	Very high	21 Å²	21	53.6 Å²	53.6	11%	0.11	26%	0.26	C	S	.	.			trans	-107.1	131.1	177.9	-60.8	174.7	0	0	0	109.9	V118 M121 R127 M128 L131 M218	V118-L123 HydrophobicContact CG1-CD1 3.94Å; V118-L123 HydrophobicContact CG1-CD2 4.03Å; M121-L123 PolarHBondContact O-N 3.34Å; L123-R127 HydrophobicContact CD2-CB 4.38Å; L123-M128 HydrophobicContact CB-CB 4.42Å; L123-M128 HydrophobicContact CB-CE 4.37Å; L123-L131 HydrophobicContact CD1-CD1 4.36Å; L123-M218 HydrophobicContact CD1-CG 4.42Å; L123-M218 HydrophobicContact CD1-SD 3.99Å
124	D	94.7	Very high	94	Very high	60 Å²	60	52.5 Å²	52.5	32%	0.321	25%	0.25	S	S	.	.			trans	-71	169.4	164.6	57.5	38.8	0	0	0	111.2	E126 R127 M128	D124-E126 PolarHBondContact O-N 2.85Å; D124-E126 PolarHBondContact OD1-N 2.95Å; D124-R127 VanDerWaalsContact OD1-CB 3.28Å; D124-R127 WeakPolarHBondContact OD1-CB 3.47Å; D124-R127 VanDerWaalsContact OD1-CG 3.29Å; D124-R127 WeakPolarHBondContact OD1-CG 3.39Å; D124-R127 PolarHBondContact OD1-N 2.65Å; D124-R127 IonicContact OD2-NE 2.64Å; D124-R127 IonicContact OD2-NH1 3.44Å; D124-M128 VanDerWaalsContact O-CB 3.31Å; D124-M128 WeakPolarHBondContact O-CB 3.43Å; D124-M128 PolarHBondContact O-N 2.98Å
125	H	96.1	Very high	94.4	Very high	7 Å²	7	50 Å²	50	3%	0.032	24%	0.237	C	C	.	.	H	α-helix	trans	-62.9	-31.7	178.7	-73.9	-63.8	0	0	0	112.9	S129 F280 N287 K290 A291 Y320	H125-S129 WeakPolarHBondContact O-CB 3.42Å; H125-S129 PolarHBondContact O-N 3.43Å; H125-S129 PolarHBondContact O-OG 3.16Å; H125-F280 AromaticContact CE1-CD1 3.74Å; H125-N287 PolarHBondContact NE2-O 3.02Å; H125-K290 HydrophobicContact CB-CB 4Å; H125-K290 HydrophobicContact CB-CG 4.28Å; H125-K290 VanDerWaalsContact CD2-CB 3.46Å; H125-K290 WeakPolarHBondContact CD2-CB 3.34Å; H125-A291 PolarHBondContact CE1-N 3.06Å; H125-Y320 HydrophobicContact CB-CE2 4.23Å; H125-Y320 AromaticContact ND1-CE2 3.49Å; H125-Y320 WeakPolarHBondContact ND1-CE2 3.36Å; H125-Y320 AromaticContact ND1-CZ 3.63Å; H125-Y320 PolarHBondContact ND1-OH 2.78Å
126	E	96.4	Very high	94.7	Very high	127 Å²	127	50 Å²	50	59%	0.593	24%	0.237	S	C	*	.	H	α-helix	trans	-65.1	-55.9	-178.4	-166.3	179.4	159.6	0	0	110.3	D124 M128 S129 Y130 W324	D124-E126 PolarHBondContact O-N 2.85Å; D124-E126 PolarHBondContact OD1-N 2.95Å; E126-M128 PolarHBondContact O-N 2.94Å; E126-S129 PolarHBondContact O-N 3.41Å; E126-S129 PolarHBondContact O-OG 3.09Å; E126-Y130 VanDerWaalsContact O-CB 3.3Å; E126-Y130 WeakPolarHBondContact O-CB 2.88Å; E126-Y130 PolarHBondContact O-N 3.37Å; E126-W324 HydrophobicContact CB-CZ2 4.46Å; E126-W324 HydrophobicContact CG-CH2 3.58Å; E126-W324 HydrophobicContact CG-CZ2 3.42Å; E126-W324 VanDerWaalsContact CG-CZ2 3.42Å
127	R	96.5	Very high	95	Very high	125 Å²	125	47.5 Å²	47.5	47%	0.472	22%	0.22	S	C	.	.	H	α-helix	trans	-62.2	-44.9	177.8	-69.2	169.1	171.7	160.8	0.6	111.7	L123 D124 Y130 L131	L123-R127 HydrophobicContact CD2-CB 4.38Å; D124-R127 VanDerWaalsContact OD1-CB 3.28Å; D124-R127 WeakPolarHBondContact OD1-CB 3.47Å; D124-R127 VanDerWaalsContact OD1-CG 3.29Å; D124-R127 WeakPolarHBondContact OD1-CG 3.39Å; D124-R127 PolarHBondContact OD1-N 2.65Å; D124-R127 IonicContact OD2-NE 2.64Å; D124-R127 IonicContact OD2-NH1 3.44Å; R127-Y130 PolarHBondContact O-N 2.68Å; R127-L131 WeakPolarHBondContact O-CB 3.45Å; R127-L131 VanDerWaalsContact O-CG 3.26Å; R127-L131 WeakPolarHBondContact O-CG 3.31Å; R127-L131 PolarHBondContact O-N 3.38Å
128	M	97.4	Very high	95.3	Very high	7 Å²	7	42.2 Å²	42.2	3%	0.034	20%	0.195	C	C	.	.	H	α-helix	trans	-62.4	-47.8	179.9	-173.5	-172.7	-62.3	0	0	111.7	L123 D124 E126 Y130 L131 L132 M218 I219	L123-M128 HydrophobicContact CB-CB 4.42Å; L123-M128 HydrophobicContact CB-CE 4.37Å; D124-M128 VanDerWaalsContact O-CB 3.31Å; D124-M128 WeakPolarHBondContact O-CB 3.43Å; D124-M128 PolarHBondContact O-N 2.98Å; E126-M128 PolarHBondContact O-N 2.94Å; M128-Y130 VanDerWaalsContact C-N 3.34Å; M128-Y130 PolarHBondContact O-N 3.46Å; M128-L131 PolarHBondContact O-N 3.4Å; M128-L132 HydrophobicContact CG-CD1 4.1Å; M128-L132 WeakPolarHBondContact O-CD1 3.22Å; M128-L132 VanDerWaalsContact O-CG 3.3Å; M128-L132 WeakPolarHBondContact O-CG 3.49Å; M128-L132 PolarHBondContact O-N 3.46Å; M128-M218 HydrophobicContact CE-CB 4.33Å; M128-M218 HydrophobicContact CG-SD 4.1Å; M128-I219 HydrophobicContact CE-CG1 3.71Å; M128-I219 HydrophobicContact SD-CD1 4.08Å; M128-I219 HydrophobicContact SD-CG1 3.76Å
129	S	98.3	Very high	95.6	Very high	3 Å²	3	41.6 Å²	41.6	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-66.5	-35.3	178.6	60.3	0	0	0	0	112.4	H125 E126 L132 Y133 Y320 W324	H125-S129 WeakPolarHBondContact O-CB 3.42Å; H125-S129 PolarHBondContact O-N 3.43Å; H125-S129 PolarHBondContact O-OG 3.16Å; E126-S129 PolarHBondContact O-N 3.41Å; E126-S129 PolarHBondContact O-OG 3.09Å; S129-L132 PolarHBondContact O-N 3.24Å; S129-Y133 WeakPolarHBondContact O-CB 3.48Å; S129-Y133 PolarHBondContact O-N 3.48Å; S129-Y320 WeakPolarHBondContact CB-O 3.49Å; S129-W324 PolarHBondContact OG-NE1 3.33Å
130	Y	98.5	Very high	95.8	Very high	56 Å²	56	43.7 Å²	43.7	22%	0.22	20%	0.2	C	C	.	.	H	α-helix	trans	-69.5	-39.6	177.1	-173.6	-127.7	0	0	0	112.6	E126 R127 M128 Y133 Q134 C163 W324	E126-Y130 VanDerWaalsContact O-CB 3.3Å; E126-Y130 WeakPolarHBondContact O-CB 2.88Å; E126-Y130 PolarHBondContact O-N 3.37Å; R127-Y130 PolarHBondContact O-N 2.68Å; M128-Y130 VanDerWaalsContact C-N 3.34Å; M128-Y130 PolarHBondContact O-N 3.46Å; Y130-Y133 HydrophobicContact CD2-CD1 4.11Å; Y130-Y133 HydrophobicContact CE2-CD1 4.15Å; Y130-Y133 PolarHBondContact O-N 3.36Å; Y130-Q134 VanDerWaalsContact CD1-NE2 3.27Å; Y130-Q134 HydrophobicContact CD2-CG 4.48Å; Y130-Q134 HydrophobicContact CE2-CG 4.16Å; Y130-Q134 WeakPolarHBondContact O-CB 3.07Å; Y130-Q134 VanDerWaalsContact O-CG 3.31Å; Y130-Q134 WeakPolarHBondContact O-CG 3.29Å; Y130-Q134 PolarHBondContact O-N 3.07Å; Y130-Q134 PolarHBondContact O-NE2 2.88Å; Y130-C163 HydrophobicContact CD1-CB 4.17Å; Y130-C163 HydrophobicContact CE1-CB 4.41Å; Y130-W324 HydrophobicContact CD2-CB 4.44Å; Y130-W324 AromaticContact CD2-CD2 3.69Å; Y130-W324 HydrophobicContact CD2-CD2 3.69Å; Y130-W324 AromaticContact CD2-CE3 3.84Å; Y130-W324 HydrophobicContact CD2-CE3 3.84Å; Y130-W324 AromaticContact CD2-CG 3.96Å; Y130-W324 HydrophobicContact CD2-CG 3.96Å; Y130-W324 HydrophobicContact CD2-CZ3 4.37Å; Y130-W324 HydrophobicContact CE2-CE3 4.34Å; Y130-W324 HydrophobicContact CG-CD2 4.34Å; Y130-W324 HydrophobicContact CG-CZ2 4.5Å
131	L	98.4	Very high	96	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.021	17%	0.17	C	C	.	.	H	α-helix	trans	-63.1	-43	172.1	-68.9	170.5	0	0	0	111.1	L115 V118 L123 R127 M128 Q134 M135 V159 L165	L115-L131 HydrophobicContact CD1-CD1 4.38Å; V118-L131 HydrophobicContact CG1-CD1 3.95Å; L123-L131 HydrophobicContact CD1-CD1 4.36Å; R127-L131 WeakPolarHBondContact O-CB 3.45Å; R127-L131 VanDerWaalsContact O-CG 3.26Å; R127-L131 WeakPolarHBondContact O-CG 3.31Å; R127-L131 PolarHBondContact O-N 3.38Å; M128-L131 PolarHBondContact O-N 3.4Å; L131-Q134 PolarHBondContact O-N 3.27Å; L131-M135 WeakPolarHBondContact O-CG 3.19Å; L131-M135 PolarHBondContact O-N 3.05Å; L131-V159 HydrophobicContact CD2-CG1 3.92Å; L131-L165 HydrophobicContact CB-CD1 4.23Å; L131-L165 HydrophobicContact CD2-CB 4.15Å; L131-L165 HydrophobicContact CD2-CD1 3.86Å
132	L	98.6	Very high	96.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62	-45.6	175.3	-72.9	162	0	0	0	112.2	M128 S129 Q134 M135 L136 V211 M215 Y320 I321	M128-L132 HydrophobicContact CG-CD1 4.1Å; M128-L132 WeakPolarHBondContact O-CD1 3.22Å; M128-L132 VanDerWaalsContact O-CG 3.3Å; M128-L132 WeakPolarHBondContact O-CG 3.49Å; M128-L132 PolarHBondContact O-N 3.46Å; S129-L132 PolarHBondContact O-N 3.24Å; L132-Q134 PolarHBondContact O-N 2.76Å; L132-M135 HydrophobicContact CB-CE 4.31Å; L132-M135 HydrophobicContact CD2-CE 3.36Å; L132-M135 HydrophobicContact CG-CE 3.96Å; L132-M135 PolarHBondContact O-N 2.85Å; L132-L136 VanDerWaalsContact O-CG 3.26Å; L132-L136 WeakPolarHBondContact O-CG 3.33Å; L132-L136 PolarHBondContact O-N 3.03Å; L132-V211 HydrophobicContact CD2-CG1 3.73Å; L132-M215 HydrophobicContact CD1-CB 4.42Å; L132-M215 HydrophobicContact CD1-CE 3.97Å; L132-M215 HydrophobicContact CD1-CG 3.85Å; L132-M215 HydrophobicContact CD1-SD 3.63Å; L132-M215 HydrophobicContact CD2-CB 3.83Å; L132-M215 HydrophobicContact CD2-CG 4.17Å; L132-M215 HydrophobicContact CD2-SD 4.25Å; L132-Y320 HydrophobicContact CD1-CD1 4.4Å; L132-Y320 HydrophobicContact CD1-CE1 3.98Å; L132-I321 HydrophobicContact CB-CD1 3.6Å; L132-I321 HydrophobicContact CD1-CD1 4.27Å
133	Y	98.8	Very high	96.3	Very high	1 Å²	1	23.5 Å²	23.5	0%	0.004	11%	0.105	C	C	.	.	H	α-helix	trans	-55.2	-49.8	175.4	169.1	-108.6	0	0	0	111.7	S129 Y130 M135 L136 C137 L316 I321 W324 D326 E329 V330	S129-Y133 WeakPolarHBondContact O-CB 3.48Å; S129-Y133 PolarHBondContact O-N 3.48Å; Y130-Y133 HydrophobicContact CD2-CD1 4.11Å; Y130-Y133 HydrophobicContact CE2-CD1 4.15Å; Y130-Y133 PolarHBondContact O-N 3.36Å; Y133-M135 PolarHBondContact O-N 3.28Å; Y133-L136 PolarHBondContact O-N 3.02Å; Y133-L136 VanDerWaalsContact O-N 3.16Å; Y133-C137 WeakPolarHBondContact CE2-SG 3.43Å; Y133-C137 PolarHBondContact O-N 2.94Å; Y133-C137 PolarHBondContact O-SG 3.34Å; Y133-L316 HydrophobicContact CD2-CD2 3.81Å; Y133-L316 HydrophobicContact CE2-CD2 3.96Å; Y133-I321 HydrophobicContact CD2-CG2 3.93Å; Y133-I321 HydrophobicContact CG-CG2 4.45Å; Y133-W324 HydrophobicContact CD1-CB 3.54Å; Y133-W324 HydrophobicContact CD1-CG 4.33Å; Y133-W324 HydrophobicContact CD2-CB 3.84Å; Y133-W324 HydrophobicContact CE1-CB 3.95Å; Y133-W324 WeakPolarHBondContact CE1-O 3.4Å; Y133-W324 HydrophobicContact CE2-CB 4.24Å; Y133-W324 WeakPolarHBondContact CE2-O 3.45Å; Y133-W324 HydrophobicContact CG-CB 3.48Å; Y133-W324 VanDerWaalsContact CG-CB 3.48Å; Y133-W324 HydrophobicContact CG-CG 4.24Å; Y133-W324 PolarHBondContact OH-O 2.8Å; Y133-D326 PolarHBondContact OH-N 2.95Å; Y133-D326 VanDerWaalsContact OH-N 3.12Å; Y133-E329 VanDerWaalsContact CE1-OE2 3.3Å; Y133-E329 WeakPolarHBondContact CE1-OE2 3.34Å; Y133-E329 PolarHBondContact OH-OE2 3.33Å; Y133-V330 HydrophobicContact CE2-CG2 3.96Å
134	Q	98.7	Very high	96.3	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.009	12%	0.12	C	C	.	.	H	α-helix	trans	-63.5	-39.7	178.9	-73.9	178.7	87.5	0	0	112.9	N84 Y130 L131 L132 C137 G138 C163 L165	N84-Q134 VanDerWaalsContact CB-O 3.27Å; N84-Q134 WeakPolarHBondContact CB-O 3.24Å; N84-Q134 WeakPolarHBondContact ND2-CB 3.35Å; N84-Q134 WeakPolarHBondContact ND2-CG 3.22Å; N84-Q134 PolarHBondContact ND2-OE1 3.28Å; N84-Q134 VanDerWaalsContact ND2-OE1 3.16Å; Y130-Q134 VanDerWaalsContact CD1-NE2 3.27Å; Y130-Q134 HydrophobicContact CD2-CG 4.48Å; Y130-Q134 HydrophobicContact CE2-CG 4.16Å; Y130-Q134 WeakPolarHBondContact O-CB 3.07Å; Y130-Q134 VanDerWaalsContact O-CG 3.31Å; Y130-Q134 WeakPolarHBondContact O-CG 3.29Å; Y130-Q134 PolarHBondContact O-N 3.07Å; Y130-Q134 PolarHBondContact O-NE2 2.88Å; L131-Q134 PolarHBondContact O-N 3.27Å; L132-Q134 PolarHBondContact O-N 2.76Å; Q134-C137 PolarHBondContact O-N 3.38Å; Q134-G138 PolarHBondContact O-N 2.89Å; Q134-C163 PolarHBondContact NE2-O 2.83Å; Q134-L165 HydrophobicContact CB-CB 3.98Å; Q134-L165 HydrophobicContact CB-CD2 4.35Å
135	M	98.4	Very high	95.8	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-60.1	-46.5	172.3	-72.6	-173.8	-61.6	0	0	111	L115 L131 L132 Y133 C137 G138 I139 I157 L165 V211 I214 M218	L115-M135 HydrophobicContact CD2-SD 4.23Å; L131-M135 WeakPolarHBondContact O-CG 3.19Å; L131-M135 PolarHBondContact O-N 3.05Å; L132-M135 HydrophobicContact CB-CE 4.31Å; L132-M135 HydrophobicContact CD2-CE 3.36Å; L132-M135 HydrophobicContact CG-CE 3.96Å; L132-M135 PolarHBondContact O-N 2.85Å; Y133-M135 PolarHBondContact O-N 3.28Å; M135-C137 PolarHBondContact O-N 2.86Å; M135-G138 PolarHBondContact O-N 2.91Å; M135-I139 WeakPolarHBondContact O-CB 3.28Å; M135-I139 WeakPolarHBondContact O-CD1 3.18Å; M135-I139 WeakPolarHBondContact O-CG1 3.4Å; M135-I139 PolarHBondContact O-N 3.45Å; M135-I157 HydrophobicContact CG-CD1 4.5Å; M135-I157 HydrophobicContact SD-CD1 3.68Å; M135-L165 HydrophobicContact CB-CD2 4.48Å; M135-L165 HydrophobicContact CG-CD1 3.53Å; M135-L165 HydrophobicContact CG-CD2 3.64Å; M135-L165 HydrophobicContact CG-CG 4.27Å; M135-L165 HydrophobicContact SD-CD1 4.23Å; M135-V211 HydrophobicContact CE-CG1 4.33Å; M135-I214 HydrophobicContact CE-CG2 4.31Å; M135-I214 HydrophobicContact SD-CG2 4.29Å; M135-M218 HydrophobicContact CE-CE 3.9Å
136	L	98.6	Very high	95.2	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-64.2	-38.7	179.8	-67.8	170.3	0	0	0	112.2	L132 Y133 I139 K140 M208 M301 V312 A315 L316 I321	L132-L136 VanDerWaalsContact O-CG 3.26Å; L132-L136 WeakPolarHBondContact O-CG 3.33Å; L132-L136 PolarHBondContact O-N 3.03Å; Y133-L136 PolarHBondContact O-N 3.02Å; Y133-L136 VanDerWaalsContact O-N 3.16Å; L136-I139 PolarHBondContact O-N 3.36Å; L136-K140 WeakPolarHBondContact O-CB 3.21Å; L136-K140 PolarHBondContact O-N 2.9Å; L136-M208 HydrophobicContact CD2-CE 3.57Å; L136-M208 HydrophobicContact CD2-SD 3.66Å; L136-M301 HydrophobicContact CD1-CE 4.45Å; L136-M301 HydrophobicContact CD2-CE 4.38Å; L136-V312 HydrophobicContact CD2-CG1 4.39Å; L136-A315 HydrophobicContact CD1-CB 3.99Å; L136-A315 HydrophobicContact CD2-CB 4.21Å; L136-L316 HydrophobicContact CB-CD2 3.6Å; L136-L316 HydrophobicContact CB-CG 3.95Å; L136-L316 HydrophobicContact CD1-CD2 4.32Å; L136-L316 HydrophobicContact CD1-CG 4.46Å; L136-I321 HydrophobicContact CD1-CG1 4.24Å; L136-I321 HydrophobicContact CD1-CG2 4.04Å
137	C	98.1	Very high	94.7	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-63.1	-46.9	174.2	-64.9	0	0	0	0	111.6	Y133 Q134 M135 I139 K140 H141	Y133-C137 WeakPolarHBondContact CE2-SG 3.43Å; Y133-C137 PolarHBondContact O-N 2.94Å; Y133-C137 PolarHBondContact O-SG 3.34Å; Q134-C137 PolarHBondContact O-N 3.38Å; M135-C137 PolarHBondContact O-N 2.86Å; C137-I139 VanDerWaalsContact C-N 3.34Å; C137-I139 PolarHBondContact O-N 3.28Å; C137-K140 PolarHBondContact O-N 2.94Å; C137-H141 WeakPolarHBondContact O-CB 3.3Å; C137-H141 PolarHBondContact O-N 3.47Å
138	G	96.2	Very high	94.4	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-59.3	-43.8	174.9	0	0	0	0	0	112.6	Q134 M135 H141 L142	Q134-G138 PolarHBondContact O-N 2.89Å; M135-G138 PolarHBondContact O-N 2.91Å; G138-H141 PolarHBondContact O-N 2.9Å; G138-L142 WeakPolarHBondContact O-CG 3.26Å; G138-L142 PolarHBondContact O-N 3.43Å; G138-L142 VanDerWaalsContact O-N 3.09Å
139	I	95.8	Very high	94	Very high	1 Å²	1	11 Å²	11	1%	0.005	6%	0.061	C	C	.	.	H	α-helix	trans	-64	-46.4	177.5	-68.7	164.6	0	0	0	111.1	M135 L136 C137 H141 L142 H143 L152 I167 D207 V211 V312	M135-I139 WeakPolarHBondContact O-CB 3.28Å; M135-I139 WeakPolarHBondContact O-CD1 3.18Å; M135-I139 WeakPolarHBondContact O-CG1 3.4Å; M135-I139 PolarHBondContact O-N 3.45Å; L136-I139 PolarHBondContact O-N 3.36Å; C137-I139 VanDerWaalsContact C-N 3.34Å; C137-I139 PolarHBondContact O-N 3.28Å; I139-H141 VanDerWaalsContact C-N 3.29Å; I139-H141 PolarHBondContact O-N 2.7Å; I139-L142 WeakPolarHBondContact O-CB 3.49Å; I139-L142 PolarHBondContact O-N 3.32Å; I139-L142 VanDerWaalsContact O-N 3.16Å; I139-H143 WeakPolarHBondContact CG2-CE1 3.46Å; I139-H143 WeakPolarHBondContact CG2-NE2 3.28Å; I139-H143 PolarHBondContact O-CD2 3.45Å; I139-H143 VanDerWaalsContact O-CG 3.31Å; I139-H143 PolarHBondContact O-N 3.37Å; I139-L152 HydrophobicContact CD1-CD1 3.47Å; I139-L152 VanDerWaalsContact CD1-CD1 3.47Å; I139-L152 HydrophobicContact CG1-CD1 3.84Å; I139-I167 HydrophobicContact CG1-CD1 3.97Å; I139-D207 HydrophobicContact CG2-CB 4.1Å; I139-V211 HydrophobicContact CD1-CG2 3.37Å; I139-V312 HydrophobicContact CG2-CG2 3.85Å
140	K	95.7	Very high	93.4	Very high	47 Å²	47	11.3 Å²	11.3	20%	0.204	6%	0.062	C	C	.	.	H	α-helix	trans	-58.3	-43.6	177.4	-176.1	176.5	167.5	68.2	0	111.4	L136 C137 L142 H143 S144 V312 D313 L316 V330	L136-K140 WeakPolarHBondContact O-CB 3.21Å; L136-K140 PolarHBondContact O-N 2.9Å; C137-K140 PolarHBondContact O-N 2.94Å; K140-L142 VanDerWaalsContact C-N 3.35Å; K140-L142 PolarHBondContact O-N 2.92Å; K140-H143 PolarHBondContact O-N 3.39Å; K140-S144 WeakPolarHBondContact O-CB 3.41Å; K140-S144 PolarHBondContact O-N 3.44Å; K140-V312 HydrophobicContact CB-CG1 3.82Å; K140-D313 IonicContact NZ-OD1 3.91Å; K140-D313 PolarHBondContact NZ-OD1 3.31Å; K140-D313 IonicContact NZ-OD2 3.38Å; K140-L316 HydrophobicContact CB-CD1 4.48Å; K140-L316 HydrophobicContact CD-CD1 3.71Å; K140-V330 HydrophobicContact CD-CG1 3.62Å; K140-V330 VanDerWaalsContact CD-O 3.23Å; K140-V330 WeakPolarHBondContact CD-O 3.47Å; K140-V330 WeakPolarHBondContact CE-O 3.35Å
141	H	93.4	Very high	92.7	Very high	6 Å²	6	9 Å²	9	3%	0.028	5%	0.053	C	C	.	.	H	α-helix	trans	-62.7	-41	178	-170.9	86.7	0	0	0	111.7	N81 H82 I85 C137 G138 I139 S144 A145 A332 P333	N81-H141 PolarHBondContact O-CE1 2.98Å; N81-H141 PolarHBondContact O-NE2 3.32Å; H82-H141 HydrophobicContact CB-CB 4.22Å; H82-H141 VanDerWaalsContact CB-CD2 3.49Å; H82-H141 WeakPolarHBondContact CB-CD2 3.36Å; H82-H141 AromaticContact CD2-CG 3.91Å; H82-H141 AromaticContact CD2-ND1 3.79Å; H82-H141 AromaticContact CG-CG 3.81Å; I85-H141 HydrophobicContact CD1-CB 4.24Å; C137-H141 WeakPolarHBondContact O-CB 3.3Å; C137-H141 PolarHBondContact O-N 3.47Å; G138-H141 PolarHBondContact O-N 2.9Å; I139-H141 VanDerWaalsContact C-N 3.29Å; I139-H141 PolarHBondContact O-N 2.7Å; H141-S144 PolarHBondContact O-N 3.08Å; H141-S144 PolarHBondContact O-OG 2.88Å; H141-A145 PolarHBondContact O-N 2.91Å; H141-A332 PolarHBondContact ND1-O 2.97Å; H141-P333 PolarHBondContact CE1-O 3.29Å
142	L	90.7	Very high	92.4	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-62.3	-47.2	172.1	-66.8	170	0	0	0	112.2	V80 I85 G138 I139 K140 S144 A145 G146 I147 H149 F170	V80-L142 HydrophobicContact CG1-CD2 4.35Å; V80-L142 HydrophobicContact CG2-CD2 4.24Å; I85-L142 HydrophobicContact CD1-CD1 4.45Å; I85-L142 HydrophobicContact CD1-CD2 3.76Å; I85-L142 HydrophobicContact CD1-CG 3.71Å; G138-L142 WeakPolarHBondContact O-CG 3.26Å; G138-L142 PolarHBondContact O-N 3.43Å; G138-L142 VanDerWaalsContact O-N 3.09Å; I139-L142 WeakPolarHBondContact O-CB 3.49Å; I139-L142 PolarHBondContact O-N 3.32Å; I139-L142 VanDerWaalsContact O-N 3.16Å; K140-L142 VanDerWaalsContact C-N 3.35Å; K140-L142 PolarHBondContact O-N 2.92Å; L142-S144 VanDerWaalsContact C-N 3.28Å; L142-S144 PolarHBondContact O-N 3.37Å; L142-A145 WeakPolarHBondContact O-CA 3.49Å; L142-A145 WeakPolarHBondContact O-CB 3.46Å; L142-A145 PolarHBondContact O-N 2.79Å; L142-G146 PolarHBondContact O-N 2.97Å; L142-I147 CarbonylContact C-O 3.53Å; L142-I147 HydrophobicContact CB-CB 4.3Å; L142-I147 WeakPolarHBondContact CB-O 3.4Å; L142-I147 HydrophobicContact CD2-CB 4.49Å; L142-I147 HydrophobicContact CD2-CD1 4.33Å; L142-I147 HydrophobicContact CD2-CG2 4.32Å; L142-I147 WeakPolarHBondContact O-CB 3.46Å; L142-I147 PolarHBondContact O-N 2.81Å; L142-H149 HydrophobicContact CD1-CB 4.44Å; L142-F170 HydrophobicContact CD1-CD1 4.37Å; L142-F170 HydrophobicContact CD1-CE1 3.74Å; L142-F170 HydrophobicContact CD2-CD1 4.03Å; L142-F170 HydrophobicContact CD2-CE1 3.54Å; L142-F170 HydrophobicContact CD2-CZ 4.2Å; L142-F170 HydrophobicContact CG-CE1 4.26Å
143	H	91.9	Very high	92.1	Very high	26 Å²	26	9.6 Å²	9.6	12%	0.12	6%	0.056	C	C	.	.	H	α-helix	trans	-62.5	-36.6	-179.5	-68.4	179	0	0	0	111.7	I139 K140 A145 G146 I147 E204 D207	I139-H143 WeakPolarHBondContact CG2-CE1 3.46Å; I139-H143 WeakPolarHBondContact CG2-NE2 3.28Å; I139-H143 PolarHBondContact O-CD2 3.45Å; I139-H143 VanDerWaalsContact O-CG 3.31Å; I139-H143 PolarHBondContact O-N 3.37Å; K140-H143 PolarHBondContact O-N 3.39Å; H143-A145 PolarHBondContact O-N 2.9Å; H143-G146 WeakPolarHBondContact O-CA 3.35Å; H143-G146 PolarHBondContact O-N 3.35Å; H143-I147 PolarHBondContact CD2-O 2.78Å; H143-I147 VanDerWaalsContact CD2-O 3.31Å; H143-I147 PolarHBondContact N-O 3.25Å; H143-E204 HydrophobicContact CB-CG 4.27Å; H143-E204 PolarHBondContact CE1-O 3.13Å; H143-E204 PolarHBondContact NE2-O 3.01Å; H143-D207 IonicContact CD2-OD2 3.25Å; H143-D207 IonicContact CE1-OD2 3.42Å; H143-D207 IonicContact NE2-OD2 2.7Å; H143-D207 PolarHBondContact NE2-OD2 2.8Å
144	S	90.2	Very high	91.9	Very high	60 Å²	60	9.6 Å²	9.6	42%	0.42	6%	0.056	S	C	.	.	H	α-helix	trans	-63.7	-25.3	174.9	77	0	0	0	0	113.4	K140 H141 L142 G146 P334	K140-S144 WeakPolarHBondContact O-CB 3.41Å; K140-S144 PolarHBondContact O-N 3.44Å; H141-S144 PolarHBondContact O-N 3.08Å; H141-S144 PolarHBondContact O-OG 2.88Å; L142-S144 VanDerWaalsContact C-N 3.28Å; L142-S144 PolarHBondContact O-N 3.37Å; S144-G146 VanDerWaalsContact C-N 3.29Å; S144-P334 WeakPolarHBondContact OG-CB 3.4Å
145	A	84.8	Confident	91.4	Very high	5 Å²	5	12 Å²	12	4%	0.041	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	1.8	172.2	0	0	0	0	0	113.3	H141 L142 H143 I147 P335	H141-A145 PolarHBondContact O-N 2.91Å; L142-A145 WeakPolarHBondContact O-CA 3.49Å; L142-A145 WeakPolarHBondContact O-CB 3.46Å; L142-A145 PolarHBondContact O-N 2.79Å; H143-A145 PolarHBondContact O-N 2.9Å; A145-I147 VanDerWaalsContact C-N 3.31Å; A145-I147 HydrophobicContact CB-CD1 3.69Å; A145-I147 HydrophobicContact CB-CG1 4.04Å; A145-P335 HydrophobicContact CB-CG 3.48Å; A145-P335 VanDerWaalsContact CB-CG 3.48Å
146	G	84.7	Confident	91.1	Very high	17 Å²	17	12.7 Å²	12.7	18%	0.175	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.2	13.3	-173.8	0	0	0	0	0	114.3	L142 H143 S144 T175 A176	L142-G146 PolarHBondContact O-N 2.97Å; H143-G146 WeakPolarHBondContact O-CA 3.35Å; H143-G146 PolarHBondContact O-N 3.35Å; S144-G146 VanDerWaalsContact C-N 3.29Å; G146-T175 CarbonylContact O-C 3.47Å; G146-T175 VanDerWaalsContact O-CA 3.24Å; G146-T175 WeakPolarHBondContact O-CA 3.45Å; G146-A176 PolarHBondContact O-N 3.46Å
147	I	85.8	Confident	90.9	Very high	3 Å²	3	12.7 Å²	12.7	2%	0.015	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	119.4	-176.4	-56.7	160.2	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 3.97Å; V80-I147 HydrophobicContact CG2-CD1 4.04Å; L142-I147 CarbonylContact C-O 3.53Å; L142-I147 HydrophobicContact CB-CB 4.3Å; L142-I147 WeakPolarHBondContact CB-O 3.4Å; L142-I147 HydrophobicContact CD2-CB 4.49Å; L142-I147 HydrophobicContact CD2-CD1 4.33Å; L142-I147 HydrophobicContact CD2-CG2 4.32Å; L142-I147 WeakPolarHBondContact O-CB 3.46Å; L142-I147 PolarHBondContact O-N 2.81Å; H143-I147 PolarHBondContact CD2-O 2.78Å; H143-I147 VanDerWaalsContact CD2-O 3.31Å; H143-I147 PolarHBondContact N-O 3.25Å; A145-I147 VanDerWaalsContact C-N 3.31Å; A145-I147 HydrophobicContact CB-CD1 3.69Å; A145-I147 HydrophobicContact CB-CG1 4.04Å; I147-A173 HydrophobicContact CG2-CB 3.65Å; I147-Y338 HydrophobicContact CG1-CG 4.45Å
148	I	89.3	Confident	90.7	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	131.1	171.5	-54.3	178.4	0	0	0	108.6	R150 A173 R174 A176 Y202 E204 V206 D207	I148-R150 HydrophobicContact CB-CG 4.24Å; I148-R150 HydrophobicContact CG2-CG 3.63Å; I148-A173 CarbonylContact O-C 3.54Å; I148-A173 WeakPolarHBondContact O-CA 3.34Å; I148-A173 WeakPolarHBondContact O-CB 3.41Å; I148-R174 PolarHBondContact N-O 2.9Å; I148-R174 PolarHBondContact O-N 2.67Å; I148-A176 HydrophobicContact CD1-CB 3.85Å; I148-A176 HydrophobicContact CG1-CB 4.24Å; I148-Y202 HydrophobicContact CD1-CD2 4.24Å; I148-Y202 HydrophobicContact CD1-CE2 4.19Å; I148-E204 HydrophobicContact CD1-CG 4.41Å; I148-E204 HydrophobicContact CG1-CG 4.4Å; I148-V206 HydrophobicContact CG2-CG1 3.3Å; I148-D207 WeakPolarHBondContact CG2-OD2 3.23Å
149	H	89	Confident	90.7	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.084	C	C	.	.			trans	-74.9	-51.2	-170.9	-170.5	-75.3	0	0	0	113	L142 D151 L152 L168 D169 A173 D207	L142-H149 HydrophobicContact CD1-CB 4.44Å; H149-D151 VanDerWaalsContact CE1-C 3.44Å; H149-D151 PolarHBondContact CE1-O 3.46Å; H149-D151 VanDerWaalsContact ND1-C 3.29Å; H149-D151 PolarHBondContact ND1-N 2.95Å; H149-D151 PolarHBondContact O-N 3.02Å; H149-L152 HydrophobicContact CB-CD1 4.48Å; H149-L152 HydrophobicContact CB-CD2 4.37Å; H149-L152 HydrophobicContact CB-CG 4Å; H149-L152 PolarHBondContact ND1-N 3.38Å; H149-L152 VanDerWaalsContact ND1-N 3.15Å; H149-L168 PolarHBondContact NE2-O 2.94Å; H149-D169 PolarHBondContact NE2-O 2.87Å; H149-A173 WeakPolarHBondContact O-CA 3.26Å; H149-D207 PolarHBondContact N-OD2 2.91Å
150	R	85.3	Confident	90.6	Very high	9 Å²	9	17.4 Å²	17.4	3%	0.034	10%	0.099	C	C	.	.			trans	65.3	-12.5	175.4	-47.2	-176.4	-53	154.7	12.5	117.7	I148 L172 M182 Y202 V206 D207	I148-R150 HydrophobicContact CB-CG 4.24Å; I148-R150 HydrophobicContact CG2-CG 3.63Å; R150-L172 PolarHBondContact NE-O 3.44Å; R150-L172 VanDerWaalsContact NE-O 3.14Å; R150-L172 PolarHBondContact NH2-O 2.84Å; R150-M182 HydrophobicContact CB-CE 3.86Å; R150-Y202 HydrophobicContact CG-CE2 4.25Å; R150-Y202 PolarHBondContact NH1-OH 3.34Å; R150-V206 HydrophobicContact CG-CG1 4.29Å; R150-D207 PolarHBondContact N-OD1 2.9Å
151	D	84.8	Confident	90.4	Very high	6 Å²	6	20.4 Å²	20.4	3%	0.032	13%	0.126	C	C	.	.			trans	-126.8	38.1	175.4	-159.5	53	0	0	0	112.2	H149 K153 N156 L172	H149-D151 VanDerWaalsContact CE1-C 3.44Å; H149-D151 PolarHBondContact CE1-O 3.46Å; H149-D151 VanDerWaalsContact ND1-C 3.29Å; H149-D151 PolarHBondContact ND1-N 2.95Å; H149-D151 PolarHBondContact O-N 3.02Å; D151-K153 PolarHBondContact O-N 2.92Å; D151-K153 IonicContact OD1-NZ 3.4Å; D151-K153 IonicContact OD2-NZ 3.97Å; D151-K153 PolarHBondContact OD2-NZ 3.47Å; D151-N156 PolarHBondContact O-ND2 2.9Å; D151-L172 HydrophobicContact CB-CB 4Å; D151-L172 HydrophobicContact CB-CD1 3.76Å; D151-L172 HydrophobicContact CB-CG 4.46Å
152	L	92.3	Very high	90.4	Very high	4 Å²	4	24.8 Å²	24.8	2%	0.021	15%	0.15	C	C	.	.			trans	-67.7	127.3	173.1	-75.8	174.2	0	0	0	109.4	I139 H149 I167 Y191 D207 V211	I139-L152 HydrophobicContact CD1-CD1 3.47Å; I139-L152 VanDerWaalsContact CD1-CD1 3.47Å; I139-L152 HydrophobicContact CG1-CD1 3.84Å; H149-L152 HydrophobicContact CB-CD1 4.48Å; H149-L152 HydrophobicContact CB-CD2 4.37Å; H149-L152 HydrophobicContact CB-CG 4Å; H149-L152 PolarHBondContact ND1-N 3.38Å; H149-L152 VanDerWaalsContact ND1-N 3.15Å; L152-I167 HydrophobicContact CD2-CD1 4.38Å; L152-I167 HydrophobicContact CD2-CG2 3.83Å; L152-Y191 WeakPolarHBondContact O-CB 3.44Å; L152-D207 HydrophobicContact CD1-CB 3.79Å; L152-V211 HydrophobicContact CD1-CG2 4.37Å
153	K	91.9	Very high	90.6	Very high	14 Å²	14	26.4 Å²	26.4	6%	0.061	16%	0.161	C	C	.	.			trans	-159.7	159.6	178.9	62.9	-168.7	179.4	-143.3	0	109.2	D151 S155 N156 Y191	D151-K153 PolarHBondContact O-N 2.92Å; D151-K153 IonicContact OD1-NZ 3.4Å; D151-K153 IonicContact OD2-NZ 3.97Å; D151-K153 PolarHBondContact OD2-NZ 3.47Å; K153-S155 WeakPolarHBondContact CE-OG 3.35Å; K153-S155 PolarHBondContact O-N 3.5Å; K153-S155 VanDerWaalsContact O-N 3.13Å; K153-N156 WeakPolarHBondContact CE-ND2 3.4Å; K153-N156 WeakPolarHBondContact CE-OD1 3.37Å; K153-N156 HydrophobicContact CG-CB 4.07Å; K153-N156 PolarHBondContact O-N 3.43Å; K153-Y191 HydrophobicContact CB-CD2 3.41Å; K153-Y191 VanDerWaalsContact CB-CD2 3.41Å; K153-Y191 HydrophobicContact CB-CE2 3.81Å; K153-Y191 HydrophobicContact CB-CG 3.98Å
154	P	93.7	Very high	90.8	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.006	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-56.4	-33.4	-175.6	-29.2	37.5	0	0	0	114.8	L115 C116 I119 N156 I157 Y191 I214	L115-P154 HydrophobicContact CB-CB 4Å; L115-P154 WeakPolarHBondContact CB-O 3.46Å; L115-P154 HydrophobicContact CD2-CB 4.47Å; L115-P154 PolarHBondContact N-O 3.19Å; C116-P154 HydrophobicContact CB-CB 4.49Å; I119-P154 HydrophobicContact CD1-CB 3.67Å; I119-P154 HydrophobicContact CD1-CG 3.45Å; I119-P154 VanDerWaalsContact CD1-CG 3.45Å; P154-N156 VanDerWaalsContact C-N 3.28Å; P154-N156 PolarHBondContact O-N 2.83Å; P154-I157 PolarHBondContact O-N 2.85Å; P154-Y191 VanDerWaalsContact CD-CE1 3.46Å; P154-Y191 VanDerWaalsContact CD-CE2 3.49Å; P154-Y191 WeakPolarHBondContact CD-OH 3.36Å; P154-Y191 HydrophobicContact CG-CE1 3.85Å; P154-Y191 HydrophobicContact CG-CE2 4.43Å; P154-Y191 WeakPolarHBondContact CG-OH 3.5Å; P154-I214 HydrophobicContact CG-CG1 4.12Å
155	S	89	Confident	91.1	Very high	53 Å²	53	24.3 Å²	24.3	37%	0.371	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-73.4	-16.5	178	57.6	0	0	0	0	114.8	K153	K153-S155 WeakPolarHBondContact CE-OG 3.35Å; K153-S155 PolarHBondContact O-N 3.5Å; K153-S155 VanDerWaalsContact O-N 3.13Å
156	N	91.4	Very high	91.7	Very high	14 Å²	14	25 Å²	25	8%	0.075	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-97.4	12.1	174.4	-74.9	1.8	0	0	0	111.9	D151 K153 P154 L168 D169	D151-N156 PolarHBondContact O-ND2 2.9Å; K153-N156 WeakPolarHBondContact CE-ND2 3.4Å; K153-N156 WeakPolarHBondContact CE-OD1 3.37Å; K153-N156 HydrophobicContact CG-CB 4.07Å; K153-N156 PolarHBondContact O-N 3.43Å; P154-N156 VanDerWaalsContact C-N 3.28Å; P154-N156 PolarHBondContact O-N 2.83Å; N156-L168 WeakPolarHBondContact O-CB 3.41Å; N156-L168 PolarHBondContact O-N 2.76Å; N156-D169 PolarHBondContact ND2-OD2 3.18Å
157	I	94.4	Very high	92.2	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.005	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	125.2	178.3	-63.2	162.6	0	0	0	107.2	N114 L115 M135 P154 L165 I214	N114-I157 CarbonylContact C-O 3.13Å; N114-I157 VanDerWaalsContact CA-O 3.29Å; N114-I157 WeakPolarHBondContact CA-O 3.5Å; L115-I157 HydrophobicContact CB-CB 4.03Å; L115-I157 HydrophobicContact CB-CG2 4.11Å; L115-I157 HydrophobicContact CD2-CB 4.17Å; L115-I157 HydrophobicContact CD2-CD1 3.95Å; L115-I157 HydrophobicContact CD2-CG2 4.02Å; L115-I157 HydrophobicContact CG-CG2 4.48Å; L115-I157 PolarHBondContact N-O 3.12Å; M135-I157 HydrophobicContact CG-CD1 4.5Å; M135-I157 HydrophobicContact SD-CD1 3.68Å; P154-I157 PolarHBondContact O-N 2.85Å; I157-L165 HydrophobicContact CG2-CD1 3.48Å; I157-L165 VanDerWaalsContact CG2-CD1 3.48Å; I157-L165 HydrophobicContact CG2-CD2 3.84Å; I157-L165 HydrophobicContact CG2-CG 3.56Å; I157-I214 HydrophobicContact CD1-CD1 3.65Å
158	V	94.6	Very high	92.3	Very high	18 Å²	18	26 Å²	26	11%	0.109	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	148	-177.4	-73.6	0	0	0	0	111	M111 A113 N114 L165 K166 L168	M111-V158 HydrophobicContact CB-CB 3.74Å; M111-V158 HydrophobicContact CB-CG1 4.5Å; M111-V158 HydrophobicContact CB-CG2 3.98Å; M111-V158 HydrophobicContact CE-CG2 4.33Å; M111-V158 HydrophobicContact CG-CB 3.94Å; M111-V158 HydrophobicContact CG-CG2 3.57Å; A113-V158 CarbonylContact O-C 3.2Å; A113-V158 VanDerWaalsContact O-CA 3.28Å; A113-V158 WeakPolarHBondContact O-CA 3.48Å; A113-V158 WeakPolarHBondContact O-CB 3.36Å; N114-V158 HydrophobicContact CB-CG1 4.24Å; V158-L165 CarbonylContact O-C 3.44Å; V158-L165 WeakPolarHBondContact O-CA 3.47Å; V158-K166 HydrophobicContact CG2-CB 4.12Å; V158-K166 WeakPolarHBondContact CG2-O 3.46Å; V158-K166 PolarHBondContact N-O 3.28Å; V158-K166 PolarHBondContact O-N 2.9Å; V158-L168 HydrophobicContact CB-CD1 4.44Å; V158-L168 HydrophobicContact CG1-CD1 3.52Å; V158-L168 HydrophobicContact CG1-CG 4.14Å; V158-L168 HydrophobicContact CG2-CD1 4.11Å; V158-L168 HydrophobicContact CG2-CD2 3.72Å; V158-L168 HydrophobicContact CG2-CG 3.82Å
159	V	96.1	Very high	91.6	Very high	8 Å²	8	26.5 Å²	26.5	5%	0.048	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	159.9	-176.5	-58.3	0	0	0	0	111.5	D112 A113 L115 V118 L131 T164 L165	D112-V159 PolarHBondContact N-O 3.24Å; A113-V159 HydrophobicContact CB-CG2 4.03Å; A113-V159 PolarHBondContact N-O 3Å; A113-V159 VanDerWaalsContact N-O 3.13Å; A113-V159 PolarHBondContact O-N 2.82Å; L115-V159 HydrophobicContact CD1-CG1 4.19Å; V118-V159 HydrophobicContact CG2-CG1 4.44Å; V118-V159 HydrophobicContact CG2-CG2 3.42Å; V118-V159 VanDerWaalsContact CG2-CG2 3.42Å; L131-V159 HydrophobicContact CD2-CG1 3.92Å; V159-T164 CarbonylContact C-O 3.5Å; V159-T164 WeakPolarHBondContact CA-O 3.44Å; V159-L165 HydrophobicContact CG1-CB 4.22Å; V159-L165 HydrophobicContact CG1-CD1 4.2Å; V159-L165 HydrophobicContact CG1-CG 4.25Å
160	K	94.3	Very high	90.6	Very high	73 Å²	73	26.5 Å²	26.5	32%	0.317	15%	0.153	S	C	.	.			trans	-108	167.2	163.9	-72.9	-179.7	177.6	-176.2	0	111.2	M111 D112 D162 C163 T164	M111-K160 HydrophobicContact CE-CD 4.41Å; M111-K160 HydrophobicContact CE-CG 3.76Å; M111-K160 HydrophobicContact SD-CD 4.19Å; M111-K160 HydrophobicContact SD-CG 3.87Å; D112-K160 WeakPolarHBondContact OD2-CA 3.13Å; K160-D162 WeakPolarHBondContact CB-OD1 3.42Å; K160-D162 PolarHBondContact O-N 2.98Å; K160-C163 PolarHBondContact O-N 3.41Å; K160-T164 WeakPolarHBondContact CB-OG1 3.35Å; K160-T164 PolarHBondContact N-O 2.93Å
161	S	91.5	Very high	89.2	Confident	110 Å²	110	26.2 Å²	26.2	77%	0.769	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-25.5	174.5	43.5	0	0	0	0	114.2	D112 C163	D112-S161 WeakPolarHBondContact OD2-CB 3.18Å; D112-S161 PolarHBondContact OD2-N 2.71Å; D112-S161 PolarHBondContact OD2-OG 2.8Å; S161-C163 PolarHBondContact O-N 3.43Å
162	D	93.1	Very high	88.1	Confident	98 Å²	98	27.6 Å²	27.6	52%	0.524	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	13.8	173.4	67.8	-3.1	0	0	0	113.8	K160 T164	K160-D162 WeakPolarHBondContact CB-OD1 3.42Å; K160-D162 PolarHBondContact O-N 2.98Å; D162-T164 PolarHBondContact O-N 2.8Å; D162-T164 VanDerWaalsContact OD1-CB 3.31Å; D162-T164 WeakPolarHBondContact OD1-CB 3.46Å; D162-T164 VanDerWaalsContact OD1-CG2 3.26Å; D162-T164 WeakPolarHBondContact OD1-CG2 2.98Å; D162-T164 PolarHBondContact OD1-N 3.45Å; D162-T164 PolarHBondContact OD1-OG1 3.03Å; D162-T164 WeakPolarHBondContact OD2-CG2 2.94Å
163	C	94	Very high	86.4	Confident	35 Å²	35	27.4 Å²	27.4	24%	0.236	16%	0.159	C	C	.	.			trans	61.6	16.3	-175.6	-64.3	0	0	0	0	115.1	Y130 Q134 K160 S161	Y130-C163 HydrophobicContact CD1-CB 4.17Å; Y130-C163 HydrophobicContact CE1-CB 4.41Å; Q134-C163 PolarHBondContact NE2-O 2.83Å; K160-C163 PolarHBondContact O-N 3.41Å; S161-C163 PolarHBondContact O-N 3.43Å
164	T	96.3	Very high	85	Confident	42 Å²	42	29 Å²	29	26%	0.258	17%	0.165	S	C	.	.			trans	-72	139.8	169.3	58.5	0	0	0	0	111	V159 K160 D162	V159-T164 CarbonylContact C-O 3.5Å; V159-T164 WeakPolarHBondContact CA-O 3.44Å; K160-T164 WeakPolarHBondContact CB-OG1 3.35Å; K160-T164 PolarHBondContact N-O 2.93Å; D162-T164 PolarHBondContact O-N 2.8Å; D162-T164 VanDerWaalsContact OD1-CB 3.31Å; D162-T164 WeakPolarHBondContact OD1-CB 3.46Å; D162-T164 VanDerWaalsContact OD1-CG2 3.26Å; D162-T164 WeakPolarHBondContact OD1-CG2 2.98Å; D162-T164 PolarHBondContact OD1-N 3.45Å; D162-T164 PolarHBondContact OD1-OG1 3.03Å; D162-T164 WeakPolarHBondContact OD2-CG2 2.94Å
165	L	97.8	Very high	83.1	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	138.2	-175	-179.8	152.4	0	0	0	111.6	N84 L131 Q134 M135 I157 V158 V159 I167	N84-L165 VanDerWaalsContact CA-O 3.26Å; N84-L165 WeakPolarHBondContact CA-O 3.45Å; N84-L165 PolarHBondContact ND2-O 3.44Å; L131-L165 HydrophobicContact CB-CD1 4.23Å; L131-L165 HydrophobicContact CD2-CB 4.15Å; L131-L165 HydrophobicContact CD2-CD1 3.86Å; Q134-L165 HydrophobicContact CB-CB 3.98Å; Q134-L165 HydrophobicContact CB-CD2 4.35Å; M135-L165 HydrophobicContact CB-CD2 4.48Å; M135-L165 HydrophobicContact CG-CD1 3.53Å; M135-L165 HydrophobicContact CG-CD2 3.64Å; M135-L165 HydrophobicContact CG-CG 4.27Å; M135-L165 HydrophobicContact SD-CD1 4.23Å; I157-L165 HydrophobicContact CG2-CD1 3.48Å; I157-L165 VanDerWaalsContact CG2-CD1 3.48Å; I157-L165 HydrophobicContact CG2-CD2 3.84Å; I157-L165 HydrophobicContact CG2-CG 3.56Å; V158-L165 CarbonylContact O-C 3.44Å; V158-L165 WeakPolarHBondContact O-CA 3.47Å; V159-L165 HydrophobicContact CG1-CB 4.22Å; V159-L165 HydrophobicContact CG1-CD1 4.2Å; V159-L165 HydrophobicContact CG1-CG 4.25Å; L165-I167 HydrophobicContact CD2-CG1 4.31Å
166	K	96.8	Very high	81	Confident	20 Å²	20	27.8 Å²	27.8	9%	0.087	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	138.5	171.8	-74.3	170.6	178.4	-93.3	0	112	K83 N84 I85 I86 E109 M111 V158	K83-K166 WeakPolarHBondContact O-CE 3.47Å; K83-K166 VanDerWaalsContact O-CG 3.22Å; K83-K166 WeakPolarHBondContact O-CG 3.4Å; K83-K166 PolarHBondContact O-NZ 3.38Å; N84-K166 WeakPolarHBondContact O-CA 3.21Å; I85-K166 PolarHBondContact O-NZ 2.99Å; I86-K166 HydrophobicContact CD1-CD 4.17Å; E109-K166 WeakPolarHBondContact OE2-CE 3.39Å; E109-K166 IonicContact OE2-NZ 2.71Å; E109-K166 PolarHBondContact OE2-NZ 3.45Å; M111-K166 HydrophobicContact CE-CB 4.23Å; M111-K166 HydrophobicContact CE-CD 4.08Å; M111-K166 HydrophobicContact CE-CG 4.24Å; M111-K166 HydrophobicContact SD-CD 3.95Å; V158-K166 HydrophobicContact CG2-CB 4.12Å; V158-K166 WeakPolarHBondContact CG2-O 3.46Å; V158-K166 PolarHBondContact N-O 3.28Å; V158-K166 PolarHBondContact O-N 2.9Å
167	I	95.3	Very high	78.3	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	136.7	173.4	-58.5	172	0	0	0	109.9	N84 I86 I139 L152 L165	N84-I167 PolarHBondContact O-N 2.94Å; I86-I167 WeakPolarHBondContact CG2-O 3.35Å; I86-I167 PolarHBondContact N-O 3.35Å; I139-I167 HydrophobicContact CG1-CD1 3.97Å; L152-I167 HydrophobicContact CD2-CD1 4.38Å; L152-I167 HydrophobicContact CD2-CG2 3.83Å; L165-I167 HydrophobicContact CD2-CG1 4.31Å
168	L	87.9	Confident	75.7	Confident	39 Å²	39	32 Å²	32	20%	0.204	20%	0.198	C	C	.	.			trans	-108.6	170.3	176.3	-56.2	-178.2	0	0	0	112.4	I86 H149 N156 V158	I86-L168 HydrophobicContact CB-CD2 3.63Å; I86-L168 HydrophobicContact CD1-CD2 4.23Å; I86-L168 HydrophobicContact CG1-CD2 3.74Å; I86-L168 HydrophobicContact CG2-CD2 3.73Å; H149-L168 PolarHBondContact NE2-O 2.94Å; N156-L168 WeakPolarHBondContact O-CB 3.41Å; N156-L168 PolarHBondContact O-N 2.76Å; V158-L168 HydrophobicContact CB-CD1 4.44Å; V158-L168 HydrophobicContact CG1-CD1 3.52Å; V158-L168 HydrophobicContact CG1-CG 4.14Å; V158-L168 HydrophobicContact CG2-CD1 4.11Å; V158-L168 HydrophobicContact CG2-CD2 3.72Å; V158-L168 HydrophobicContact CG2-CG 3.82Å
169	D	73.8	Confident	73	Confident	11 Å²	11	36 Å²	36	6%	0.059	23%	0.227	C	C	.	.			trans	58.2	81.5	161.8	-174	14.4	0	0	0	116.3	Q37 R69 H149 N156 G171	Q37-D169 PolarHBondContact NE2-OD2 3.16Å; Q37-D169 PolarHBondContact OE1-OD1 3.09Å; Q37-D169 PolarHBondContact OE1-OD2 3.17Å; R69-D169 IonicContact CZ-OD1 2.67Å; R69-D169 IonicContact NH2-OD1 2.91Å; R69-D169 PolarHBondContact NH2-OD1 3.4Å; R69-D169 IonicContact NH2-OD2 3.62Å; R69-D169 PolarHBondContact NH2-OD2 3.41Å; H149-D169 PolarHBondContact NE2-O 2.87Å; N156-D169 PolarHBondContact ND2-OD2 3.18Å; D169-G171 PolarHBondContact O-N 2.74Å; D169-G171 WeakPolarHBondContact OD1-CA 3.44Å; D169-G171 PolarHBondContact OD1-N 2.9Å
170	F	68.2	Low	70.2	Confident	1 Å²	1	42 Å²	42	0%	0.004	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-81.8	11.1	169.3	-48.5	-67	0	0	0	113.7	R72 L76 M77 I85 I86 L142 L172 A173	R72-F170 PolarHBondContact NE-O 3.13Å; R72-F170 VanDerWaalsContact NE-O 3.15Å; R72-F170 PolarHBondContact NH2-O 3.47Å; L76-F170 HydrophobicContact CB-CB 4.08Å; L76-F170 HydrophobicContact CB-CD2 4.18Å; L76-F170 HydrophobicContact CB-CG 4.24Å; L76-F170 HydrophobicContact CD1-CB 3.43Å; L76-F170 VanDerWaalsContact CD1-CB 3.43Å; L76-F170 HydrophobicContact CD1-CG 4.18Å; L76-F170 HydrophobicContact CG-CB 4.4Å; M77-F170 HydrophobicContact CG-CD2 4.06Å; M77-F170 HydrophobicContact CG-CE2 4.21Å; I85-F170 HydrophobicContact CG2-CE2 4.01Å; I85-F170 HydrophobicContact CG2-CZ 3.48Å; I85-F170 VanDerWaalsContact CG2-CZ 3.48Å; I86-F170 HydrophobicContact CG2-CE2 4.46Å; L142-F170 HydrophobicContact CD1-CD1 4.37Å; L142-F170 HydrophobicContact CD1-CE1 3.74Å; L142-F170 HydrophobicContact CD2-CD1 4.03Å; L142-F170 HydrophobicContact CD2-CE1 3.54Å; L142-F170 HydrophobicContact CD2-CZ 4.2Å; L142-F170 HydrophobicContact CG-CE1 4.26Å; F170-L172 PolarHBondContact O-N 3.23Å; F170-L172 VanDerWaalsContact O-N 3.11Å; F170-A173 HydrophobicContact CB-CB 4.02Å; F170-A173 VanDerWaalsContact O-CB 3.29Å; F170-A173 WeakPolarHBondContact O-CB 3.29Å; F170-A173 PolarHBondContact O-N 2.98Å
171	G	56.6	Low	67.6	Low	2 Å²	2	45.4 Å²	45.4	2%	0.021	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-67.3	-10.8	-175	0	0	0	0	0	114.5	R69 R72 D169	R69-G171 WeakPolarHBondContact CD-O 3.45Å; R69-G171 WeakPolarHBondContact CG-O 3.44Å; R69-G171 PolarHBondContact NE-O 2.81Å; R72-G171 PolarHBondContact NH2-O 3.48Å; D169-G171 PolarHBondContact O-N 2.74Å; D169-G171 WeakPolarHBondContact OD1-CA 3.44Å; D169-G171 PolarHBondContact OD1-N 2.9Å
172	L	61.7	Low	65.4	Low	35 Å²	35	41.8 Å²	41.8	18%	0.183	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-117.5	-0.5	166.9	-66	177.7	0	0	0	115.1	R150 D151 F170 R174 M182	R150-L172 PolarHBondContact NE-O 3.44Å; R150-L172 VanDerWaalsContact NE-O 3.14Å; R150-L172 PolarHBondContact NH2-O 2.84Å; D151-L172 HydrophobicContact CB-CB 4Å; D151-L172 HydrophobicContact CB-CD1 3.76Å; D151-L172 HydrophobicContact CB-CG 4.46Å; F170-L172 PolarHBondContact O-N 3.23Å; F170-L172 VanDerWaalsContact O-N 3.11Å; L172-R174 PolarHBondContact O-NH1 3.05Å; L172-R174 VanDerWaalsContact O-NH1 3.12Å; L172-M182 HydrophobicContact CB-CE 4.34Å; L172-M182 HydrophobicContact CD1-CE 4.33Å
173	A	56.7	Low	62.9	Low	0 Å²	0	41.8 Å²	41.8	0%	0	25%	0.246	C	C	.	.			trans	-56.5	156	176.1	0	0	0	0	0	112.5	R72 L76 I147 I148 H149 F170	R72-A173 PolarHBondContact NE-O 3.46Å; R72-A173 PolarHBondContact NH1-O 3.38Å; R72-A173 PolarHBondContact NH2-O 3.16Å; L76-A173 HydrophobicContact CD1-CB 4.1Å; I147-A173 HydrophobicContact CG2-CB 3.65Å; I148-A173 CarbonylContact O-C 3.54Å; I148-A173 WeakPolarHBondContact O-CA 3.34Å; I148-A173 WeakPolarHBondContact O-CB 3.41Å; H149-A173 WeakPolarHBondContact O-CA 3.26Å; F170-A173 HydrophobicContact CB-CB 4.02Å; F170-A173 VanDerWaalsContact O-CB 3.29Å; F170-A173 WeakPolarHBondContact O-CB 3.29Å; F170-A173 PolarHBondContact O-N 2.98Å
174	R	62.3	Low	60	Low	48 Å²	48	44.4 Å²	44.4	18%	0.181	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	157.7	175.3	-73.2	-62.4	-176	-72.6	2.2	110.9	R72 I148 L172	R72-R174 VanDerWaalsContact CZ-NH1 3.34Å; R72-R174 VanDerWaalsContact NH1-CZ 3.35Å; I148-R174 PolarHBondContact N-O 2.9Å; I148-R174 PolarHBondContact O-N 2.67Å; L172-R174 PolarHBondContact O-NH1 3.05Å; L172-R174 VanDerWaalsContact O-NH1 3.12Å
175	T	53.3	Low	57.1	Low	4 Å²	4	51.5 Å²	51.5	3%	0.025	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	135.9	165.8	-49.6	0	0	0	0	111.2	G146 G177 T178 Y338 K340 D343	G146-T175 CarbonylContact O-C 3.47Å; G146-T175 VanDerWaalsContact O-CA 3.24Å; G146-T175 WeakPolarHBondContact O-CA 3.45Å; T175-G177 PolarHBondContact O-N 3.36Å; T175-T178 PolarHBondContact O-N 2.94Å; T175-T178 PolarHBondContact O-OG1 3.39Å; T175-Y338 WeakPolarHBondContact OG1-CD1 3.24Å; T175-Y338 VanDerWaalsContact OG1-CE1 3.28Å; T175-Y338 WeakPolarHBondContact OG1-CE1 3.4Å; T175-K340 HydrophobicContact CG2-CB 3.92Å; T175-K340 HydrophobicContact CG2-CD 3.52Å; T175-K340 HydrophobicContact CG2-CG 3.45Å; T175-K340 VanDerWaalsContact CG2-CG 3.45Å; T175-D343 WeakPolarHBondContact CB-OD2 3.45Å; T175-D343 PolarHBondContact N-OD2 2.7Å; T175-D343 PolarHBondContact OG1-OD2 3.22Å
176	A	45.9	Very low	54.5	Low	24 Å²	24	58 Å²	58	20%	0.198	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	128.8	171.3	0	0	0	0	0	111.7	G146 I148	G146-A176 PolarHBondContact O-N 3.46Å; I148-A176 HydrophobicContact CD1-CB 3.85Å; I148-A176 HydrophobicContact CG1-CB 4.24Å
177	G	34	Very low	52.9	Low	72 Å²	72	60 Å²	60	74%	0.742	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.4	-5.3	179.2	0	0	0	0	0	116.4	T175 S179	T175-G177 PolarHBondContact O-N 3.36Å; G177-S179 PolarHBondContact O-N 3.28Å
178	T	39.8	Very low	51.7	Low	32 Å²	32	62.9 Å²	62.9	20%	0.196	36%	0.357	C	S	.	.			trans	-86.2	109.9	178.3	56.3	0	0	0	0	112	T175 F180 Y202	T175-T178 PolarHBondContact O-N 2.94Å; T175-T178 PolarHBondContact O-OG1 3.39Å; T178-F180 VanDerWaalsContact C-N 3.31Å; T178-F180 PolarHBondContact O-N 3.11Å; T178-F180 VanDerWaalsContact O-N 3.08Å; T178-Y202 PolarHBondContact O-OH 3Å
179	S	37.8	Very low	51.7	Low	101 Å²	101	62.5 Å²	62.5	71%	0.706	35%	0.353	S	S	*	.			trans	-86.4	55.2	-175.1	-168	0	0	0	0	113.3	G177	G177-S179 PolarHBondContact O-N 3.28Å
180	F	38.1	Very low	52.7	Low	136 Å²	136	65.4 Å²	65.4	60%	0.596	36%	0.363	S	S	*	.	P	Polyproline II helix	trans	-98	127.5	178.1	-161.7	-94.2	0	0	0	112.2	T178	T178-F180 VanDerWaalsContact C-N 3.31Å; T178-F180 PolarHBondContact O-N 3.11Å; T178-F180 VanDerWaalsContact O-N 3.08Å
181	M	39.9	Very low	54	Low	143 Å²	143	66.2 Å²	66.2	70%	0.704	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-68.5	134.4	175.3	-68.2	-174.1	-76.1	0	0	110.9
182	M	45.2	Very low	55.7	Low	35 Å²	35	66.7 Å²	66.7	17%	0.172	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-65.6	141.5	172.2	-77.2	-161.9	172.2	0	0	110.6	R150 L172 V196	R150-M182 HydrophobicContact CB-CE 3.86Å; L172-M182 HydrophobicContact CB-CE 4.34Å; L172-M182 HydrophobicContact CD1-CE 4.33Å; M182-V196 HydrophobicContact CG-CG1 4.27Å; M182-V196 HydrophobicContact SD-CG1 4.01Å
183	T	39.2	Very low	57.3	Low	97 Å²	97	65.1 Å²	65.1	60%	0.595	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-66.6	136.9	172.1	42.6	0	0	0	0	110.3	Y185	T183-Y185 PolarHBondContact O-N 3.07Å
184	P	34.6	Very low	59.2	Low	90 Å²	90	65.1 Å²	65.1	58%	0.584	36%	0.36	S	S	*	.			trans	-76.8	15.7	-170.8	27.8	-33.9	0	0	0	115.6
185	Y	35.1	Very low	60.7	Low	192 Å²	192	62.8 Å²	62.8	75%	0.753	35%	0.351	S	S	*	.	S	Bend	trans	-80.2	145.1	-175.3	-89.5	-89.8	0	0	0	113.9	T183 V187	T183-Y185 PolarHBondContact O-N 3.07Å; Y185-V187 PolarHBondContact O-N 3.42Å
186	V	42.6	Very low	62.4	Low	137 Å²	137	63.6 Å²	63.6	83%	0.83	36%	0.356	S	S	*	.	S	Bend	trans	-38.5	86.8	-173.8	-169.4	0	0	0	0	114.3
187	V	63.3	Low	64.5	Low	62 Å²	62	63.3 Å²	63.3	38%	0.376	35%	0.351	S	S	.	.	S	Bend	trans	-135.9	149.7	168.3	-177.7	0	0	0	0	107.7	Y185 R189	Y185-V187 PolarHBondContact O-N 3.42Å; V187-R189 PolarHBondContact O-N 2.88Å
188	T	70.5	Confident	67.2	Low	60 Å²	60	60.6 Å²	60.6	37%	0.368	32%	0.319	S	S	.	.			trans	-49.6	112.6	174.2	-47.5	0	0	0	0	110.9	Y190 Y191	T188-Y190 HydrophobicContact CG2-CD2 3.47Å; T188-Y190 VanDerWaalsContact CG2-CD2 3.47Å; T188-Y190 HydrophobicContact CG2-CE2 3.89Å; T188-Y190 HydrophobicContact CG2-CG 4.02Å; T188-Y191 HydrophobicContact CG2-CD2 4.32Å; T188-Y191 HydrophobicContact CG2-CE2 3.99Å
189	R	86.6	Confident	69.4	Low	30 Å²	30	60.6 Å²	60.6	11%	0.113	33%	0.326	C	S	.	.			trans	-101.9	-3.6	-176.1	67.3	-178.4	64.8	81.9	-2.2	114.2	V187 Y191 R192 G227 T228 D229 Q233	V187-R189 PolarHBondContact O-N 2.88Å; R189-Y191 PolarHBondContact O-N 2.82Å; R189-R192 WeakPolarHBondContact O-CB 3.3Å; R189-R192 PolarHBondContact O-N 3.11Å; R189-G227 PolarHBondContact NH1-O 3.21Å; R189-T228 PolarHBondContact NH1-O 3.01Å; R189-D229 WeakPolarHBondContact CD-O 3Å; R189-Q233 HydrophobicContact CG-CB 4.38Å; R189-Q233 HydrophobicContact CG-CG 4.21Å
190	Y	94.8	Very high	71.8	Confident	72 Å²	72	57 Å²	57	28%	0.282	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-24.7	-167.8	-50.6	-32.8	0	0	0	114.5	T188 V223 F225 P226 G227	T188-Y190 HydrophobicContact CG2-CD2 3.47Å; T188-Y190 VanDerWaalsContact CG2-CD2 3.47Å; T188-Y190 HydrophobicContact CG2-CE2 3.89Å; T188-Y190 HydrophobicContact CG2-CG 4.02Å; Y190-V223 HydrophobicContact CD1-CG1 4.46Å; Y190-V223 HydrophobicContact CD2-CB 4.48Å; Y190-V223 HydrophobicContact CD2-CG1 3.6Å; Y190-V223 HydrophobicContact CD2-CG2 4.11Å; Y190-V223 HydrophobicContact CE2-CG1 4.39Å; Y190-V223 HydrophobicContact CG-CG1 3.65Å; Y190-F225 VanDerWaalsContact CD1-O 3.28Å; Y190-F225 WeakPolarHBondContact CD1-O 3.13Å; Y190-P226 HydrophobicContact CE1-CB 4.42Å; Y190-G227 WeakPolarHBondContact CE1-O 3.24Å
191	Y	95.6	Very high	74.1	Confident	18 Å²	18	53.1 Å²	53.1	7%	0.071	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	1.8	-178.3	-47.6	-84.8	0	0	0	113.2	L152 K153 P154 T188 R189 S210 C213 I214 E217	L152-Y191 WeakPolarHBondContact O-CB 3.44Å; K153-Y191 HydrophobicContact CB-CD2 3.41Å; K153-Y191 VanDerWaalsContact CB-CD2 3.41Å; K153-Y191 HydrophobicContact CB-CE2 3.81Å; K153-Y191 HydrophobicContact CB-CG 3.98Å; P154-Y191 VanDerWaalsContact CD-CE1 3.46Å; P154-Y191 VanDerWaalsContact CD-CE2 3.49Å; P154-Y191 WeakPolarHBondContact CD-OH 3.36Å; P154-Y191 HydrophobicContact CG-CE1 3.85Å; P154-Y191 HydrophobicContact CG-CE2 4.43Å; P154-Y191 WeakPolarHBondContact CG-OH 3.5Å; T188-Y191 HydrophobicContact CG2-CD2 4.32Å; T188-Y191 HydrophobicContact CG2-CE2 3.99Å; R189-Y191 PolarHBondContact O-N 2.82Å; Y191-S210 WeakPolarHBondContact O-CA 3.25Å; Y191-S210 WeakPolarHBondContact O-CB 3.47Å; Y191-S210 PolarHBondContact O-OG 3.01Å; Y191-C213 HydrophobicContact CD1-CB 3.65Å; Y191-C213 HydrophobicContact CE1-CB 4.39Å; Y191-I214 HydrophobicContact CD1-CG1 3.8Å; Y191-I214 HydrophobicContact CE1-CG1 4.05Å; Y191-E217 WeakPolarHBondContact CE1-OE2 3.31Å; Y191-E217 VanDerWaalsContact OH-CD 3.3Å; Y191-E217 PolarHBondContact OH-OE1 3.24Å; Y191-E217 PolarHBondContact OH-OE2 2.94Å
192	R	93.6	Very high	76.4	Confident	13 Å²	13	47.6 Å²	47.6	5%	0.049	27%	0.267	C	S	.	.			trans	-76.6	137.5	179.3	-67	-176.6	179.5	177.3	-0.1	110.3	R189 V196 I197 W209	R189-R192 WeakPolarHBondContact O-CB 3.3Å; R189-R192 PolarHBondContact O-N 3.11Å; R192-V196 HydrophobicContact CB-CG1 4.45Å; R192-I197 HydrophobicContact CB-CD1 4.27Å; R192-I197 HydrophobicContact CB-CG1 4.03Å; R192-I197 VanDerWaalsContact O-CD1 3.3Å; R192-I197 WeakPolarHBondContact O-CD1 3.27Å; R192-W209 PolarHBondContact O-NE1 2.86Å
193	A	95.3	Very high	78.6	Confident	1 Å²	1	53 Å²	53	1%	0.008	29%	0.29	C	S	.	.			trans	-68.5	154.2	178.9	0	0	0	0	0	112.6	E195 V196 I197 V206 W209	A193-E195 VanDerWaalsContact C-N 3.28Å; A193-E195 VanDerWaalsContact CB-CD 3.41Å; A193-E195 HydrophobicContact CB-CG 4.19Å; A193-E195 WeakPolarHBondContact CB-OE2 2.96Å; A193-E195 PolarHBondContact O-N 3.22Å; A193-V196 HydrophobicContact CB-CG2 4.36Å; A193-V196 WeakPolarHBondContact O-CB 3.43Å; A193-V196 PolarHBondContact O-N 3.44Å; A193-I197 PolarHBondContact O-N 3.15Å; A193-V206 HydrophobicContact CB-CG2 3.55Å; A193-W209 HydrophobicContact CB-CB 3.68Å; A193-W209 HydrophobicContact CB-CD2 4.46Å; A193-W209 HydrophobicContact CB-CG 3.73Å
194	P	95.1	Very high	81	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-49.7	-45.2	176.1	-33.8	40.2	0	0	0	113.9	V196 I197 L198 W209 W234 I304	P194-V196 PolarHBondContact O-N 2.82Å; P194-I197 PolarHBondContact O-N 2.91Å; P194-L198 VanDerWaalsContact O-CB 3.27Å; P194-L198 WeakPolarHBondContact O-CB 3.26Å; P194-L198 VanDerWaalsContact O-CG 3.25Å; P194-L198 WeakPolarHBondContact O-CG 3.24Å; P194-L198 PolarHBondContact O-N 3.44Å; P194-W209 HydrophobicContact CG-CD2 4.39Å; P194-W209 HydrophobicContact CG-CE3 4.17Å; P194-W209 HydrophobicContact CG-CH2 3.79Å; P194-W209 HydrophobicContact CG-CZ2 4.03Å; P194-W209 HydrophobicContact CG-CZ3 3.88Å; P194-W234 HydrophobicContact CB-CZ3 3.99Å; P194-W234 HydrophobicContact CG-CZ3 4.45Å; P194-I304 HydrophobicContact CB-CG2 4.1Å; P194-I304 HydrophobicContact CG-CB 4.48Å; P194-I304 HydrophobicContact CG-CG2 4.12Å
195	E	93.6	Very high	83.9	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.8	-30.8	178.7	60	-88.5	-149.6	0	0	112.8	A193 G199 M200 V206 P306 R309	A193-E195 VanDerWaalsContact C-N 3.28Å; A193-E195 VanDerWaalsContact CB-CD 3.41Å; A193-E195 HydrophobicContact CB-CG 4.19Å; A193-E195 WeakPolarHBondContact CB-OE2 2.96Å; A193-E195 PolarHBondContact O-N 3.22Å; E195-G199 PolarHBondContact O-N 3.45Å; E195-M200 HydrophobicContact CB-CB 3.88Å; E195-M200 HydrophobicContact CB-CG 4.48Å; E195-M200 HydrophobicContact CB-SD 4.1Å; E195-M200 PolarHBondContact O-N 3.02Å; E195-V206 HydrophobicContact CG-CG2 4.15Å; E195-P306 HydrophobicContact CB-CG 4.12Å; E195-P306 HydrophobicContact CG-CG 4.04Å; E195-P306 WeakPolarHBondContact OE1-CG 3.47Å; E195-P306 WeakPolarHBondContact OE2-CG 3.35Å; E195-R309 IonicContact OE1-CZ 3.62Å; E195-R309 IonicContact OE1-NH1 3.03Å; E195-R309 PolarHBondContact OE1-NH1 2.94Å; E195-R309 IonicContact OE1-NH2 2.87Å; E195-R309 PolarHBondContact OE1-NH2 3.31Å; E195-R309 IonicContact OE2-CZ 2.7Å; E195-R309 IonicContact OE2-NH1 3.56Å; E195-R309 IonicContact OE2-NH2 2.82Å; E195-R309 PolarHBondContact OE2-NH2 2.69Å
196	V	89.9	Confident	86.8	Confident	21 Å²	21	39.8 Å²	39.8	13%	0.127	22%	0.222	C	C	.	.	H	α-helix	trans	-76.2	-41.8	175.2	-179.6	0	0	0	0	110.7	M182 R192 A193 P194 V206	M182-V196 HydrophobicContact CG-CG1 4.27Å; M182-V196 HydrophobicContact SD-CG1 4.01Å; R192-V196 HydrophobicContact CB-CG1 4.45Å; A193-V196 HydrophobicContact CB-CG2 4.36Å; A193-V196 WeakPolarHBondContact O-CB 3.43Å; A193-V196 PolarHBondContact O-N 3.44Å; P194-V196 PolarHBondContact O-N 2.82Å; V196-V206 HydrophobicContact CG2-CG2 3.48Å; V196-V206 VanDerWaalsContact CG2-CG2 3.48Å
197	I	89.5	Confident	89.4	Confident	18 Å²	18	33.3 Å²	33.3	9%	0.092	18%	0.182	C	C	.	.	H	α-helix	trans	-68	-37.6	-179.9	-65.1	160	0	0	0	111.1	R192 A193 P194 H230 Q233	R192-I197 HydrophobicContact CB-CD1 4.27Å; R192-I197 HydrophobicContact CB-CG1 4.03Å; R192-I197 VanDerWaalsContact O-CD1 3.3Å; R192-I197 WeakPolarHBondContact O-CD1 3.27Å; A193-I197 PolarHBondContact O-N 3.15Å; P194-I197 PolarHBondContact O-N 2.91Å; I197-H230 HydrophobicContact CG2-CB 4.28Å; I197-Q233 HydrophobicContact CD1-CB 4.47Å; I197-Q233 HydrophobicContact CD1-CG 3.44Å; I197-Q233 VanDerWaalsContact CD1-CG 3.44Å; I197-Q233 HydrophobicContact CG1-CG 4.35Å
198	L	90.1	Very high	91.1	Very high	15 Å²	15	30.3 Å²	30.3	8%	0.079	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	1.2	-177.3	-61.5	175.9	0	0	0	113.5	P194 M200 W234 F248 L252 V256 V260	P194-L198 VanDerWaalsContact O-CB 3.27Å; P194-L198 WeakPolarHBondContact O-CB 3.26Å; P194-L198 VanDerWaalsContact O-CG 3.25Å; P194-L198 WeakPolarHBondContact O-CG 3.24Å; P194-L198 PolarHBondContact O-N 3.44Å; L198-M200 HydrophobicContact CB-CG 4.19Å; L198-M200 HydrophobicContact CB-SD 4.35Å; L198-M200 HydrophobicContact CD1-SD 4.46Å; L198-M200 PolarHBondContact O-N 3.19Å; L198-W234 HydrophobicContact CD1-CD2 4.46Å; L198-W234 HydrophobicContact CD1-CE3 4.03Å; L198-W234 HydrophobicContact CD1-CH2 3.95Å; L198-W234 HydrophobicContact CD1-CZ2 4.38Å; L198-W234 HydrophobicContact CD1-CZ3 3.79Å; L198-W234 HydrophobicContact CD2-CD2 4.22Å; L198-W234 HydrophobicContact CD2-CE3 4.34Å; L198-W234 HydrophobicContact CD2-CG 4.48Å; L198-W234 HydrophobicContact CG-CE3 4.35Å; L198-F248 HydrophobicContact CD1-CE1 4.07Å; L198-F248 HydrophobicContact CD1-CZ 3.92Å; L198-L252 HydrophobicContact CB-CD2 4.1Å; L198-L252 HydrophobicContact CD1-CD2 3.87Å; L198-V256 HydrophobicContact CB-CG1 4.08Å; L198-V256 HydrophobicContact CD2-CG1 3.84Å; L198-V260 HydrophobicContact CD2-CG2 3.85Å
199	G	86.6	Confident	92.4	Very high	32 Å²	32	27.5 Å²	27.5	33%	0.33	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	33.1	177	0	0	0	0	0	114.1	E195	E195-G199 PolarHBondContact O-N 3.45Å
200	M	89.6	Confident	93	Very high	25 Å²	25	26.1 Å²	26.1	12%	0.123	14%	0.142	C	C	.	.			trans	-85.7	164.1	174.7	-56	169	69.7	0	0	110.9	E195 L198 F248 K251 L252	E195-M200 HydrophobicContact CB-CB 3.88Å; E195-M200 HydrophobicContact CB-CG 4.48Å; E195-M200 HydrophobicContact CB-SD 4.1Å; E195-M200 PolarHBondContact O-N 3.02Å; L198-M200 HydrophobicContact CB-CG 4.19Å; L198-M200 HydrophobicContact CB-SD 4.35Å; L198-M200 HydrophobicContact CD1-SD 4.46Å; L198-M200 PolarHBondContact O-N 3.19Å; M200-F248 HydrophobicContact CE-CD2 4.35Å; M200-F248 HydrophobicContact CE-CE2 3.83Å; M200-F248 HydrophobicContact CE-CZ 4.22Å; M200-F248 HydrophobicContact SD-CE2 3.86Å; M200-F248 HydrophobicContact SD-CZ 3.73Å; M200-K251 HydrophobicContact CE-CB 3.76Å; M200-K251 HydrophobicContact CE-CD 4.4Å; M200-L252 HydrophobicContact CE-CD2 4.13Å; M200-L252 HydrophobicContact CG-CD2 3.68Å; M200-L252 HydrophobicContact SD-CD2 3.4Å; M200-L252 WeakPolarHBondContact SD-CD2 3.28Å
201	G	85.2	Confident	93.1	Very high	54 Å²	54	22.7 Å²	22.7	56%	0.557	13%	0.129	S	C	*	.			trans	-63.5	145	162.7	0	0	0	0	0	110.8
202	Y	88.2	Confident	93.3	Very high	27 Å²	27	21.9 Å²	21.9	11%	0.106	13%	0.125	C	C	.	.			trans	-131.3	161.7	-176.9	58.2	-91	0	0	0	111.2	I148 R150 T178 V206	I148-Y202 HydrophobicContact CD1-CD2 4.24Å; I148-Y202 HydrophobicContact CD1-CE2 4.19Å; R150-Y202 HydrophobicContact CG-CE2 4.25Å; R150-Y202 PolarHBondContact NH1-OH 3.34Å; T178-Y202 PolarHBondContact O-OH 3Å; Y202-V206 HydrophobicContact CD2-CG1 4.27Å
203	K	90.8	Very high	93.5	Very high	148 Å²	148	21.3 Å²	21.3	64%	0.643	12%	0.124	S	C	*	.			trans	-126.3	-177.6	177.1	-69.4	-170.7	177.7	-173	0	109.9	N205 V206	K203-N205 PolarHBondContact O-N 2.89Å; K203-V206 VanDerWaalsContact O-CB 3.26Å; K203-V206 WeakPolarHBondContact O-CB 3.39Å; K203-V206 WeakPolarHBondContact O-CG1 3.18Å; K203-V206 PolarHBondContact O-N 2.93Å
204	E	91.4	Very high	93.7	Very high	76 Å²	76	21.3 Å²	21.3	36%	0.355	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-41	-179.9	-66.4	84	-177.6	0	0	112.6	H143 I148 V206 D207	H143-E204 HydrophobicContact CB-CG 4.27Å; H143-E204 PolarHBondContact CE1-O 3.13Å; H143-E204 PolarHBondContact NE2-O 3.01Å; I148-E204 HydrophobicContact CD1-CG 4.41Å; I148-E204 HydrophobicContact CG1-CG 4.4Å; E204-V206 PolarHBondContact O-N 3.22Å; E204-D207 PolarHBondContact O-N 3.33Å
205	N	95.3	Very high	93.8	Very high	25 Å²	25	21.3 Å²	21.3	13%	0.134	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	6.1	-179.8	75.3	-19.6	0	0	0	115	K203 D207 M208 P306 R309	K203-N205 PolarHBondContact O-N 2.89Å; N205-D207 PolarHBondContact O-N 2.81Å; N205-M208 HydrophobicContact CB-CB 4.47Å; N205-M208 HydrophobicContact CB-CG 4.11Å; N205-M208 WeakPolarHBondContact O-CB 3.32Å; N205-M208 PolarHBondContact O-N 3.34Å; N205-P306 PolarHBondContact ND2-O 3.03Å; N205-R309 PolarHBondContact ND2-O 3.03Å; N205-R309 WeakPolarHBondContact O-CD 3.41Å; N205-R309 PolarHBondContact O-NH1 3.29Å
206	V	95.6	Very high	94.1	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.012	12%	0.123	C	C	.	.	H	α-helix	trans	-59.8	-37.3	164.1	73.2	0	0	0	0	111.3	I148 R150 A193 E195 V196 Y202 K203 E204 M208 W209	I148-V206 HydrophobicContact CG2-CG1 3.3Å; R150-V206 HydrophobicContact CG-CG1 4.29Å; A193-V206 HydrophobicContact CB-CG2 3.55Å; E195-V206 HydrophobicContact CG-CG2 4.15Å; V196-V206 HydrophobicContact CG2-CG2 3.48Å; V196-V206 VanDerWaalsContact CG2-CG2 3.48Å; Y202-V206 HydrophobicContact CD2-CG1 4.27Å; K203-V206 VanDerWaalsContact O-CB 3.26Å; K203-V206 WeakPolarHBondContact O-CB 3.39Å; K203-V206 WeakPolarHBondContact O-CG1 3.18Å; K203-V206 PolarHBondContact O-N 2.93Å; E204-V206 PolarHBondContact O-N 3.22Å; V206-M208 PolarHBondContact O-N 3.38Å; V206-W209 WeakPolarHBondContact O-CB 3.19Å; V206-W209 PolarHBondContact O-N 3.2Å
207	D	96.9	Very high	94.4	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-70.1	-25.2	-179.9	-71	-32.6	0	0	0	111.4	I139 H143 I148 H149 R150 L152 E204 N205 W209 S210 V211	I139-D207 HydrophobicContact CG2-CB 4.1Å; H143-D207 IonicContact CD2-OD2 3.25Å; H143-D207 IonicContact CE1-OD2 3.42Å; H143-D207 IonicContact NE2-OD2 2.7Å; H143-D207 PolarHBondContact NE2-OD2 2.8Å; I148-D207 WeakPolarHBondContact CG2-OD2 3.23Å; H149-D207 PolarHBondContact N-OD2 2.91Å; R150-D207 PolarHBondContact N-OD1 2.9Å; L152-D207 HydrophobicContact CD1-CB 3.79Å; E204-D207 PolarHBondContact O-N 3.33Å; N205-D207 PolarHBondContact O-N 2.81Å; D207-W209 VanDerWaalsContact C-N 3.29Å; D207-W209 PolarHBondContact O-N 3.21Å; D207-S210 WeakPolarHBondContact O-CB 3.49Å; D207-S210 PolarHBondContact O-N 2.98Å; D207-S210 VanDerWaalsContact O-N 3.15Å; D207-V211 WeakPolarHBondContact O-CG2 3.35Å; D207-V211 PolarHBondContact O-N 3.41Å
208	M	98.6	Very high	94.8	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-66.5	-30	176.5	-62.3	-54.5	-65.7	0	0	112.9	L136 N205 V206 G212 M301 R309 I310 V312 A315	L136-M208 HydrophobicContact CD2-CE 3.57Å; L136-M208 HydrophobicContact CD2-SD 3.66Å; N205-M208 HydrophobicContact CB-CB 4.47Å; N205-M208 HydrophobicContact CB-CG 4.11Å; N205-M208 WeakPolarHBondContact O-CB 3.32Å; N205-M208 PolarHBondContact O-N 3.34Å; V206-M208 PolarHBondContact O-N 3.38Å; M208-G212 PolarHBondContact O-N 3.19Å; M208-M301 HydrophobicContact CE-CE 3.61Å; M208-M301 HydrophobicContact CE-CG 4.2Å; M208-R309 HydrophobicContact CB-CG 4.49Å; M208-I310 HydrophobicContact CE-CG2 3.97Å; M208-V312 HydrophobicContact CG-CG2 4.11Å; M208-V312 HydrophobicContact SD-CB 4.21Å; M208-V312 HydrophobicContact SD-CG2 3.56Å; M208-V312 VanDerWaalsContact SD-CG2 3.56Å; M208-A315 HydrophobicContact CE-CB 3.38Å
209	W	98.6	Very high	95.1	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64.2	-46.4	171.2	175	-86.1	0	0	0	111	R192 A193 P194 V206 D207 V211 G212 C213 F225 V237 L241 L302 I304	R192-W209 PolarHBondContact O-NE1 2.86Å; A193-W209 HydrophobicContact CB-CB 3.68Å; A193-W209 HydrophobicContact CB-CD2 4.46Å; A193-W209 HydrophobicContact CB-CG 3.73Å; P194-W209 HydrophobicContact CG-CD2 4.39Å; P194-W209 HydrophobicContact CG-CE3 4.17Å; P194-W209 HydrophobicContact CG-CH2 3.79Å; P194-W209 HydrophobicContact CG-CZ2 4.03Å; P194-W209 HydrophobicContact CG-CZ3 3.88Å; V206-W209 WeakPolarHBondContact O-CB 3.19Å; V206-W209 PolarHBondContact O-N 3.2Å; D207-W209 VanDerWaalsContact C-N 3.29Å; D207-W209 PolarHBondContact O-N 3.21Å; W209-V211 VanDerWaalsContact C-N 3.33Å; W209-V211 PolarHBondContact O-N 3.44Å; W209-G212 PolarHBondContact O-N 3.29Å; W209-G212 VanDerWaalsContact O-N 3.12Å; W209-C213 PolarHBondContact NE1-SG 3.03Å; W209-C213 VanDerWaalsContact NE1-SG 3.37Å; W209-C213 PolarHBondContact O-N 3.15Å; W209-F225 HydrophobicContact CH2-CE2 4.22Å; W209-F225 HydrophobicContact CH2-CZ 4.47Å; W209-F225 HydrophobicContact CZ2-CD2 4.09Å; W209-F225 AromaticContact CZ2-CE2 3.7Å; W209-F225 HydrophobicContact CZ2-CE2 3.7Å; W209-F225 HydrophobicContact CZ2-CZ 4.35Å; W209-V237 HydrophobicContact CH2-CG1 3.73Å; W209-V237 HydrophobicContact CH2-CG2 4.3Å; W209-V237 HydrophobicContact CZ2-CG1 4.16Å; W209-V237 HydrophobicContact CZ2-CG2 3.89Å; W209-L241 HydrophobicContact CH2-CD1 3.56Å; W209-L241 HydrophobicContact CZ3-CD1 3.88Å; W209-L302 HydrophobicContact CE3-CD2 4.48Å; W209-I304 HydrophobicContact CZ3-CG1 4.43Å
210	S	97.9	Very high	95.5	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.014	12%	0.119	C	C	.	.	H	α-helix	trans	-61.3	-42.6	179.4	-55.2	0	0	0	0	111.4	Y191 D207 G212 C213 I214	Y191-S210 WeakPolarHBondContact O-CA 3.25Å; Y191-S210 WeakPolarHBondContact O-CB 3.47Å; Y191-S210 PolarHBondContact O-OG 3.01Å; D207-S210 WeakPolarHBondContact O-CB 3.49Å; D207-S210 PolarHBondContact O-N 2.98Å; D207-S210 VanDerWaalsContact O-N 3.15Å; S210-G212 VanDerWaalsContact C-N 3.34Å; S210-G212 PolarHBondContact O-N 2.98Å; S210-C213 PolarHBondContact O-N 2.85Å; S210-I214 WeakPolarHBondContact O-CD1 3.41Å; S210-I214 VanDerWaalsContact O-CG1 3.23Å; S210-I214 WeakPolarHBondContact O-CG1 3.48Å; S210-I214 PolarHBondContact O-N 2.97Å
211	V	98.6	Very high	95.7	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.3	-43.3	173.2	178.2	0	0	0	0	111.2	L132 M135 I139 L152 D207 W209 C213 I214 M215 M301	L132-V211 HydrophobicContact CD2-CG1 3.73Å; M135-V211 HydrophobicContact CE-CG1 4.33Å; I139-V211 HydrophobicContact CD1-CG2 3.37Å; L152-V211 HydrophobicContact CD1-CG2 4.37Å; D207-V211 WeakPolarHBondContact O-CG2 3.35Å; D207-V211 PolarHBondContact O-N 3.41Å; W209-V211 VanDerWaalsContact C-N 3.33Å; W209-V211 PolarHBondContact O-N 3.44Å; V211-C213 PolarHBondContact O-N 3.43Å; V211-I214 PolarHBondContact O-N 3.16Å; V211-M215 WeakPolarHBondContact O-CB 3.41Å; V211-M215 PolarHBondContact O-N 2.68Å; V211-M301 HydrophobicContact CB-SD 4.44Å; V211-M301 HydrophobicContact CG1-CE 3.9Å; V211-M301 HydrophobicContact CG1-SD 3.94Å
212	G	98.7	Very high	96.1	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-60.3	-41.6	174.9	0	0	0	0	0	113.2	M208 W209 S210 G216 L298	M208-G212 PolarHBondContact O-N 3.19Å; W209-G212 PolarHBondContact O-N 3.29Å; W209-G212 VanDerWaalsContact O-N 3.12Å; S210-G212 VanDerWaalsContact C-N 3.34Å; S210-G212 PolarHBondContact O-N 2.98Å; G212-G216 PolarHBondContact O-N 3.06Å; G212-L298 WeakPolarHBondContact O-CD2 3.34Å
213	C	98.7	Very high	96.5	Very high	2 Å²	2	24 Å²	24	1%	0.014	13%	0.131	C	C	.	.	H	α-helix	trans	-62.9	-45.1	174.7	-72	0	0	0	0	111.9	Y191 W209 S210 V211 G216 E217	Y191-C213 HydrophobicContact CD1-CB 3.65Å; Y191-C213 HydrophobicContact CE1-CB 4.39Å; W209-C213 PolarHBondContact NE1-SG 3.03Å; W209-C213 VanDerWaalsContact NE1-SG 3.37Å; W209-C213 PolarHBondContact O-N 3.15Å; S210-C213 PolarHBondContact O-N 2.85Å; V211-C213 PolarHBondContact O-N 3.43Å; C213-G216 PolarHBondContact O-N 3.45Å; C213-E217 WeakPolarHBondContact O-CB 3.46Å; C213-E217 PolarHBondContact O-N 3.25Å
214	I	98.4	Very high	96.8	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63.1	-46.9	178.5	-69.6	163.9	0	0	0	110.4	L115 M135 P154 I157 Y191 S210 V211 G216 E217 M218	L115-I214 HydrophobicContact CD2-CG2 3.46Å; L115-I214 VanDerWaalsContact CD2-CG2 3.46Å; M135-I214 HydrophobicContact CE-CG2 4.31Å; M135-I214 HydrophobicContact SD-CG2 4.29Å; P154-I214 HydrophobicContact CG-CG1 4.12Å; I157-I214 HydrophobicContact CD1-CD1 3.65Å; Y191-I214 HydrophobicContact CD1-CG1 3.8Å; Y191-I214 HydrophobicContact CE1-CG1 4.05Å; S210-I214 WeakPolarHBondContact O-CD1 3.41Å; S210-I214 VanDerWaalsContact O-CG1 3.23Å; S210-I214 WeakPolarHBondContact O-CG1 3.48Å; S210-I214 PolarHBondContact O-N 2.97Å; V211-I214 PolarHBondContact O-N 3.16Å; I214-G216 PolarHBondContact O-N 3.07Å; I214-E217 PolarHBondContact O-N 3.41Å; I214-M218 HydrophobicContact CG2-CE 3.43Å; I214-M218 VanDerWaalsContact CG2-CE 3.43Å; I214-M218 WeakPolarHBondContact O-CG 3.35Å; I214-M218 PolarHBondContact O-N 2.88Å
215	M	98.6	Very high	97.1	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-59.8	-46.6	176.8	-179.9	174.9	-179.8	0	0	111.7	L132 V211 E217 M218 I219 A294 L297 L298 Y320	L132-M215 HydrophobicContact CD1-CB 4.42Å; L132-M215 HydrophobicContact CD1-CE 3.97Å; L132-M215 HydrophobicContact CD1-CG 3.85Å; L132-M215 HydrophobicContact CD1-SD 3.63Å; L132-M215 HydrophobicContact CD2-CB 3.83Å; L132-M215 HydrophobicContact CD2-CG 4.17Å; L132-M215 HydrophobicContact CD2-SD 4.25Å; V211-M215 WeakPolarHBondContact O-CB 3.41Å; V211-M215 PolarHBondContact O-N 2.68Å; M215-E217 VanDerWaalsContact C-N 3.27Å; M215-E217 PolarHBondContact O-N 3.26Å; M215-M218 WeakPolarHBondContact O-CB 3.41Å; M215-M218 PolarHBondContact O-N 2.99Å; M215-I219 HydrophobicContact CE-CD1 4.19Å; M215-I219 HydrophobicContact CG-CD1 4.05Å; M215-I219 WeakPolarHBondContact O-CD1 3.46Å; M215-I219 WeakPolarHBondContact O-CG1 3.49Å; M215-I219 PolarHBondContact O-N 2.91Å; M215-I219 VanDerWaalsContact O-N 3.16Å; M215-A294 HydrophobicContact CE-CB 3.76Å; M215-A294 VanDerWaalsContact CE-O 3.25Å; M215-A294 WeakPolarHBondContact CE-O 3.31Å; M215-L297 HydrophobicContact CE-CB 4.46Å; M215-L297 HydrophobicContact CE-CD2 4.32Å; M215-L297 HydrophobicContact SD-CD2 4.1Å; M215-L297 HydrophobicContact SD-CG 4.33Å; M215-L298 HydrophobicContact CB-CD2 4.01Å; M215-L298 HydrophobicContact CE-CD1 4.4Å; M215-L298 HydrophobicContact CE-CG 4.01Å; M215-L298 HydrophobicContact CG-CD2 3.88Å; M215-L298 HydrophobicContact CG-CG 4.05Å; M215-L298 HydrophobicContact SD-CD2 4.05Å; M215-L298 HydrophobicContact SD-CG 3.81Å; M215-Y320 HydrophobicContact CE-CD1 4.1Å; M215-Y320 HydrophobicContact CE-CE1 3.83Å
216	G	98.2	Very high	97.1	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-66.5	-32	179.1	0	0	0	0	0	112.5	G212 C213 I214 I219 K220 F275	G212-G216 PolarHBondContact O-N 3.06Å; C213-G216 PolarHBondContact O-N 3.45Å; I214-G216 PolarHBondContact O-N 3.07Å; G216-I219 PolarHBondContact O-N 3.03Å; G216-K220 WeakPolarHBondContact O-CB 3.43Å; G216-K220 WeakPolarHBondContact O-CG 3.3Å; G216-K220 PolarHBondContact O-N 3.24Å; G216-F275 VanDerWaalsContact CA-CE1 3.48Å
217	E	97.7	Very high	97	Very high	15 Å²	15	15.3 Å²	15.3	7%	0.07	10%	0.097	C	C	.	.	H	α-helix	trans	-70.3	-38.5	173.1	-178.9	170.8	170.3	0	0	112.4	I119 Y191 C213 I214 M215 I219 K220 G221	I119-E217 HydrophobicContact CD1-CG 4Å; I119-E217 HydrophobicContact CG1-CG 4.5Å; I119-E217 HydrophobicContact CG2-CG 3.69Å; Y191-E217 WeakPolarHBondContact CE1-OE2 3.31Å; Y191-E217 VanDerWaalsContact OH-CD 3.3Å; Y191-E217 PolarHBondContact OH-OE1 3.24Å; Y191-E217 PolarHBondContact OH-OE2 2.94Å; C213-E217 WeakPolarHBondContact O-CB 3.46Å; C213-E217 PolarHBondContact O-N 3.25Å; I214-E217 PolarHBondContact O-N 3.41Å; M215-E217 VanDerWaalsContact C-N 3.27Å; M215-E217 PolarHBondContact O-N 3.26Å; E217-I219 PolarHBondContact O-N 2.87Å; E217-K220 PolarHBondContact O-N 3.18Å; E217-G221 WeakPolarHBondContact O-CA 3.38Å; E217-G221 PolarHBondContact O-N 2.81Å
218	M	96.8	Very high	96.7	Very high	12 Å²	12	20.4 Å²	20.4	6%	0.059	13%	0.128	C	C	.	.	H	α-helix	trans	-58.2	-34.6	171.1	-69	-172.9	-139.1	0	0	112.2	L115 I119 L123 M128 M135 I214 M215	L115-M218 HydrophobicContact CD1-CE 4.3Å; L115-M218 HydrophobicContact CD2-CE 3.9Å; L115-M218 HydrophobicContact CG-CE 4.42Å; I119-M218 HydrophobicContact CG1-CG 3.73Å; L123-M218 HydrophobicContact CD1-CG 4.42Å; L123-M218 HydrophobicContact CD1-SD 3.99Å; M128-M218 HydrophobicContact CE-CB 4.33Å; M128-M218 HydrophobicContact CG-SD 4.1Å; M135-M218 HydrophobicContact CE-CE 3.9Å; I214-M218 HydrophobicContact CG2-CE 3.43Å; I214-M218 VanDerWaalsContact CG2-CE 3.43Å; I214-M218 WeakPolarHBondContact O-CG 3.35Å; I214-M218 PolarHBondContact O-N 2.88Å; M215-M218 WeakPolarHBondContact O-CB 3.41Å; M215-M218 PolarHBondContact O-N 2.99Å
219	I	96.4	Very high	96.1	Very high	12 Å²	12	23.8 Å²	23.8	6%	0.062	15%	0.146	C	C	.	.	H	α-helix	trans	-81.5	-38.3	-179.6	-67.5	156.8	0	0	0	111.9	M128 M215 G216 E217 F275 L279 F280 L298	M128-I219 HydrophobicContact CE-CG1 3.71Å; M128-I219 HydrophobicContact SD-CD1 4.08Å; M128-I219 HydrophobicContact SD-CG1 3.76Å; M215-I219 HydrophobicContact CE-CD1 4.19Å; M215-I219 HydrophobicContact CG-CD1 4.05Å; M215-I219 WeakPolarHBondContact O-CD1 3.46Å; M215-I219 WeakPolarHBondContact O-CG1 3.49Å; M215-I219 PolarHBondContact O-N 2.91Å; M215-I219 VanDerWaalsContact O-N 3.16Å; G216-I219 PolarHBondContact O-N 3.03Å; E217-I219 PolarHBondContact O-N 2.87Å; I219-F275 HydrophobicContact CB-CD1 4.34Å; I219-F275 HydrophobicContact CG2-CD1 3.93Å; I219-L279 HydrophobicContact CG2-CB 3.82Å; I219-L279 HydrophobicContact CG2-CD1 4.29Å; I219-F280 HydrophobicContact CD1-CE1 3.55Å; I219-F280 HydrophobicContact CD1-CZ 3.88Å; I219-F280 HydrophobicContact CG1-CE1 3.82Å; I219-F280 HydrophobicContact CG1-CZ 4.34Å; I219-F280 HydrophobicContact CG2-CD1 4.35Å; I219-F280 HydrophobicContact CG2-CE1 3.83Å; I219-F280 HydrophobicContact CG2-CE2 4.15Å; I219-F280 HydrophobicContact CG2-CZ 3.72Å; I219-L298 HydrophobicContact CD1-CD1 3.53Å; I219-L298 HydrophobicContact CD1-CG 4.5Å
220	K	95.3	Very high	95.5	Very high	80 Å²	80	26.4 Å²	26.4	35%	0.348	16%	0.158	S	C	.	.	H	α-helix	trans	-89.7	-14.6	-177	-69.5	-175.8	72.2	174.3	0	113.9	G216 E217 A222 L224 F275 L279	G216-K220 WeakPolarHBondContact O-CB 3.43Å; G216-K220 WeakPolarHBondContact O-CG 3.3Å; G216-K220 PolarHBondContact O-N 3.24Å; E217-K220 PolarHBondContact O-N 3.18Å; K220-A222 PolarHBondContact O-N 3.06Å; K220-L224 HydrophobicContact CD-CD2 3.55Å; K220-L224 HydrophobicContact CG-CD2 4.38Å; K220-F275 HydrophobicContact CD-CD1 4.04Å; K220-F275 HydrophobicContact CD-CE1 3.67Å; K220-F275 HydrophobicContact CD-CZ 4.46Å; K220-F275 HydrophobicContact CG-CD1 3.91Å; K220-F275 HydrophobicContact CG-CE1 3.82Å; K220-L279 HydrophobicContact CG-CD1 3.8Å
221	G	94.2	Very high	95.1	Very high	32 Å²	32	30 Å²	30	33%	0.33	18%	0.177	S	C	.	.	S	Bend	trans	67.5	5.7	-170.6	0	0	0	0	0	114.4	E217	E217-G221 WeakPolarHBondContact O-CA 3.38Å; E217-G221 PolarHBondContact O-N 2.81Å
222	A	94.2	Very high	94.8	Very high	53 Å²	53	31.6 Å²	31.6	44%	0.438	19%	0.185	S	C	.	.	S	Bend	trans	-147.1	147.4	-174.6	0	0	0	0	0	112.1	K220 L224	K220-A222 PolarHBondContact O-N 3.06Å; A222-L224 PolarHBondContact O-N 2.84Å
223	V	96.5	Very high	94.5	Very high	44 Å²	44	31.6 Å²	31.6	27%	0.267	19%	0.185	S	C	.	.			trans	-51.7	127.4	178.3	176.4	0	0	0	0	111	Y190 P226	Y190-V223 HydrophobicContact CD1-CG1 4.46Å; Y190-V223 HydrophobicContact CD2-CB 4.48Å; Y190-V223 HydrophobicContact CD2-CG1 3.6Å; Y190-V223 HydrophobicContact CD2-CG2 4.11Å; Y190-V223 HydrophobicContact CE2-CG1 4.39Å; Y190-V223 HydrophobicContact CG-CG1 3.65Å; V223-P226 HydrophobicContact CB-CB 4.44Å; V223-P226 HydrophobicContact CG1-CB 4.05Å
224	L	97.2	Very high	94.4	Very high	6 Å²	6	31.6 Å²	31.6	3%	0.031	19%	0.185	C	C	.	.	S	Bend	trans	-66.2	-44.4	-178.3	-62.8	-170.4	0	0	0	113.3	K220 A222 P226 Q240 F275 L302	K220-L224 HydrophobicContact CD-CD2 3.55Å; K220-L224 HydrophobicContact CG-CD2 4.38Å; A222-L224 PolarHBondContact O-N 2.84Å; L224-P226 WeakPolarHBondContact O-CD 3.29Å; L224-Q240 PolarHBondContact O-NE2 3.39Å; L224-F275 HydrophobicContact CD1-CZ 4.19Å; L224-F275 HydrophobicContact CD2-CE1 4.06Å; L224-F275 HydrophobicContact CD2-CZ 4.06Å; L224-L302 HydrophobicContact CD1-CD1 3.69Å; L224-L302 HydrophobicContact CD1-CD2 4.41Å
225	F	97.4	Very high	94.2	Very high	3 Å²	3	33 Å²	33	1%	0.013	19%	0.193	C	C	.	.			trans	-129.5	75.3	-170.8	-49.1	-61.5	0	0	0	110.3	Y190 W209 G227 Q233 K236 V237 Q240 L241 L302	Y190-F225 VanDerWaalsContact CD1-O 3.28Å; Y190-F225 WeakPolarHBondContact CD1-O 3.13Å; W209-F225 HydrophobicContact CH2-CE2 4.22Å; W209-F225 HydrophobicContact CH2-CZ 4.47Å; W209-F225 HydrophobicContact CZ2-CD2 4.09Å; W209-F225 AromaticContact CZ2-CE2 3.7Å; W209-F225 HydrophobicContact CZ2-CE2 3.7Å; W209-F225 HydrophobicContact CZ2-CZ 4.35Å; F225-G227 PolarHBondContact O-N 3.5Å; F225-Q233 VanDerWaalsContact O-CD 3.3Å; F225-Q233 PolarHBondContact O-NE2 3.17Å; F225-Q233 PolarHBondContact O-OE1 2.96Å; F225-K236 HydrophobicContact CB-CB 4.22Å; F225-K236 HydrophobicContact CD1-CB 4.45Å; F225-V237 HydrophobicContact CB-CG2 4.19Å; F225-V237 HydrophobicContact CD1-CB 4.48Å; F225-V237 HydrophobicContact CD1-CG2 3.89Å; F225-V237 HydrophobicContact CD2-CG2 4.11Å; F225-V237 HydrophobicContact CE1-CG2 4.3Å; F225-V237 HydrophobicContact CE2-CG2 4.5Å; F225-V237 HydrophobicContact CG-CG2 3.79Å; F225-Q240 HydrophobicContact CE1-CB 4.16Å; F225-L241 HydrophobicContact CZ-CD1 4.08Å; F225-L241 HydrophobicContact CZ-CG 4.34Å; F225-L302 HydrophobicContact CE2-CD2 4.16Å
226	P	95.5	Very high	94.1	Very high	60 Å²	60	36 Å²	36	39%	0.39	21%	0.206	S	C	.	.			trans	-83.2	73	-175.7	33.3	-35.2	0	0	0	111.8	Y190 V223 L224	Y190-P226 HydrophobicContact CE1-CB 4.42Å; V223-P226 HydrophobicContact CB-CB 4.44Å; V223-P226 HydrophobicContact CG1-CB 4.05Å; L224-P226 WeakPolarHBondContact O-CD 3.29Å
227	G	92.9	Very high	94.1	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.206	C	C	.	.			trans	-82.2	126.4	-179.2	0	0	0	0	0	114.3	R189 Y190 F225 D229 Q233	R189-G227 PolarHBondContact NH1-O 3.21Å; Y190-G227 WeakPolarHBondContact CE1-O 3.24Å; F225-G227 PolarHBondContact O-N 3.5Å; G227-D229 VanDerWaalsContact C-N 3.3Å; G227-D229 PolarHBondContact O-N 3.35Å; G227-Q233 VanDerWaalsContact CA-OE1 3.25Å
228	T	89.9	Confident	94.1	Very high	108 Å²	108	35.4 Å²	35.4	66%	0.663	20%	0.203	S	C	*	.	S	Bend	trans	-66.3	-30.1	178.8	52.8	0	0	0	0	113.3	R189 D232	R189-T228 PolarHBondContact NH1-O 3.01Å; T228-D232 PolarHBondContact N-OD2 2.95Å; T228-D232 WeakPolarHBondContact OG1-CB 3.25Å; T228-D232 PolarHBondContact OG1-OD2 2.82Å
229	D	86.8	Confident	94.1	Very high	70 Å²	70	38.4 Å²	38.4	37%	0.374	22%	0.217	S	C	.	.	S	Bend	trans	-144.7	-172.6	172.4	64.6	31.1	0	0	0	111.3	R189 G227 I231 D232 Q233	R189-D229 WeakPolarHBondContact CD-O 3Å; G227-D229 VanDerWaalsContact C-N 3.3Å; G227-D229 PolarHBondContact O-N 3.35Å; D229-I231 VanDerWaalsContact C-N 3.27Å; D229-I231 PolarHBondContact O-N 3.22Å; D229-I231 WeakPolarHBondContact OD1-CA 3.41Å; D229-I231 VanDerWaalsContact OD1-CB 3.29Å; D229-I231 WeakPolarHBondContact OD1-CB 3.34Å; D229-I231 PolarHBondContact OD1-N 3.22Å; D229-D232 PolarHBondContact OD1-N 3.24Å; D229-Q233 WeakPolarHBondContact O-CB 3.33Å; D229-Q233 PolarHBondContact O-N 3Å
230	H	86.2	Confident	94.2	Very high	55 Å²	55	39.5 Å²	39.5	26%	0.255	22%	0.222	S	C	.	.	H	α-helix	trans	-64.4	-31.3	179.3	-73.2	-87.5	0	0	0	113.5	I197 W234	I197-H230 HydrophobicContact CG2-CB 4.28Å; H230-W234 PolarHBondContact O-N 3.25Å
231	I	88.1	Confident	94.3	Very high	79 Å²	79	37.3 Å²	37.3	41%	0.405	21%	0.214	S	C	.	.	H	α-helix	trans	-74	-51.1	-178.6	-74.6	173.6	0	0	0	109.5	D229 Q233 W234 N235 Y259	D229-I231 VanDerWaalsContact C-N 3.27Å; D229-I231 PolarHBondContact O-N 3.22Å; D229-I231 WeakPolarHBondContact OD1-CA 3.41Å; D229-I231 VanDerWaalsContact OD1-CB 3.29Å; D229-I231 WeakPolarHBondContact OD1-CB 3.34Å; D229-I231 PolarHBondContact OD1-N 3.22Å; I231-Q233 VanDerWaalsContact C-N 3.34Å; I231-W234 WeakPolarHBondContact O-CB 3.41Å; I231-W234 PolarHBondContact O-N 3.3Å; I231-N235 PolarHBondContact O-N 3.35Å; I231-N235 VanDerWaalsContact O-N 3.08Å; I231-N235 PolarHBondContact O-ND2 3.19Å; I231-Y259 WeakPolarHBondContact CA-OH 3.34Å; I231-Y259 VanDerWaalsContact CB-OH 3.31Å; I231-Y259 WeakPolarHBondContact CB-OH 3.46Å; I231-Y259 HydrophobicContact CD1-CE2 4.03Å; I231-Y259 HydrophobicContact CG1-CE2 3.88Å; I231-Y259 WeakPolarHBondContact CG1-OH 3.45Å; I231-Y259 HydrophobicContact CG2-CE2 4.41Å; I231-Y259 WeakPolarHBondContact CG2-OH 3.42Å
232	D	92.2	Very high	94.5	Very high	32 Å²	32	36 Å²	36	17%	0.171	20%	0.2	C	C	.	.	H	α-helix	trans	-65.3	-39.5	177.9	-173.6	39.5	0	0	0	110.9	T228 D229 W234 N235 K236	T228-D232 PolarHBondContact N-OD2 2.95Å; T228-D232 WeakPolarHBondContact OG1-CB 3.25Å; T228-D232 PolarHBondContact OG1-OD2 2.82Å; D229-D232 PolarHBondContact OD1-N 3.24Å; D232-W234 VanDerWaalsContact C-N 3.29Å; D232-W234 PolarHBondContact O-N 3.38Å; D232-N235 WeakPolarHBondContact O-CB 3.41Å; D232-N235 PolarHBondContact O-N 3.13Å; D232-N235 VanDerWaalsContact O-N 3.07Å; D232-K236 WeakPolarHBondContact O-CG 3.37Å; D232-K236 PolarHBondContact O-N 3.22Å
233	Q	94.3	Very high	94.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-54.4	-46.4	173.2	-174.3	67	33.3	0	0	112	R189 I197 F225 G227 D229 I231 K236 V237	R189-Q233 HydrophobicContact CG-CB 4.38Å; R189-Q233 HydrophobicContact CG-CG 4.21Å; I197-Q233 HydrophobicContact CD1-CB 4.47Å; I197-Q233 HydrophobicContact CD1-CG 3.44Å; I197-Q233 VanDerWaalsContact CD1-CG 3.44Å; I197-Q233 HydrophobicContact CG1-CG 4.35Å; F225-Q233 VanDerWaalsContact O-CD 3.3Å; F225-Q233 PolarHBondContact O-NE2 3.17Å; F225-Q233 PolarHBondContact O-OE1 2.96Å; G227-Q233 VanDerWaalsContact CA-OE1 3.25Å; D229-Q233 WeakPolarHBondContact O-CB 3.33Å; D229-Q233 PolarHBondContact O-N 3Å; I231-Q233 VanDerWaalsContact C-N 3.34Å; Q233-K236 PolarHBondContact O-N 3.27Å; Q233-V237 WeakPolarHBondContact O-CG2 3.42Å; Q233-V237 PolarHBondContact O-N 3.14Å
234	W	95.1	Very high	94.5	Very high	2 Å²	2	34 Å²	34	1%	0.008	18%	0.183	C	C	.	.	H	α-helix	trans	-62.8	-42.8	176.4	175.5	-110	0	0	0	112	P194 L198 H230 I231 D232 V237 I238 P244 F248 V260 I304	P194-W234 HydrophobicContact CB-CZ3 3.99Å; P194-W234 HydrophobicContact CG-CZ3 4.45Å; L198-W234 HydrophobicContact CD1-CD2 4.46Å; L198-W234 HydrophobicContact CD1-CE3 4.03Å; L198-W234 HydrophobicContact CD1-CH2 3.95Å; L198-W234 HydrophobicContact CD1-CZ2 4.38Å; L198-W234 HydrophobicContact CD1-CZ3 3.79Å; L198-W234 HydrophobicContact CD2-CD2 4.22Å; L198-W234 HydrophobicContact CD2-CE3 4.34Å; L198-W234 HydrophobicContact CD2-CG 4.48Å; L198-W234 HydrophobicContact CG-CE3 4.35Å; H230-W234 PolarHBondContact O-N 3.25Å; I231-W234 WeakPolarHBondContact O-CB 3.41Å; I231-W234 PolarHBondContact O-N 3.3Å; D232-W234 VanDerWaalsContact C-N 3.29Å; D232-W234 PolarHBondContact O-N 3.38Å; W234-V237 HydrophobicContact CZ3-CG1 4.41Å; W234-V237 WeakPolarHBondContact O-CB 3.49Å; W234-V237 PolarHBondContact O-N 3.44Å; W234-I238 HydrophobicContact CD2-CG2 4.08Å; W234-I238 HydrophobicContact CE3-CG2 4.34Å; W234-I238 HydrophobicContact CH2-CG2 3.68Å; W234-I238 HydrophobicContact CZ2-CG2 3.35Å; W234-I238 HydrophobicContact CZ3-CG2 4.14Å; W234-I238 WeakPolarHBondContact O-CG1 3.26Å; W234-I238 PolarHBondContact O-N 2.82Å; W234-I238 VanDerWaalsContact O-N 3.08Å; W234-P244 HydrophobicContact CH2-CG 3.92Å; W234-P244 HydrophobicContact CZ2-CG 4.12Å; W234-F248 HydrophobicContact CH2-CE1 4.16Å; W234-V260 HydrophobicContact CZ2-CG1 3.51Å; W234-V260 HydrophobicContact CZ2-CG2 4.32Å; W234-I304 HydrophobicContact CH2-CG2 4.01Å; W234-I304 HydrophobicContact CZ3-CG2 4.19Å
235	N	94.9	Very high	94.3	Very high	30 Å²	30	35.5 Å²	35.5	16%	0.16	19%	0.193	C	C	.	.	H	α-helix	trans	-59.7	-47.8	177.7	-65.8	-22.9	0	0	0	111.6	I231 D232 V237 I238 E239	I231-N235 PolarHBondContact O-N 3.35Å; I231-N235 VanDerWaalsContact O-N 3.08Å; I231-N235 PolarHBondContact O-ND2 3.19Å; D232-N235 WeakPolarHBondContact O-CB 3.41Å; D232-N235 PolarHBondContact O-N 3.13Å; D232-N235 VanDerWaalsContact O-N 3.07Å; N235-V237 PolarHBondContact O-N 3.05Å; N235-I238 WeakPolarHBondContact O-CG1 3.47Å; N235-I238 PolarHBondContact O-N 2.71Å; N235-E239 WeakPolarHBondContact O-CB 3.12Å; N235-E239 VanDerWaalsContact O-CG 3.24Å; N235-E239 WeakPolarHBondContact O-CG 3.47Å; N235-E239 PolarHBondContact O-N 2.95Å
236	K	97.1	Very high	94.1	Very high	63 Å²	63	39.3 Å²	39.3	27%	0.274	22%	0.218	S	C	.	.	H	α-helix	trans	-56.9	-34.6	176.9	-62.8	-53.2	177.5	-167.6	0	113	F225 D232 Q233 Q240	F225-K236 HydrophobicContact CB-CB 4.22Å; F225-K236 HydrophobicContact CD1-CB 4.45Å; D232-K236 WeakPolarHBondContact O-CG 3.37Å; D232-K236 PolarHBondContact O-N 3.22Å; Q233-K236 PolarHBondContact O-N 3.27Å; K236-Q240 PolarHBondContact O-NE2 3.2Å
237	V	97.8	Very high	94	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-69.5	-53.5	177.4	168.8	0	0	0	0	111	W209 F225 Q233 W234 N235 E239 Q240 L241 I304	W209-V237 HydrophobicContact CH2-CG1 3.73Å; W209-V237 HydrophobicContact CH2-CG2 4.3Å; W209-V237 HydrophobicContact CZ2-CG1 4.16Å; W209-V237 HydrophobicContact CZ2-CG2 3.89Å; F225-V237 HydrophobicContact CB-CG2 4.19Å; F225-V237 HydrophobicContact CD1-CB 4.48Å; F225-V237 HydrophobicContact CD1-CG2 3.89Å; F225-V237 HydrophobicContact CD2-CG2 4.11Å; F225-V237 HydrophobicContact CE1-CG2 4.3Å; F225-V237 HydrophobicContact CE2-CG2 4.5Å; F225-V237 HydrophobicContact CG-CG2 3.79Å; Q233-V237 WeakPolarHBondContact O-CG2 3.42Å; Q233-V237 PolarHBondContact O-N 3.14Å; W234-V237 HydrophobicContact CZ3-CG1 4.41Å; W234-V237 WeakPolarHBondContact O-CB 3.49Å; W234-V237 PolarHBondContact O-N 3.44Å; N235-V237 PolarHBondContact O-N 3.05Å; V237-E239 PolarHBondContact O-N 3.37Å; V237-Q240 PolarHBondContact O-N 3.31Å; V237-L241 HydrophobicContact CG1-CD1 4.23Å; V237-L241 WeakPolarHBondContact O-CB 3.37Å; V237-L241 PolarHBondContact O-N 3.49Å; V237-I304 HydrophobicContact CG1-CD1 3.99Å; V237-I304 HydrophobicContact CG1-CG1 4.05Å
238	I	97.1	Very high	94.1	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-72.9	-27.7	-175.6	61.4	173.7	0	0	0	113.4	W234 N235 Q240 G242 R263 Y266 I304	W234-I238 HydrophobicContact CD2-CG2 4.08Å; W234-I238 HydrophobicContact CE3-CG2 4.34Å; W234-I238 HydrophobicContact CH2-CG2 3.68Å; W234-I238 HydrophobicContact CZ2-CG2 3.35Å; W234-I238 HydrophobicContact CZ3-CG2 4.14Å; W234-I238 WeakPolarHBondContact O-CG1 3.26Å; W234-I238 PolarHBondContact O-N 2.82Å; W234-I238 VanDerWaalsContact O-N 3.08Å; N235-I238 WeakPolarHBondContact O-CG1 3.47Å; N235-I238 PolarHBondContact O-N 2.71Å; I238-Q240 PolarHBondContact O-N 3.15Å; I238-G242 CarbonylContact O-C 3.42Å; I238-G242 WeakPolarHBondContact O-CA 3.22Å; I238-G242 PolarHBondContact O-N 2.79Å; I238-R263 HydrophobicContact CD1-CB 4.05Å; I238-Y266 HydrophobicContact CB-CD2 4.35Å; I238-Y266 HydrophobicContact CD1-CD2 3.92Å; I238-Y266 HydrophobicContact CD1-CE2 4.05Å; I238-Y266 HydrophobicContact CG1-CD2 3.83Å; I238-Y266 HydrophobicContact CG1-CE2 4.11Å; I238-Y266 VanDerWaalsContact O-CB 3.22Å; I238-Y266 WeakPolarHBondContact O-CB 3.17Å; I238-I304 HydrophobicContact CG2-CD1 4.33Å
239	E	97.3	Very high	94.3	Very high	74 Å²	74	36.6 Å²	36.6	35%	0.346	19%	0.193	S	C	.	.	H	α-helix	trans	-60.9	-35.3	173.4	-78.2	167.2	-166.1	0	0	111.5	N235 V237 Y266	N235-E239 WeakPolarHBondContact O-CB 3.12Å; N235-E239 VanDerWaalsContact O-CG 3.24Å; N235-E239 WeakPolarHBondContact O-CG 3.47Å; N235-E239 PolarHBondContact O-N 2.95Å; V237-E239 PolarHBondContact O-N 3.37Å; E239-Y266 HydrophobicContact CG-CD1 4.32Å; E239-Y266 HydrophobicContact CG-CD2 4.21Å; E239-Y266 HydrophobicContact CG-CE1 3.88Å; E239-Y266 HydrophobicContact CG-CE2 3.72Å; E239-Y266 HydrophobicContact CG-CG 4.47Å
240	Q	97.8	Very high	94.6	Very high	35 Å²	35	39.8 Å²	39.8	16%	0.164	20%	0.203	C	C	.	.	H	α-helix	trans	-92.6	-44.2	-179	-73.8	-176.6	79.8	0	0	113.3	L224 F225 K236 V237 I238 G268 L269 L274	L224-Q240 PolarHBondContact O-NE2 3.39Å; F225-Q240 HydrophobicContact CE1-CB 4.16Å; K236-Q240 PolarHBondContact O-NE2 3.2Å; V237-Q240 PolarHBondContact O-N 3.31Å; I238-Q240 PolarHBondContact O-N 3.15Å; Q240-G268 WeakPolarHBondContact O-CA 3.36Å; Q240-L269 PolarHBondContact O-N 2.71Å; Q240-L274 HydrophobicContact CB-CD2 3.94Å; Q240-L274 HydrophobicContact CG-CD2 4.05Å
241	L	98.1	Very high	94.9	Very high	35 Å²	35	42 Å²	42	18%	0.183	21%	0.212	C	C	.	.	H	α-helix	trans	-98.9	-7	-173.2	-58.1	-177.7	0	0	0	113.8	W209 F225 V237 F271 L274 L302 I304	W209-L241 HydrophobicContact CH2-CD1 3.56Å; W209-L241 HydrophobicContact CZ3-CD1 3.88Å; F225-L241 HydrophobicContact CZ-CD1 4.08Å; F225-L241 HydrophobicContact CZ-CG 4.34Å; V237-L241 HydrophobicContact CG1-CD1 4.23Å; V237-L241 WeakPolarHBondContact O-CB 3.37Å; V237-L241 PolarHBondContact O-N 3.49Å; L241-F271 HydrophobicContact CD2-CZ 4.03Å; L241-L274 HydrophobicContact CD2-CD1 3.91Å; L241-L302 HydrophobicContact CD1-CB 4.36Å; L241-I304 HydrophobicContact CB-CD1 4.11Å; L241-I304 HydrophobicContact CB-CG1 4.39Å; L241-I304 HydrophobicContact CD1-CG1 4.2Å
242	G	97.4	Very high	95.2	Very high	4 Å²	4	38.8 Å²	38.8	4%	0.041	20%	0.196	C	C	.	.			trans	88.8	163.3	-178.1	0	0	0	0	0	113.5	I238 Y266 G268 I304	I238-G242 CarbonylContact O-C 3.42Å; I238-G242 WeakPolarHBondContact O-CA 3.22Å; I238-G242 PolarHBondContact O-N 2.79Å; G242-Y266 CarbonylContact C-O 3.54Å; G242-Y266 VanDerWaalsContact CA-O 3.25Å; G242-Y266 WeakPolarHBondContact CA-O 3.49Å; G242-G268 VanDerWaalsContact N-CA 3.31Å; G242-I304 WeakPolarHBondContact O-CD1 3.4Å
243	T	96.6	Very high	95.1	Very high	35 Å²	35	43.3 Å²	43.3	22%	0.215	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-70.7	128.9	174.7	-55.8	0	0	0	0	109.9	M249 K265 Y266	T243-M249 HydrophobicContact CG2-CE 3.69Å; T243-K265 HydrophobicContact CG2-CD 3.79Å; T243-K265 WeakPolarHBondContact OG1-CA 3.3Å; T243-Y266 PolarHBondContact N-O 2.75Å; T243-Y266 PolarHBondContact OG1-N 3.47Å
244	P	94.5	Very high	95	Very high	21 Å²	21	47.5 Å²	47.5	14%	0.136	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-70.1	162.8	-176.5	30.4	-37.1	0	0	0	112.4	W234 F248 M249 I304	W234-P244 HydrophobicContact CH2-CG 3.92Å; W234-P244 HydrophobicContact CZ2-CG 4.12Å; P244-F248 HydrophobicContact CB-CB 4.1Å; P244-F248 HydrophobicContact CB-CD1 3.6Å; P244-F248 HydrophobicContact CB-CE1 4.23Å; P244-F248 HydrophobicContact CB-CG 3.93Å; P244-F248 HydrophobicContact CG-CD1 3.41Å; P244-F248 VanDerWaalsContact CG-CD1 3.41Å; P244-F248 HydrophobicContact CG-CE1 3.73Å; P244-F248 HydrophobicContact CG-CG 4.26Å; P244-M249 HydrophobicContact CG-CE 3.45Å; P244-M249 VanDerWaalsContact CG-CE 3.45Å; P244-M249 HydrophobicContact CG-SD 3.97Å; P244-I304 HydrophobicContact CB-CB 4.42Å; P244-I304 HydrophobicContact CB-CD1 4.45Å; P244-I304 HydrophobicContact CB-CG2 3.9Å; P244-I304 HydrophobicContact CG-CG2 4.14Å
245	C	92.7	Very high	94.8	Very high	36 Å²	36	52.7 Å²	52.7	24%	0.243	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-68.4	159.2	-174.3	68.7	0	0	0	0	113.1	E247 F248 M249	C245-E247 VanDerWaalsContact CB-OE2 3.31Å; C245-E247 WeakPolarHBondContact CB-OE2 3.09Å; C245-E247 PolarHBondContact O-N 2.98Å; C245-E247 VanDerWaalsContact O-N 3.16Å; C245-E247 PolarHBondContact SG-OE2 3.3Å; C245-F248 WeakPolarHBondContact O-CB 3.37Å; C245-F248 PolarHBondContact O-N 3.29Å; C245-M249 PolarHBondContact O-N 3.3Å
246	P	93.4	Very high	94.6	Very high	83 Å²	83	53 Å²	53	54%	0.539	28%	0.279	S	S	.	.	H	α-helix	trans	-56.1	-31.8	179.1	-26.4	36.1	0	0	0	114.1	F248 M249 K250	P246-F248 VanDerWaalsContact C-N 3.29Å; P246-F248 PolarHBondContact O-N 2.96Å; P246-M249 PolarHBondContact O-N 3.1Å; P246-K250 WeakPolarHBondContact O-CG 3.28Å; P246-K250 PolarHBondContact O-N 3.14Å
247	E	94.1	Very high	94.4	Very high	106 Å²	106	53.8 Å²	53.8	50%	0.495	28%	0.28	S	S	.	.	H	α-helix	trans	-63.9	-35.4	177.5	-61.7	67.7	-141.4	0	0	111.9	C245	C245-E247 VanDerWaalsContact CB-OE2 3.31Å; C245-E247 WeakPolarHBondContact CB-OE2 3.09Å; C245-E247 PolarHBondContact O-N 2.98Å; C245-E247 VanDerWaalsContact O-N 3.16Å; C245-E247 PolarHBondContact SG-OE2 3.3Å
248	F	94.5	Very high	94.1	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-68.4	-47.5	172.6	172.7	-92	0	0	0	110.6	L198 M200 W234 P244 C245 P246 K250 K251 L252 I304 D305	L198-F248 HydrophobicContact CD1-CE1 4.07Å; L198-F248 HydrophobicContact CD1-CZ 3.92Å; M200-F248 HydrophobicContact CE-CD2 4.35Å; M200-F248 HydrophobicContact CE-CE2 3.83Å; M200-F248 HydrophobicContact CE-CZ 4.22Å; M200-F248 HydrophobicContact SD-CE2 3.86Å; M200-F248 HydrophobicContact SD-CZ 3.73Å; W234-F248 HydrophobicContact CH2-CE1 4.16Å; P244-F248 HydrophobicContact CB-CB 4.1Å; P244-F248 HydrophobicContact CB-CD1 3.6Å; P244-F248 HydrophobicContact CB-CE1 4.23Å; P244-F248 HydrophobicContact CB-CG 3.93Å; P244-F248 HydrophobicContact CG-CD1 3.41Å; P244-F248 VanDerWaalsContact CG-CD1 3.41Å; P244-F248 HydrophobicContact CG-CE1 3.73Å; P244-F248 HydrophobicContact CG-CG 4.26Å; C245-F248 WeakPolarHBondContact O-CB 3.37Å; C245-F248 PolarHBondContact O-N 3.29Å; P246-F248 VanDerWaalsContact C-N 3.29Å; P246-F248 PolarHBondContact O-N 2.96Å; F248-K250 PolarHBondContact O-N 2.9Å; F248-K251 WeakPolarHBondContact O-CB 3.26Å; F248-K251 PolarHBondContact O-N 3.47Å; F248-L252 HydrophobicContact CE1-CD1 4.38Å; F248-L252 HydrophobicContact CE1-CD2 4.28Å; F248-L252 HydrophobicContact CZ-CD2 4.43Å; F248-I304 HydrophobicContact CD2-CG2 4.45Å; F248-I304 HydrophobicContact CE1-CG2 4.1Å; F248-I304 HydrophobicContact CE2-CG2 3.98Å; F248-I304 HydrophobicContact CZ-CG2 3.79Å; F248-D305 HydrophobicContact CD2-CB 3.92Å
249	M	93.5	Very high	93.6	Very high	5 Å²	5	61.1 Å²	61.1	3%	0.025	32%	0.315	C	S	.	.	H	α-helix	trans	-59.3	-34.6	-178.5	-58.8	-56.7	-165.7	0	0	112.7	T243 P244 C245 P246 K251 L252 R257 V260 E261	T243-M249 HydrophobicContact CG2-CE 3.69Å; P244-M249 HydrophobicContact CG-CE 3.45Å; P244-M249 VanDerWaalsContact CG-CE 3.45Å; P244-M249 HydrophobicContact CG-SD 3.97Å; C245-M249 PolarHBondContact O-N 3.3Å; P246-M249 PolarHBondContact O-N 3.1Å; M249-K251 PolarHBondContact O-N 2.66Å; M249-L252 WeakPolarHBondContact O-CB 3.23Å; M249-L252 PolarHBondContact O-N 3.22Å; M249-L252 VanDerWaalsContact O-N 3.13Å; M249-L252 HydrophobicContact SD-CD1 3.87Å; M249-R257 WeakPolarHBondContact O-CD 3.36Å; M249-V260 HydrophobicContact CE-CG1 3.35Å; M249-V260 HydrophobicContact SD-CB 4.25Å; M249-V260 HydrophobicContact SD-CG1 3.38Å; M249-V260 WeakPolarHBondContact SD-CG1 3.5Å; M249-E261 HydrophobicContact CG-CG 4.47Å
250	K	93.9	Very high	93.3	Very high	137 Å²	137	57.8 Å²	57.8	60%	0.596	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-21.7	176.2	-75.7	172.9	-176.5	174.8	0	113.9	P246 F248 L252	P246-K250 WeakPolarHBondContact O-CG 3.28Å; P246-K250 PolarHBondContact O-N 3.14Å; F248-K250 PolarHBondContact O-N 2.9Å; K250-L252 VanDerWaalsContact C-N 3.32Å
251	K	93.3	Very high	93	Very high	101 Å²	101	59.2 Å²	59.2	44%	0.439	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-9.8	178.9	-56.5	167.3	-172.1	170	0	112.6	M200 F248 M249 D305	M200-K251 HydrophobicContact CE-CB 3.76Å; M200-K251 HydrophobicContact CE-CD 4.4Å; F248-K251 WeakPolarHBondContact O-CB 3.26Å; F248-K251 PolarHBondContact O-N 3.47Å; M249-K251 PolarHBondContact O-N 2.66Å; K251-D305 VanDerWaalsContact NZ-CG 3.28Å; K251-D305 IonicContact NZ-OD1 3.33Å; K251-D305 PolarHBondContact NZ-OD1 2.9Å; K251-D305 IonicContact NZ-OD2 2.88Å; K251-D305 PolarHBondContact NZ-OD2 3.44Å
252	L	92.7	Very high	92.7	Very high	12 Å²	12	63.9 Å²	63.9	6%	0.063	33%	0.331	C	S	.	.	S	Bend	trans	-81.1	149.2	-177.6	-60.2	176.5	0	0	0	111.7	L198 M200 F248 M249 K250 V256 R257 V260	L198-L252 HydrophobicContact CB-CD2 4.1Å; L198-L252 HydrophobicContact CD1-CD2 3.87Å; M200-L252 HydrophobicContact CE-CD2 4.13Å; M200-L252 HydrophobicContact CG-CD2 3.68Å; M200-L252 HydrophobicContact SD-CD2 3.4Å; M200-L252 WeakPolarHBondContact SD-CD2 3.28Å; F248-L252 HydrophobicContact CE1-CD1 4.38Å; F248-L252 HydrophobicContact CE1-CD2 4.28Å; F248-L252 HydrophobicContact CZ-CD2 4.43Å; M249-L252 WeakPolarHBondContact O-CB 3.23Å; M249-L252 PolarHBondContact O-N 3.22Å; M249-L252 VanDerWaalsContact O-N 3.13Å; M249-L252 HydrophobicContact SD-CD1 3.87Å; K250-L252 VanDerWaalsContact C-N 3.32Å; L252-V256 HydrophobicContact CD2-CG1 4.4Å; L252-R257 HydrophobicContact CB-CB 3.82Å; L252-R257 HydrophobicContact CB-CG 4.4Å; L252-R257 HydrophobicContact CD1-CB 4.5Å; L252-V260 HydrophobicContact CD1-CB 4.02Å; L252-V260 HydrophobicContact CD1-CG1 4.29Å; L252-V260 HydrophobicContact CD1-CG2 3.96Å
253	Q	90.8	Very high	92.4	Very high	127 Å²	127	67.4 Å²	67.4	59%	0.593	34%	0.343	S	S	*	.			trans	-59.6	146.1	168.5	-72.2	-67	-12.5	0	0	110.7	T255 V256 R257	Q253-T255 VanDerWaalsContact C-N 3.33Å; Q253-T255 PolarHBondContact O-N 2.96Å; Q253-T255 VanDerWaalsContact O-N 3.15Å; Q253-V256 HydrophobicContact CB-CG2 4.31Å; Q253-V256 PolarHBondContact O-N 3.03Å; Q253-V256 VanDerWaalsContact O-N 3.08Å; Q253-R257 WeakPolarHBondContact O-CB 3.49Å; Q253-R257 PolarHBondContact O-N 2.75Å
254	P	92.1	Very high	92.3	Very high	88 Å²	88	69.2 Å²	69.2	57%	0.571	36%	0.356	S	S	*	.	H	α-helix	trans	-53.4	-42.2	-170.9	-29	35.1	0	0	0	115.1	R257 N258	P254-R257 PolarHBondContact O-N 2.69Å; P254-N258 PolarHBondContact O-N 2.93Å; P254-N258 PolarHBondContact O-ND2 3.12Å
255	T	90.7	Very high	92.3	Very high	112 Å²	112	74.8 Å²	74.8	69%	0.687	38%	0.378	S	S	*	.	H	α-helix	trans	-66.5	-46	178.6	48.6	0	0	0	0	112.1	Q253 Y259	Q253-T255 VanDerWaalsContact C-N 3.33Å; Q253-T255 PolarHBondContact O-N 2.96Å; Q253-T255 VanDerWaalsContact O-N 3.15Å; T255-Y259 PolarHBondContact O-N 2.96Å; T255-Y259 VanDerWaalsContact O-N 3.14Å
256	V	90.5	Very high	92.5	Very high	37 Å²	37	76.7 Å²	76.7	22%	0.224	38%	0.38	C	S	.	.	H	α-helix	trans	-65.6	-40.6	177.1	-178.3	0	0	0	0	110.5	L198 L252 Q253 Y259 V260	L198-V256 HydrophobicContact CB-CG1 4.08Å; L198-V256 HydrophobicContact CD2-CG1 3.84Å; L252-V256 HydrophobicContact CD2-CG1 4.4Å; Q253-V256 HydrophobicContact CB-CG2 4.31Å; Q253-V256 PolarHBondContact O-N 3.03Å; Q253-V256 VanDerWaalsContact O-N 3.08Å; V256-Y259 WeakPolarHBondContact O-CB 3.49Å; V256-Y259 PolarHBondContact O-N 2.93Å; V256-V260 HydrophobicContact CG1-CG2 4.25Å; V256-V260 VanDerWaalsContact O-CG2 3.32Å; V256-V260 WeakPolarHBondContact O-CG2 3.43Å; V256-V260 PolarHBondContact O-N 3.14Å
257	R	92.8	Very high	92.6	Very high	78 Å²	78	77.9 Å²	77.9	29%	0.294	40%	0.397	S	S	.	.	H	α-helix	trans	-59.7	-51.7	177.2	-172.8	176.4	174.5	-180	-6.6	111.8	M249 L252 Q253 P254 Y259 V260 E261	M249-R257 WeakPolarHBondContact O-CD 3.36Å; L252-R257 HydrophobicContact CB-CB 3.82Å; L252-R257 HydrophobicContact CB-CG 4.4Å; L252-R257 HydrophobicContact CD1-CB 4.5Å; Q253-R257 WeakPolarHBondContact O-CB 3.49Å; Q253-R257 PolarHBondContact O-N 2.75Å; P254-R257 PolarHBondContact O-N 2.69Å; R257-Y259 PolarHBondContact O-N 3.35Å; R257-V260 PolarHBondContact O-N 3.05Å; R257-V260 VanDerWaalsContact O-N 3.14Å; R257-E261 HydrophobicContact CG-CG 4.19Å; R257-E261 IonicContact CZ-OE1 2.98Å; R257-E261 IonicContact NE-OE1 3.81Å; R257-E261 PolarHBondContact NE-OE1 3.02Å; R257-E261 IonicContact NE-OE2 3.73Å; R257-E261 IonicContact NH2-OE1 2.76Å; R257-E261 PolarHBondContact NH2-OE1 2.92Å; R257-E261 WeakPolarHBondContact O-CB 3.45Å; R257-E261 WeakPolarHBondContact O-CG 3.36Å; R257-E261 PolarHBondContact O-N 2.9Å
258	N	91.4	Very high	92.7	Very high	96 Å²	96	74.1 Å²	74.1	51%	0.513	39%	0.387	S	S	.	.	H	α-helix	trans	-56.8	-42	176.8	-75.9	-18.7	0	0	0	111.2	P254 N262	P254-N258 PolarHBondContact O-N 2.93Å; P254-N258 PolarHBondContact O-ND2 3.12Å; N258-N262 WeakPolarHBondContact O-CB 3.47Å; N258-N262 VanDerWaalsContact O-CG 3.25Å; N258-N262 PolarHBondContact O-N 3.4Å; N258-N262 PolarHBondContact O-ND2 2.86Å
259	Y	88.5	Confident	92.8	Very high	62 Å²	62	78.2 Å²	78.2	24%	0.243	41%	0.408	C	S	.	.	H	α-helix	trans	-60.5	-49.7	175.6	168	-89.3	0	0	0	112	I231 T255 V256 R257 R263	I231-Y259 WeakPolarHBondContact CA-OH 3.34Å; I231-Y259 VanDerWaalsContact CB-OH 3.31Å; I231-Y259 WeakPolarHBondContact CB-OH 3.46Å; I231-Y259 HydrophobicContact CD1-CE2 4.03Å; I231-Y259 HydrophobicContact CG1-CE2 3.88Å; I231-Y259 WeakPolarHBondContact CG1-OH 3.45Å; I231-Y259 HydrophobicContact CG2-CE2 4.41Å; I231-Y259 WeakPolarHBondContact CG2-OH 3.42Å; T255-Y259 PolarHBondContact O-N 2.96Å; T255-Y259 VanDerWaalsContact O-N 3.14Å; V256-Y259 WeakPolarHBondContact O-CB 3.49Å; V256-Y259 PolarHBondContact O-N 2.93Å; R257-Y259 PolarHBondContact O-N 3.35Å; Y259-R263 VanDerWaalsContact CZ-NE 3.32Å; Y259-R263 PolarHBondContact OH-NE 3.35Å; Y259-R263 PolarHBondContact OH-NH2 3.39Å
260	V	89.7	Confident	93	Very high	3 Å²	3	81.8 Å²	81.8	2%	0.018	43%	0.43	C	S	.	.	H	α-helix	trans	-69	-39.9	-177.5	175.8	0	0	0	0	111.9	L198 W234 M249 L252 V256 R257 N262 R263	L198-V260 HydrophobicContact CD2-CG2 3.85Å; W234-V260 HydrophobicContact CZ2-CG1 3.51Å; W234-V260 HydrophobicContact CZ2-CG2 4.32Å; M249-V260 HydrophobicContact CE-CG1 3.35Å; M249-V260 HydrophobicContact SD-CB 4.25Å; M249-V260 HydrophobicContact SD-CG1 3.38Å; M249-V260 WeakPolarHBondContact SD-CG1 3.5Å; L252-V260 HydrophobicContact CD1-CB 4.02Å; L252-V260 HydrophobicContact CD1-CG1 4.29Å; L252-V260 HydrophobicContact CD1-CG2 3.96Å; V256-V260 HydrophobicContact CG1-CG2 4.25Å; V256-V260 VanDerWaalsContact O-CG2 3.32Å; V256-V260 WeakPolarHBondContact O-CG2 3.43Å; V256-V260 PolarHBondContact O-N 3.14Å; R257-V260 PolarHBondContact O-N 3.05Å; R257-V260 VanDerWaalsContact O-N 3.14Å; V260-N262 VanDerWaalsContact C-N 3.3Å; V260-N262 PolarHBondContact O-N 3.2Å; V260-R263 WeakPolarHBondContact O-CB 3.48Å; V260-R263 PolarHBondContact O-N 3.23Å
261	E	91.4	Very high	93.2	Very high	65 Å²	65	77.1 Å²	77.1	30%	0.304	41%	0.41	S	S	.	.	H	α-helix	trans	-66.3	-32.3	-179.4	-76.2	-179.4	167.8	0	0	112.5	M249 R257 R263 K265	M249-E261 HydrophobicContact CG-CG 4.47Å; R257-E261 HydrophobicContact CG-CG 4.19Å; R257-E261 IonicContact CZ-OE1 2.98Å; R257-E261 IonicContact NE-OE1 3.81Å; R257-E261 PolarHBondContact NE-OE1 3.02Å; R257-E261 IonicContact NE-OE2 3.73Å; R257-E261 IonicContact NH2-OE1 2.76Å; R257-E261 PolarHBondContact NH2-OE1 2.92Å; R257-E261 WeakPolarHBondContact O-CB 3.45Å; R257-E261 WeakPolarHBondContact O-CG 3.36Å; R257-E261 PolarHBondContact O-N 2.9Å; E261-R263 VanDerWaalsContact C-N 3.26Å; E261-R263 PolarHBondContact O-N 3.39Å; E261-K265 PolarHBondContact O-NZ 3.45Å
262	N	91.7	Very high	93.4	Very high	134 Å²	134	75.8 Å²	75.8	72%	0.717	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	3.1	177.8	-73.6	-37.9	0	0	0	114.3	N258 V260	N258-N262 WeakPolarHBondContact O-CB 3.47Å; N258-N262 VanDerWaalsContact O-CG 3.25Å; N258-N262 PolarHBondContact O-N 3.4Å; N258-N262 PolarHBondContact O-ND2 2.86Å; V260-N262 VanDerWaalsContact C-N 3.3Å; V260-N262 PolarHBondContact O-N 3.2Å
263	R	91.4	Very high	93.6	Very high	77 Å²	77	82.5 Å²	82.5	29%	0.291	44%	0.441	S	S	.	.	S	Bend	trans	-79.7	152.7	173.3	-68.5	-69.1	171.3	-140.9	17	111.6	I238 Y259 V260 E261 K265	I238-R263 HydrophobicContact CD1-CB 4.05Å; Y259-R263 VanDerWaalsContact CZ-NE 3.32Å; Y259-R263 PolarHBondContact OH-NE 3.35Å; Y259-R263 PolarHBondContact OH-NH2 3.39Å; V260-R263 WeakPolarHBondContact O-CB 3.48Å; V260-R263 PolarHBondContact O-N 3.23Å; E261-R263 VanDerWaalsContact C-N 3.26Å; E261-R263 PolarHBondContact O-N 3.39Å; R263-K265 PolarHBondContact O-N 2.93Å
264	P	93.8	Very high	93.9	Very high	73 Å²	73	76.9 Å²	76.9	47%	0.474	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-51	139	172	-24.9	33.9	0	0	0	111.1	Y266	P264-Y266 HydrophobicContact CB-CE2 3.89Å; P264-Y266 HydrophobicContact CG-CE2 4.49Å; P264-Y266 VanDerWaalsContact O-CD2 3.26Å; P264-Y266 WeakPolarHBondContact O-CD2 3.25Å; P264-Y266 WeakPolarHBondContact O-CE2 3.44Å; P264-Y266 PolarHBondContact O-N 3.39Å
265	K	94.9	Very high	94.2	Very high	138 Å²	138	72.9 Å²	72.9	60%	0.6	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-80.6	119.9	177.2	-61.6	-58.1	-175.4	-164.9	0	109.1	T243 E261 R263	T243-K265 HydrophobicContact CG2-CD 3.79Å; T243-K265 WeakPolarHBondContact OG1-CA 3.3Å; E261-K265 PolarHBondContact O-NZ 3.45Å; R263-K265 PolarHBondContact O-N 2.93Å
266	Y	96.7	Very high	94.5	Very high	76 Å²	76	69.7 Å²	69.7	30%	0.298	37%	0.37	S	S	.	.			trans	-109.1	134	176.8	-63.8	-74.5	0	0	0	109.3	I238 E239 G242 T243 P264 G268	I238-Y266 HydrophobicContact CB-CD2 4.35Å; I238-Y266 HydrophobicContact CD1-CD2 3.92Å; I238-Y266 HydrophobicContact CD1-CE2 4.05Å; I238-Y266 HydrophobicContact CG1-CD2 3.83Å; I238-Y266 HydrophobicContact CG1-CE2 4.11Å; I238-Y266 VanDerWaalsContact O-CB 3.22Å; I238-Y266 WeakPolarHBondContact O-CB 3.17Å; E239-Y266 HydrophobicContact CG-CD1 4.32Å; E239-Y266 HydrophobicContact CG-CD2 4.21Å; E239-Y266 HydrophobicContact CG-CE1 3.88Å; E239-Y266 HydrophobicContact CG-CE2 3.72Å; E239-Y266 HydrophobicContact CG-CG 4.47Å; G242-Y266 CarbonylContact C-O 3.54Å; G242-Y266 VanDerWaalsContact CA-O 3.25Å; G242-Y266 WeakPolarHBondContact CA-O 3.49Å; T243-Y266 PolarHBondContact N-O 2.75Å; T243-Y266 PolarHBondContact OG1-N 3.47Å; P264-Y266 HydrophobicContact CB-CE2 3.89Å; P264-Y266 HydrophobicContact CG-CE2 4.49Å; P264-Y266 VanDerWaalsContact O-CD2 3.26Å; P264-Y266 WeakPolarHBondContact O-CD2 3.25Å; P264-Y266 WeakPolarHBondContact O-CE2 3.44Å; P264-Y266 PolarHBondContact O-N 3.39Å; Y266-G268 PolarHBondContact O-N 2.77Å
267	A	96	Very high	94.7	Very high	109 Å²	109	72.7 Å²	72.7	90%	0.901	38%	0.384	S	S	*	.			trans	-72.4	-21.5	174.5	0	0	0	0	0	112.6
268	G	95.7	Very high	94.7	Very high	26 Å²	26	73.9 Å²	73.9	27%	0.268	41%	0.405	S	S	.	.			trans	80	159.7	-171	0	0	0	0	0	112.5	Q240 G242 Y266	Q240-G268 WeakPolarHBondContact O-CA 3.36Å; G242-G268 VanDerWaalsContact N-CA 3.31Å; Y266-G268 PolarHBondContact O-N 2.77Å
269	L	96.9	Very high	94.9	Very high	86 Å²	86	72.6 Å²	72.6	45%	0.45	40%	0.397	S	S	.	.			trans	-94.2	143.2	172.4	-62	175.6	0	0	0	108.9	Q240 K273 L274	Q240-L269 PolarHBondContact O-N 2.71Å; L269-K273 HydrophobicContact CB-CB 4.42Å; L269-L274 HydrophobicContact CB-CD1 4.39Å; L269-L274 HydrophobicContact CB-CD2 3.79Å; L269-L274 HydrophobicContact CB-CG 3.77Å; L269-L274 HydrophobicContact CD1-CD2 3.68Å; L269-L274 HydrophobicContact CD1-CG 4.48Å; L269-L274 HydrophobicContact CG-CD2 4.32Å
270	T	98.1	Very high	95.1	Very high	80 Å²	80	70.2 Å²	70.2	49%	0.491	39%	0.388	S	S	.	.			trans	-66.5	147.3	171.7	56.1	0	0	0	0	110.1	P272 K273 L274	T270-P272 VanDerWaalsContact C-CD 3.5Å; T270-P272 VanDerWaalsContact C-N 3.32Å; T270-K273 WeakPolarHBondContact O-CA 3.43Å; T270-K273 WeakPolarHBondContact O-CB 3.45Å; T270-K273 PolarHBondContact O-N 3.32Å; T270-K273 WeakPolarHBondContact OG1-CG 3.23Å; T270-L274 PolarHBondContact O-N 2.95Å
271	F	98.2	Very high	95	Very high	39 Å²	39	72.1 Å²	72.1	17%	0.171	40%	0.401	C	S	.	.	H	α-helix	trans	-54.4	-36.4	179.1	-82.2	-94.8	0	0	0	114.9	L241 K273 L274 F275 R295 L298 S299 L302	L241-F271 HydrophobicContact CD2-CZ 4.03Å; F271-K273 PolarHBondContact O-N 3.4Å; F271-L274 PolarHBondContact O-N 3.11Å; F271-F275 AromaticContact CD1-CD2 3.98Å; F271-F275 HydrophobicContact CD1-CD2 3.98Å; F271-F275 AromaticContact CD1-CE2 3.98Å; F271-F275 HydrophobicContact CD1-CE2 3.98Å; F271-F275 HydrophobicContact CE1-CE2 4.16Å; F271-F275 PolarHBondContact O-N 3.23Å; F271-R295 HydrophobicContact CB-CG 3.88Å; F271-L298 HydrophobicContact CD1-CB 4.14Å; F271-L298 HydrophobicContact CE1-CB 4.14Å; F271-S299 VanDerWaalsContact CE1-CA 3.44Å; F271-S299 VanDerWaalsContact CZ-CA 3.43Å; F271-L302 HydrophobicContact CE1-CB 4.07Å; F271-L302 HydrophobicContact CE1-CD1 4.25Å; F271-L302 HydrophobicContact CZ-CB 3.96Å
272	P	97.4	Very high	94.3	Very high	74 Å²	74	71.1 Å²	71.1	48%	0.481	40%	0.403	S	S	.	.	H	α-helix	trans	-64.2	-22.2	171.4	-24.5	34.3	0	0	0	115	T270 F275 P276	T270-P272 VanDerWaalsContact C-CD 3.5Å; T270-P272 VanDerWaalsContact C-N 3.32Å; P272-F275 CarbonylContact O-C 3.55Å; P272-P276 WeakPolarHBondContact O-CA 3.48Å
273	K	97.5	Very high	94.1	Very high	152 Å²	152	71.3 Å²	71.3	66%	0.661	41%	0.405	S	S	*	.	H	α-helix	trans	-84	-36.1	172.4	-72.8	-178.3	178.4	-176.1	0	111.8	L269 T270 F271	L269-K273 HydrophobicContact CB-CB 4.42Å; T270-K273 WeakPolarHBondContact O-CA 3.43Å; T270-K273 WeakPolarHBondContact O-CB 3.45Å; T270-K273 PolarHBondContact O-N 3.32Å; T270-K273 WeakPolarHBondContact OG1-CG 3.23Å; F271-K273 PolarHBondContact O-N 3.4Å
274	L	97.4	Very high	94	Very high	10 Å²	10	69.7 Å²	69.7	5%	0.052	41%	0.405	C	S	.	.	H	α-helix	trans	-69.3	-38.5	176.1	-70.4	171.5	0	0	0	111.9	Q240 L241 L269 T270 F271	Q240-L274 HydrophobicContact CB-CD2 3.94Å; Q240-L274 HydrophobicContact CG-CD2 4.05Å; L241-L274 HydrophobicContact CD2-CD1 3.91Å; L269-L274 HydrophobicContact CB-CD1 4.39Å; L269-L274 HydrophobicContact CB-CD2 3.79Å; L269-L274 HydrophobicContact CB-CG 3.77Å; L269-L274 HydrophobicContact CD1-CD2 3.68Å; L269-L274 HydrophobicContact CD1-CG 4.48Å; L269-L274 HydrophobicContact CG-CD2 4.32Å; T270-L274 PolarHBondContact O-N 2.95Å; F271-L274 PolarHBondContact O-N 3.11Å
275	F	97.7	Very high	93.8	Very high	3 Å²	3	72.9 Å²	72.9	1%	0.013	41%	0.413	C	S	.	.	S	Bend	trans	-131.5	75.9	-178	-54.2	-80.7	0	0	0	109	G216 I219 K220 L224 F271 P272 F280 R295 L298 L302	G216-F275 VanDerWaalsContact CA-CE1 3.48Å; I219-F275 HydrophobicContact CB-CD1 4.34Å; I219-F275 HydrophobicContact CG2-CD1 3.93Å; K220-F275 HydrophobicContact CD-CD1 4.04Å; K220-F275 HydrophobicContact CD-CE1 3.67Å; K220-F275 HydrophobicContact CD-CZ 4.46Å; K220-F275 HydrophobicContact CG-CD1 3.91Å; K220-F275 HydrophobicContact CG-CE1 3.82Å; L224-F275 HydrophobicContact CD1-CZ 4.19Å; L224-F275 HydrophobicContact CD2-CE1 4.06Å; L224-F275 HydrophobicContact CD2-CZ 4.06Å; F271-F275 AromaticContact CD1-CD2 3.98Å; F271-F275 HydrophobicContact CD1-CD2 3.98Å; F271-F275 AromaticContact CD1-CE2 3.98Å; F271-F275 HydrophobicContact CD1-CE2 3.98Å; F271-F275 HydrophobicContact CE1-CE2 4.16Å; F271-F275 PolarHBondContact O-N 3.23Å; P272-F275 CarbonylContact O-C 3.55Å; F275-F280 HydrophobicContact CB-CE2 3.88Å; F275-F280 HydrophobicContact CB-CZ 4.03Å; F275-R295 PolarHBondContact O-NE 2.93Å; F275-R295 PolarHBondContact O-NH2 3.49Å; F275-L298 HydrophobicContact CD1-CD1 3.98Å; F275-L298 HydrophobicContact CD2-CD1 3.83Å; F275-L298 HydrophobicContact CE1-CD1 4Å; F275-L298 HydrophobicContact CE2-CD1 3.86Å; F275-L298 HydrophobicContact CE2-CD2 4.45Å; F275-L298 HydrophobicContact CG-CD1 3.89Å; F275-L298 HydrophobicContact CZ-CD1 3.94Å; F275-L298 HydrophobicContact CZ-CD2 4.22Å; F275-L302 HydrophobicContact CE2-CD1 4.24Å; F275-L302 HydrophobicContact CZ-CD1 4.14Å
276	P	96.8	Very high	93.5	Very high	46 Å²	46	71.7 Å²	71.7	30%	0.299	41%	0.41	S	S	.	.			trans	-65.8	159.7	178.7	27.4	-34.4	0	0	0	112	P272 S278 L279 F280	P272-P276 WeakPolarHBondContact O-CA 3.48Å; P276-S278 PolarHBondContact O-N 2.82Å; P276-S278 VanDerWaalsContact O-N 3.11Å; P276-L279 HydrophobicContact CG-CD1 4.22Å; P276-L279 HydrophobicContact CG-CG 4.06Å; P276-L279 PolarHBondContact O-N 3.22Å; P276-F280 WeakPolarHBondContact O-CD2 3.34Å
277	D	94	Very high	93.3	Very high	99 Å²	99	69.6 Å²	69.6	53%	0.529	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-58.3	-25.9	-179	-64.2	-30.9	0	0	0	112.5	L279 F280 R295	D277-L279 PolarHBondContact O-N 3.48Å; D277-L279 VanDerWaalsContact O-N 3.15Å; D277-F280 PolarHBondContact O-N 3.41Å; D277-R295 IonicContact OD1-CZ 3.81Å; D277-R295 VanDerWaalsContact OD1-CZ 3.25Å; D277-R295 IonicContact OD1-NH1 3.22Å; D277-R295 PolarHBondContact OD1-NH1 3.44Å; D277-R295 IonicContact OD1-NH2 2.96Å; D277-R295 PolarHBondContact OD1-NH2 2.82Å
278	S	94.1	Very high	93.1	Very high	104 Å²	104	69.4 Å²	69.4	73%	0.727	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-64.5	-13.9	176.4	63.4	0	0	0	0	114.8	P276	P276-S278 PolarHBondContact O-N 2.82Å; P276-S278 VanDerWaalsContact O-N 3.11Å
279	L	94.9	Very high	93	Very high	68 Å²	68	72.8 Å²	72.8	36%	0.356	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-93.6	-4.6	175.7	-61.1	-176.6	0	0	0	113	I219 K220 P276 D277	I219-L279 HydrophobicContact CG2-CB 3.82Å; I219-L279 HydrophobicContact CG2-CD1 4.29Å; K220-L279 HydrophobicContact CG-CD1 3.8Å; P276-L279 HydrophobicContact CG-CD1 4.22Å; P276-L279 HydrophobicContact CG-CG 4.06Å; P276-L279 PolarHBondContact O-N 3.22Å; D277-L279 PolarHBondContact O-N 3.48Å; D277-L279 VanDerWaalsContact O-N 3.15Å
280	F	93.5	Very high	93	Very high	13 Å²	13	69.8 Å²	69.8	6%	0.057	38%	0.377	C	S	.	.	S	Bend	trans	-111.2	149.2	-179.5	-63.9	-83.6	0	0	0	110.2	H125 I219 F275 P276 D277 A282 A291 A294	H125-F280 AromaticContact CE1-CD1 3.74Å; I219-F280 HydrophobicContact CD1-CE1 3.55Å; I219-F280 HydrophobicContact CD1-CZ 3.88Å; I219-F280 HydrophobicContact CG1-CE1 3.82Å; I219-F280 HydrophobicContact CG1-CZ 4.34Å; I219-F280 HydrophobicContact CG2-CD1 4.35Å; I219-F280 HydrophobicContact CG2-CE1 3.83Å; I219-F280 HydrophobicContact CG2-CE2 4.15Å; I219-F280 HydrophobicContact CG2-CZ 3.72Å; F275-F280 HydrophobicContact CB-CE2 3.88Å; F275-F280 HydrophobicContact CB-CZ 4.03Å; P276-F280 WeakPolarHBondContact O-CD2 3.34Å; D277-F280 PolarHBondContact O-N 3.41Å; F280-A282 PolarHBondContact O-N 3.46Å; F280-A291 HydrophobicContact CB-CB 3.61Å; F280-A291 HydrophobicContact CD1-CB 4.12Å; F280-A291 HydrophobicContact CD2-CB 4.13Å; F280-A291 HydrophobicContact CG-CB 3.69Å; F280-A294 HydrophobicContact CD1-CB 4.48Å; F280-A294 HydrophobicContact CE1-CB 3.78Å; F280-A294 HydrophobicContact CZ-CB 4.47Å
281	P	86.8	Confident	93	Very high	43 Å²	43	66 Å²	66	28%	0.279	36%	0.355	S	S	.	.			trans	-55.7	124.2	161.6	-19.7	31.8	0	0	0	109	N287	P281-N287 WeakPolarHBondContact O-CB 3.44Å
282	A	77.6	Confident	92.9	Very high	43 Å²	43	67.4 Å²	67.4	36%	0.355	37%	0.369	S	S	.	.			trans	-140.8	24.5	-174.6	0	0	0	0	0	113.2	F280 S284 K288	F280-A282 PolarHBondContact O-N 3.46Å; A282-S284 VanDerWaalsContact C-N 3.27Å; A282-S284 PolarHBondContact O-N 3.33Å; A282-K288 HydrophobicContact CB-CG 4.35Å
283	D	86.7	Confident	93	Very high	139 Å²	139	65.6 Å²	65.6	74%	0.743	35%	0.354	S	S	*	.	S	Bend	trans	-69.8	-16.7	179.8	62.1	-22.7	0	0	0	114.2	N287	D283-N287 PolarHBondContact OD1-ND2 3.26Å
284	S	89.4	Confident	93	Very high	43 Å²	43	58.3 Å²	58.3	30%	0.301	32%	0.323	S	S	.	.	S	Bend	trans	-137.8	159.3	178.9	68.7	0	0	0	0	112.8	A282 H286 N287 K288	A282-S284 VanDerWaalsContact C-N 3.27Å; A282-S284 PolarHBondContact O-N 3.33Å; S284-H286 PolarHBondContact O-N 3.01Å; S284-N287 PolarHBondContact O-N 3.21Å; S284-N287 VanDerWaalsContact O-N 3.11Å; S284-N287 WeakPolarHBondContact OG-CB 3.4Å; S284-N287 PolarHBondContact OG-N 2.95Å; S284-N287 VanDerWaalsContact OG-N 3.16Å; S284-N287 PolarHBondContact OG-ND2 3.37Å; S284-K288 WeakPolarHBondContact O-CG 3.33Å; S284-K288 PolarHBondContact O-N 3.28Å
285	E	89.1	Confident	93.1	Very high	139 Å²	139	59.1 Å²	59.1	65%	0.65	33%	0.325	S	S	*	.	H	α-helix	trans	-60.5	-32.4	173.3	-68.6	-56.3	124.1	0	0	112.3	K288 L289	E285-K288 PolarHBondContact O-N 3.15Å; E285-K288 WeakPolarHBondContact OE1-CD 3.46Å; E285-K288 IonicContact OE1-NZ 2.88Å; E285-K288 PolarHBondContact OE1-NZ 3.09Å; E285-L289 PolarHBondContact O-N 3.45Å
286	H	89.8	Confident	93.1	Very high	114 Å²	114	62 Å²	62	53%	0.528	34%	0.341	S	S	.	.	H	α-helix	trans	-60.4	-47.9	172.4	-177.5	83.2	0	0	0	111.2	S284 L289 K290	S284-H286 PolarHBondContact O-N 3.01Å; H286-L289 WeakPolarHBondContact O-CB 3.47Å; H286-L289 PolarHBondContact O-N 3.41Å; H286-K290 WeakPolarHBondContact O-CG 3.42Å; H286-K290 PolarHBondContact O-N 3.48Å
287	N	90.8	Very high	93.2	Very high	32 Å²	32	59.8 Å²	59.8	17%	0.171	33%	0.326	C	S	.	.	H	α-helix	trans	-70.3	-32.8	-179.5	-74.2	-21	0	0	0	112.4	H125 P281 D283 S284 L289 K290 A291	H125-N287 PolarHBondContact NE2-O 3.02Å; P281-N287 WeakPolarHBondContact O-CB 3.44Å; D283-N287 PolarHBondContact OD1-ND2 3.26Å; S284-N287 PolarHBondContact O-N 3.21Å; S284-N287 VanDerWaalsContact O-N 3.11Å; S284-N287 WeakPolarHBondContact OG-CB 3.4Å; S284-N287 PolarHBondContact OG-N 2.95Å; S284-N287 VanDerWaalsContact OG-N 3.16Å; S284-N287 PolarHBondContact OG-ND2 3.37Å; N287-L289 PolarHBondContact O-N 3.29Å; N287-K290 PolarHBondContact O-N 3.42Å; N287-A291 WeakPolarHBondContact O-CB 3.46Å; N287-A291 PolarHBondContact O-N 2.8Å
288	K	92.3	Very high	93.4	Very high	104 Å²	104	55.1 Å²	55.1	45%	0.452	30%	0.301	S	S	.	.	H	α-helix	trans	-61.4	-42.8	169.8	-69.9	178	-171.9	168.2	0	112.7	A282 S284 E285 K290 A291 S292	A282-K288 HydrophobicContact CB-CG 4.35Å; S284-K288 WeakPolarHBondContact O-CG 3.33Å; S284-K288 PolarHBondContact O-N 3.28Å; E285-K288 PolarHBondContact O-N 3.15Å; E285-K288 WeakPolarHBondContact OE1-CD 3.46Å; E285-K288 IonicContact OE1-NZ 2.88Å; E285-K288 PolarHBondContact OE1-NZ 3.09Å; K288-K290 VanDerWaalsContact C-N 3.34Å; K288-A291 PolarHBondContact O-N 3.16Å; K288-S292 PolarHBondContact O-N 3.38Å; K288-S292 VanDerWaalsContact O-N 3.09Å
289	L	95	Very high	93.7	Very high	98 Å²	98	51.8 Å²	51.8	51%	0.513	28%	0.278	S	S	.	.	H	α-helix	trans	-62	-43.9	174	177.2	62.7	0	0	0	110.8	E285 H286 N287 S292 Q293	E285-L289 PolarHBondContact O-N 3.45Å; H286-L289 WeakPolarHBondContact O-CB 3.47Å; H286-L289 PolarHBondContact O-N 3.41Å; N287-L289 PolarHBondContact O-N 3.29Å; L289-S292 WeakPolarHBondContact O-CB 3.2Å; L289-S292 PolarHBondContact O-N 3.4Å; L289-Q293 HydrophobicContact CD1-CG 4.49Å; L289-Q293 WeakPolarHBondContact O-CG 3.46Å; L289-Q293 PolarHBondContact O-N 3.25Å
290	K	96.5	Very high	93.9	Very high	22 Å²	22	52.4 Å²	52.4	10%	0.096	28%	0.278	C	S	.	.	H	α-helix	trans	-64	-38.9	177.5	-71.3	-71	178.1	-175.7	0	112.8	H125 H286 N287 K288 S292 Q293 A294 Y320	H125-K290 HydrophobicContact CB-CB 4Å; H125-K290 HydrophobicContact CB-CG 4.28Å; H125-K290 VanDerWaalsContact CD2-CB 3.46Å; H125-K290 WeakPolarHBondContact CD2-CB 3.34Å; H286-K290 WeakPolarHBondContact O-CG 3.42Å; H286-K290 PolarHBondContact O-N 3.48Å; N287-K290 PolarHBondContact O-N 3.42Å; K288-K290 VanDerWaalsContact C-N 3.34Å; K290-S292 VanDerWaalsContact C-N 3.34Å; K290-S292 PolarHBondContact O-N 2.93Å; K290-Q293 PolarHBondContact O-N 2.91Å; K290-A294 WeakPolarHBondContact O-CB 3.31Å; K290-A294 PolarHBondContact O-N 3Å; K290-Y320 HydrophobicContact CB-CE2 4.25Å; K290-Y320 HydrophobicContact CD-CD2 4.13Å; K290-Y320 HydrophobicContact CD-CE2 4.2Å; K290-Y320 WeakPolarHBondContact O-CE2 3.36Å
291	A	96.9	Very high	94.1	Very high	2 Å²	2	51.8 Å²	51.8	2%	0.017	28%	0.275	C	S	.	.	H	α-helix	trans	-60.5	-43.1	172.8	0	0	0	0	0	111.9	H125 F280 N287 K288 A294 R295	H125-A291 PolarHBondContact CE1-N 3.06Å; F280-A291 HydrophobicContact CB-CB 3.61Å; F280-A291 HydrophobicContact CD1-CB 4.12Å; F280-A291 HydrophobicContact CD2-CB 4.13Å; F280-A291 HydrophobicContact CG-CB 3.69Å; N287-A291 WeakPolarHBondContact O-CB 3.46Å; N287-A291 PolarHBondContact O-N 2.8Å; K288-A291 PolarHBondContact O-N 3.16Å; A291-A294 PolarHBondContact O-N 3.4Å; A291-R295 WeakPolarHBondContact O-CB 3.4Å; A291-R295 PolarHBondContact O-N 3.36Å
292	S	97.4	Very high	94.7	Very high	68 Å²	68	50 Å²	50	48%	0.476	26%	0.263	S	S	.	.	H	α-helix	trans	-61	-46.7	173.7	-174.6	0	0	0	0	111.9	K288 L289 K290 R295 D296	K288-S292 PolarHBondContact O-N 3.38Å; K288-S292 VanDerWaalsContact O-N 3.09Å; L289-S292 WeakPolarHBondContact O-CB 3.2Å; L289-S292 PolarHBondContact O-N 3.4Å; K290-S292 VanDerWaalsContact C-N 3.34Å; K290-S292 PolarHBondContact O-N 2.93Å; S292-R295 PolarHBondContact O-N 3.45Å; S292-D296 PolarHBondContact O-N 3.24Å
293	Q	98.4	Very high	95.7	Very high	35 Å²	35	49.4 Å²	49.4	16%	0.164	26%	0.255	C	S	.	.	H	α-helix	trans	-63.1	-42	177	-69.5	175.9	-7.2	0	0	112.3	L289 K290 R295 D296 L297 H318 P319 Y320	L289-Q293 HydrophobicContact CD1-CG 4.49Å; L289-Q293 WeakPolarHBondContact O-CG 3.46Å; L289-Q293 PolarHBondContact O-N 3.25Å; K290-Q293 PolarHBondContact O-N 2.91Å; Q293-R295 VanDerWaalsContact C-N 3.34Å; Q293-R295 PolarHBondContact O-N 3.48Å; Q293-D296 PolarHBondContact O-N 2.95Å; Q293-L297 PolarHBondContact O-N 3.19Å; Q293-H318 PolarHBondContact O-CE1 3.05Å; Q293-P319 HydrophobicContact CG-CB 4.38Å; Q293-Y320 HydrophobicContact CB-CD2 3.91Å; Q293-Y320 HydrophobicContact CB-CG 4.38Å
294	A	98.4	Very high	96.2	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.4	-44.3	177.1	0	0	0	0	0	111.3	M215 F280 K290 A291 L297 L298 Y320	M215-A294 HydrophobicContact CE-CB 3.76Å; M215-A294 VanDerWaalsContact CE-O 3.25Å; M215-A294 WeakPolarHBondContact CE-O 3.31Å; F280-A294 HydrophobicContact CD1-CB 4.48Å; F280-A294 HydrophobicContact CE1-CB 3.78Å; F280-A294 HydrophobicContact CZ-CB 4.47Å; K290-A294 WeakPolarHBondContact O-CB 3.31Å; K290-A294 PolarHBondContact O-N 3Å; A291-A294 PolarHBondContact O-N 3.4Å; A294-L297 PolarHBondContact O-N 3.44Å; A294-L298 PolarHBondContact O-N 3.01Å; A294-Y320 HydrophobicContact CB-CD1 4.39Å; A294-Y320 HydrophobicContact CB-CD2 4.05Å; A294-Y320 HydrophobicContact CB-CE1 4.02Å; A294-Y320 HydrophobicContact CB-CE2 3.67Å; A294-Y320 HydrophobicContact CB-CG 4.4Å
295	R	98.4	Very high	96.6	Very high	27 Å²	27	42 Å²	42	10%	0.102	21%	0.212	C	C	.	.	H	α-helix	trans	-66.5	-38.7	177.9	-171.3	-177.3	-66.3	127.1	3	112.4	F271 F275 D277 A291 S292 Q293 L298 S299	F271-R295 HydrophobicContact CB-CG 3.88Å; F275-R295 PolarHBondContact O-NE 2.93Å; F275-R295 PolarHBondContact O-NH2 3.49Å; D277-R295 IonicContact OD1-CZ 3.81Å; D277-R295 VanDerWaalsContact OD1-CZ 3.25Å; D277-R295 IonicContact OD1-NH1 3.22Å; D277-R295 PolarHBondContact OD1-NH1 3.44Å; D277-R295 IonicContact OD1-NH2 2.96Å; D277-R295 PolarHBondContact OD1-NH2 2.82Å; A291-R295 WeakPolarHBondContact O-CB 3.4Å; A291-R295 PolarHBondContact O-N 3.36Å; S292-R295 PolarHBondContact O-N 3.45Å; Q293-R295 VanDerWaalsContact C-N 3.34Å; Q293-R295 PolarHBondContact O-N 3.48Å; R295-L298 PolarHBondContact O-N 3.35Å; R295-S299 PolarHBondContact O-N 3Å
296	D	98.8	Very high	96.9	Very high	63 Å²	63	36.4 Å²	36.4	34%	0.337	19%	0.188	S	C	.	.	H	α-helix	trans	-62.3	-46.3	174.2	-177.4	52.3	0	0	0	111.2	S292 Q293 L298 S299 K300 H318	S292-D296 PolarHBondContact O-N 3.24Å; Q293-D296 PolarHBondContact O-N 2.95Å; D296-L298 PolarHBondContact O-N 3.26Å; D296-S299 WeakPolarHBondContact O-CB 3.46Å; D296-S299 PolarHBondContact O-N 2.65Å; D296-S299 VanDerWaalsContact O-N 3.1Å; D296-S299 PolarHBondContact O-OG 2.69Å; D296-K300 WeakPolarHBondContact O-CG 3.38Å; D296-K300 PolarHBondContact O-N 3.1Å; D296-K300 WeakPolarHBondContact OD1-CE 3.33Å; D296-K300 IonicContact OD1-NZ 3.96Å; D296-K300 WeakPolarHBondContact OD2-CE 3.46Å; D296-K300 IonicContact OD2-NZ 3.6Å; D296-K300 PolarHBondContact OD2-NZ 3.29Å; D296-H318 IonicContact OD2-CE1 2.65Å; D296-H318 IonicContact OD2-NE2 3.92Å; D296-H318 PolarHBondContact OD2-NE2 3.2Å
297	L	98.9	Very high	97.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-59.1	-46.6	175.5	-175.3	57	0	0	0	112.1	M215 Q293 A294 S299 K300 M301 I310 A315 H318 Y320 I321	M215-L297 HydrophobicContact CE-CB 4.46Å; M215-L297 HydrophobicContact CE-CD2 4.32Å; M215-L297 HydrophobicContact SD-CD2 4.1Å; M215-L297 HydrophobicContact SD-CG 4.33Å; Q293-L297 PolarHBondContact O-N 3.19Å; A294-L297 PolarHBondContact O-N 3.44Å; L297-S299 VanDerWaalsContact C-N 3.25Å; L297-S299 PolarHBondContact O-N 2.99Å; L297-K300 PolarHBondContact O-N 3.27Å; L297-K300 VanDerWaalsContact O-N 3.09Å; L297-M301 HydrophobicContact CD1-CE 3.67Å; L297-M301 HydrophobicContact CD1-CG 4.37Å; L297-M301 HydrophobicContact CD1-SD 4.37Å; L297-M301 HydrophobicContact CD2-CE 3.94Å; L297-M301 HydrophobicContact CG-CE 3.76Å; L297-M301 HydrophobicContact CG-SD 4.08Å; L297-M301 PolarHBondContact O-N 3.33Å; L297-I310 HydrophobicContact CD1-CD1 4.24Å; L297-A315 HydrophobicContact CD1-CB 4.37Å; L297-H318 HydrophobicContact CD1-CB 3.94Å; L297-Y320 HydrophobicContact CD2-CD1 4.05Å; L297-I321 HydrophobicContact CD2-CD1 3.84Å; L297-I321 HydrophobicContact CD2-CG1 3.63Å
298	L	98.7	Very high	97.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-55.4	-42.3	174.3	-87.3	168.6	0	0	0	111.8	G212 M215 I219 F271 F275 A294 R295 D296 K300 M301 L302	G212-L298 WeakPolarHBondContact O-CD2 3.34Å; M215-L298 HydrophobicContact CB-CD2 4.01Å; M215-L298 HydrophobicContact CE-CD1 4.4Å; M215-L298 HydrophobicContact CE-CG 4.01Å; M215-L298 HydrophobicContact CG-CD2 3.88Å; M215-L298 HydrophobicContact CG-CG 4.05Å; M215-L298 HydrophobicContact SD-CD2 4.05Å; M215-L298 HydrophobicContact SD-CG 3.81Å; I219-L298 HydrophobicContact CD1-CD1 3.53Å; I219-L298 HydrophobicContact CD1-CG 4.5Å; F271-L298 HydrophobicContact CD1-CB 4.14Å; F271-L298 HydrophobicContact CE1-CB 4.14Å; F275-L298 HydrophobicContact CD1-CD1 3.98Å; F275-L298 HydrophobicContact CD2-CD1 3.83Å; F275-L298 HydrophobicContact CE1-CD1 4Å; F275-L298 HydrophobicContact CE2-CD1 3.86Å; F275-L298 HydrophobicContact CE2-CD2 4.45Å; F275-L298 HydrophobicContact CG-CD1 3.89Å; F275-L298 HydrophobicContact CZ-CD1 3.94Å; F275-L298 HydrophobicContact CZ-CD2 4.22Å; A294-L298 PolarHBondContact O-N 3.01Å; R295-L298 PolarHBondContact O-N 3.35Å; D296-L298 PolarHBondContact O-N 3.26Å; L298-K300 PolarHBondContact O-N 3.09Å; L298-M301 PolarHBondContact O-N 2.99Å; L298-L302 HydrophobicContact CD2-CD1 3.88Å; L298-L302 HydrophobicContact CD2-CG 4.38Å; L298-L302 WeakPolarHBondContact O-CB 3.49Å; L298-L302 PolarHBondContact O-N 3.12Å
299	S	98.8	Very high	97.8	Very high	35 Å²	35	35.4 Å²	35.4	25%	0.245	20%	0.195	C	C	.	.	H	α-helix	trans	-65	-25.4	179.9	82.7	0	0	0	0	114	F271 R295 D296 L297 V303	F271-S299 VanDerWaalsContact CE1-CA 3.44Å; F271-S299 VanDerWaalsContact CZ-CA 3.43Å; R295-S299 PolarHBondContact O-N 3Å; D296-S299 WeakPolarHBondContact O-CB 3.46Å; D296-S299 PolarHBondContact O-N 2.65Å; D296-S299 VanDerWaalsContact O-N 3.1Å; D296-S299 PolarHBondContact O-OG 2.69Å; L297-S299 VanDerWaalsContact C-N 3.25Å; L297-S299 PolarHBondContact O-N 2.99Å; S299-V303 WeakPolarHBondContact O-CG2 3.46Å
300	K	98.8	Very high	98	Very high	80 Å²	80	31.6 Å²	31.6	35%	0.348	18%	0.175	S	C	.	.	H	α-helix	trans	-89.6	-26.8	178.1	-67	172.2	178.6	165.5	0	112.6	D296 L297 L298 V303 I310	D296-K300 WeakPolarHBondContact O-CG 3.38Å; D296-K300 PolarHBondContact O-N 3.1Å; D296-K300 WeakPolarHBondContact OD1-CE 3.33Å; D296-K300 IonicContact OD1-NZ 3.96Å; D296-K300 WeakPolarHBondContact OD2-CE 3.46Å; D296-K300 IonicContact OD2-NZ 3.6Å; D296-K300 PolarHBondContact OD2-NZ 3.29Å; L297-K300 PolarHBondContact O-N 3.27Å; L297-K300 VanDerWaalsContact O-N 3.09Å; L298-K300 PolarHBondContact O-N 3.09Å; K300-V303 WeakPolarHBondContact O-CG2 3.38Å; K300-I310 HydrophobicContact CB-CB 3.96Å; K300-I310 HydrophobicContact CB-CD1 4.02Å; K300-I310 HydrophobicContact CB-CG2 4.18Å; K300-I310 HydrophobicContact CD-CD1 4.15Å; K300-I310 WeakPolarHBondContact O-CG2 3.3Å; K300-I310 PolarHBondContact O-N 3.39Å
301	M	98.8	Very high	98.1	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-84.4	-46	175.7	-71.1	179.6	172.8	0	0	113.2	L136 M208 V211 L297 L298 V303 R309 I310 A315	L136-M301 HydrophobicContact CD1-CE 4.45Å; L136-M301 HydrophobicContact CD2-CE 4.38Å; M208-M301 HydrophobicContact CE-CE 3.61Å; M208-M301 HydrophobicContact CE-CG 4.2Å; V211-M301 HydrophobicContact CB-SD 4.44Å; V211-M301 HydrophobicContact CG1-CE 3.9Å; V211-M301 HydrophobicContact CG1-SD 3.94Å; L297-M301 HydrophobicContact CD1-CE 3.67Å; L297-M301 HydrophobicContact CD1-CG 4.37Å; L297-M301 HydrophobicContact CD1-SD 4.37Å; L297-M301 HydrophobicContact CD2-CE 3.94Å; L297-M301 HydrophobicContact CG-CE 3.76Å; L297-M301 HydrophobicContact CG-SD 4.08Å; L297-M301 PolarHBondContact O-N 3.33Å; L298-M301 PolarHBondContact O-N 2.99Å; M301-V303 PolarHBondContact O-N 3.49Å; M301-R309 VanDerWaalsContact O-CD 3.31Å; M301-R309 WeakPolarHBondContact O-CD 3.33Å; M301-R309 VanDerWaalsContact O-CG 3.31Å; M301-R309 WeakPolarHBondContact O-CG 3.39Å; M301-I310 HydrophobicContact CB-CG2 4.46Å; M301-I310 HydrophobicContact CG-CG2 3.75Å; M301-A315 HydrophobicContact CE-CB 4.04Å
302	L	98.7	Very high	98.2	Very high	6 Å²	6	32.7 Å²	32.7	3%	0.031	19%	0.185	C	C	.	.	S	Bend	trans	-83.5	58.3	-178.4	-67.3	178.8	0	0	0	111.4	W209 L224 F225 L241 F271 F275 L298	W209-L302 HydrophobicContact CE3-CD2 4.48Å; L224-L302 HydrophobicContact CD1-CD1 3.69Å; L224-L302 HydrophobicContact CD1-CD2 4.41Å; F225-L302 HydrophobicContact CE2-CD2 4.16Å; L241-L302 HydrophobicContact CD1-CB 4.36Å; F271-L302 HydrophobicContact CE1-CB 4.07Å; F271-L302 HydrophobicContact CE1-CD1 4.25Å; F271-L302 HydrophobicContact CZ-CB 3.96Å; F275-L302 HydrophobicContact CE2-CD1 4.24Å; F275-L302 HydrophobicContact CZ-CD1 4.14Å; L298-L302 HydrophobicContact CD2-CD1 3.88Å; L298-L302 HydrophobicContact CD2-CG 4.38Å; L298-L302 WeakPolarHBondContact O-CB 3.49Å; L298-L302 PolarHBondContact O-N 3.12Å
303	V	98.6	Very high	98.2	Very high	31 Å²	31	33.3 Å²	33.3	19%	0.188	18%	0.183	C	C	.	.			trans	-111.7	125.5	178.5	-179	0	0	0	0	109.5	S299 K300 M301 K308 R309	S299-V303 WeakPolarHBondContact O-CG2 3.46Å; K300-V303 WeakPolarHBondContact O-CG2 3.38Å; M301-V303 PolarHBondContact O-N 3.49Å; V303-K308 HydrophobicContact CG1-CB 3.79Å; V303-R309 HydrophobicContact CB-CB 4.08Å; V303-R309 HydrophobicContact CB-CG 4.25Å; V303-R309 PolarHBondContact O-NE 2.9Å; V303-R309 PolarHBondContact O-NH2 3.46Å
304	I	98.1	Very high	98.2	Very high	14 Å²	14	36.3 Å²	36.3	7%	0.072	20%	0.2	C	C	.	.	S	Bend	trans	-64.2	-48.8	-176.2	-65.1	175.7	0	0	0	111.5	P194 W209 W234 V237 I238 L241 G242 P244 F248 P306 R309	P194-I304 HydrophobicContact CB-CG2 4.1Å; P194-I304 HydrophobicContact CG-CB 4.48Å; P194-I304 HydrophobicContact CG-CG2 4.12Å; W209-I304 HydrophobicContact CZ3-CG1 4.43Å; W234-I304 HydrophobicContact CH2-CG2 4.01Å; W234-I304 HydrophobicContact CZ3-CG2 4.19Å; V237-I304 HydrophobicContact CG1-CD1 3.99Å; V237-I304 HydrophobicContact CG1-CG1 4.05Å; I238-I304 HydrophobicContact CG2-CD1 4.33Å; L241-I304 HydrophobicContact CB-CD1 4.11Å; L241-I304 HydrophobicContact CB-CG1 4.39Å; L241-I304 HydrophobicContact CD1-CG1 4.2Å; G242-I304 WeakPolarHBondContact O-CD1 3.4Å; P244-I304 HydrophobicContact CB-CB 4.42Å; P244-I304 HydrophobicContact CB-CD1 4.45Å; P244-I304 HydrophobicContact CB-CG2 3.9Å; P244-I304 HydrophobicContact CG-CG2 4.14Å; F248-I304 HydrophobicContact CD2-CG2 4.45Å; F248-I304 HydrophobicContact CE1-CG2 4.1Å; F248-I304 HydrophobicContact CE2-CG2 3.98Å; F248-I304 HydrophobicContact CZ-CG2 3.79Å; I304-P306 VanDerWaalsContact O-CD 3.26Å; I304-P306 WeakPolarHBondContact O-CD 3.1Å; I304-R309 PolarHBondContact O-NH2 3.3Å
305	D	97.1	Very high	98.2	Very high	11 Å²	11	36.3 Å²	36.3	6%	0.059	20%	0.2	C	C	.	.	S	Bend	trans	-76.1	115.4	179.5	-169	-18	0	0	0	110.3	F248 K251 A307 K308 R309	F248-D305 HydrophobicContact CD2-CB 3.92Å; K251-D305 VanDerWaalsContact NZ-CG 3.28Å; K251-D305 IonicContact NZ-OD1 3.33Å; K251-D305 PolarHBondContact NZ-OD1 2.9Å; K251-D305 IonicContact NZ-OD2 2.88Å; K251-D305 PolarHBondContact NZ-OD2 3.44Å; D305-A307 PolarHBondContact O-N 3.25Å; D305-A307 VanDerWaalsContact O-N 3.1Å; D305-A307 WeakPolarHBondContact OD1-CB 3.18Å; D305-A307 PolarHBondContact OD1-N 3.41Å; D305-K308 HydrophobicContact CB-CD 4.37Å; D305-K308 HydrophobicContact CB-CG 4.41Å; D305-K308 PolarHBondContact O-N 3.15Å; D305-R309 PolarHBondContact O-N 3.38Å
306	P	96.5	Very high	98.2	Very high	23 Å²	23	35.1 Å²	35.1	15%	0.149	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-60	-25.3	-179.8	-22.8	35	0	0	0	112.8	E195 N205 I304 K308 R309	E195-P306 HydrophobicContact CB-CG 4.12Å; E195-P306 HydrophobicContact CG-CG 4.04Å; E195-P306 WeakPolarHBondContact OE1-CG 3.47Å; E195-P306 WeakPolarHBondContact OE2-CG 3.35Å; N205-P306 PolarHBondContact ND2-O 3.03Å; I304-P306 VanDerWaalsContact O-CD 3.26Å; I304-P306 WeakPolarHBondContact O-CD 3.1Å; P306-K308 PolarHBondContact O-N 2.74Å; P306-R309 PolarHBondContact O-N 2.96Å
307	A	95.8	Very high	98.2	Very high	81 Å²	81	36.6 Å²	36.6	67%	0.669	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-69	-16.5	177.7	0	0	0	0	0	113.5	D305	D305-A307 PolarHBondContact O-N 3.25Å; D305-A307 VanDerWaalsContact O-N 3.1Å; D305-A307 WeakPolarHBondContact OD1-CB 3.18Å; D305-A307 PolarHBondContact OD1-N 3.41Å
308	K	97.4	Very high	98.2	Very high	136 Å²	136	36.9 Å²	36.9	59%	0.591	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-111.4	-5	-179.9	-61.1	179.2	-176	175.8	0	112.6	V303 D305 P306	V303-K308 HydrophobicContact CG1-CB 3.79Å; D305-K308 HydrophobicContact CB-CD 4.37Å; D305-K308 HydrophobicContact CB-CG 4.41Å; D305-K308 PolarHBondContact O-N 3.15Å; P306-K308 PolarHBondContact O-N 2.74Å
309	R	98.5	Very high	98.2	Very high	11 Å²	11	40.3 Å²	40.3	4%	0.042	22%	0.224	C	C	.	.	S	Bend	trans	-80.9	137	-178.6	-166.7	-176	-56	143.7	3.7	109.8	E195 N205 M208 M301 V303 I304 D305 P306	E195-R309 IonicContact OE1-CZ 3.62Å; E195-R309 IonicContact OE1-NH1 3.03Å; E195-R309 PolarHBondContact OE1-NH1 2.94Å; E195-R309 IonicContact OE1-NH2 2.87Å; E195-R309 PolarHBondContact OE1-NH2 3.31Å; E195-R309 IonicContact OE2-CZ 2.7Å; E195-R309 IonicContact OE2-NH1 3.56Å; E195-R309 IonicContact OE2-NH2 2.82Å; E195-R309 PolarHBondContact OE2-NH2 2.69Å; N205-R309 PolarHBondContact ND2-O 3.03Å; N205-R309 WeakPolarHBondContact O-CD 3.41Å; N205-R309 PolarHBondContact O-NH1 3.29Å; M208-R309 HydrophobicContact CB-CG 4.49Å; M301-R309 VanDerWaalsContact O-CD 3.31Å; M301-R309 WeakPolarHBondContact O-CD 3.33Å; M301-R309 VanDerWaalsContact O-CG 3.31Å; M301-R309 WeakPolarHBondContact O-CG 3.39Å; V303-R309 HydrophobicContact CB-CB 4.08Å; V303-R309 HydrophobicContact CB-CG 4.25Å; V303-R309 PolarHBondContact O-NE 2.9Å; V303-R309 PolarHBondContact O-NH2 3.46Å; I304-R309 PolarHBondContact O-NH2 3.3Å; D305-R309 PolarHBondContact O-N 3.38Å; P306-R309 PolarHBondContact O-N 2.96Å
310	I	98.7	Very high	98.2	Very high	19 Å²	19	38.6 Å²	38.6	10%	0.097	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-53.2	143.5	179.2	-163.1	171	0	0	0	111.9	M208 L297 K300 M301 D314 A315	M208-I310 HydrophobicContact CE-CG2 3.97Å; L297-I310 HydrophobicContact CD1-CD1 4.24Å; K300-I310 HydrophobicContact CB-CB 3.96Å; K300-I310 HydrophobicContact CB-CD1 4.02Å; K300-I310 HydrophobicContact CB-CG2 4.18Å; K300-I310 HydrophobicContact CD-CD1 4.15Å; K300-I310 WeakPolarHBondContact O-CG2 3.3Å; K300-I310 PolarHBondContact O-N 3.39Å; M301-I310 HydrophobicContact CB-CG2 4.46Å; M301-I310 HydrophobicContact CG-CG2 3.75Å; I310-D314 HydrophobicContact CD1-CB 4.01Å; I310-D314 HydrophobicContact CG1-CB 3.53Å; I310-A315 HydrophobicContact CD1-CB 4Å; I310-A315 HydrophobicContact CG1-CB 4.34Å; I310-A315 HydrophobicContact CG2-CB 4.46Å
311	S	98.6	Very high	98.2	Very high	37 Å²	37	34.8 Å²	34.8	26%	0.259	20%	0.196	S	C	.	.	P	Polyproline II helix	trans	-78	168	172.3	74.3	0	0	0	0	111.2	D313 D314 A315	S311-D313 VanDerWaalsContact C-N 3.32Å; S311-D314 WeakPolarHBondContact OG-CB 3.26Å; S311-D314 PolarHBondContact OG-N 3.26Å; S311-D314 PolarHBondContact OG-OD2 2.97Å; S311-A315 WeakPolarHBondContact O-CB 3.44Å; S311-A315 PolarHBondContact O-N 2.75Å; S311-A315 VanDerWaalsContact O-N 3.11Å
312	V	98.2	Very high	98.2	Very high	10 Å²	10	38 Å²	38	6%	0.061	21%	0.213	C	C	.	.	H	α-helix	trans	-63.5	-41.9	173.9	-178.8	0	0	0	0	110.6	L136 I139 K140 M208 A315 L316	L136-V312 HydrophobicContact CD2-CG1 4.39Å; I139-V312 HydrophobicContact CG2-CG2 3.85Å; K140-V312 HydrophobicContact CB-CG1 3.82Å; M208-V312 HydrophobicContact CG-CG2 4.11Å; M208-V312 HydrophobicContact SD-CB 4.21Å; M208-V312 HydrophobicContact SD-CG2 3.56Å; M208-V312 VanDerWaalsContact SD-CG2 3.56Å; V312-A315 PolarHBondContact O-N 2.98Å; V312-L316 HydrophobicContact CG1-CD1 4.16Å; V312-L316 WeakPolarHBondContact O-CG 3.4Å; V312-L316 PolarHBondContact O-N 3.42Å
313	D	98.1	Very high	98.1	Very high	81 Å²	81	41.9 Å²	41.9	43%	0.433	24%	0.237	S	C	.	.	H	α-helix	trans	-65	-46.4	-178.6	-66.3	-38.1	0	0	0	111.6	K140 S311 A315 L316 Q317	K140-D313 IonicContact NZ-OD1 3.91Å; K140-D313 PolarHBondContact NZ-OD1 3.31Å; K140-D313 IonicContact NZ-OD2 3.38Å; S311-D313 VanDerWaalsContact C-N 3.32Å; D313-A315 VanDerWaalsContact C-N 3.26Å; D313-A315 PolarHBondContact O-N 2.7Å; D313-L316 PolarHBondContact O-N 3.05Å; D313-Q317 WeakPolarHBondContact O-CG 3.16Å; D313-Q317 PolarHBondContact O-N 3.01Å; D313-Q317 VanDerWaalsContact O-N 3.13Å
314	D	98.6	Very high	98.1	Very high	98 Å²	98	43.8 Å²	43.8	52%	0.524	24%	0.241	S	C	.	.	H	α-helix	trans	-64.9	-33.1	177.1	-62	-41.7	0	0	0	111.8	I310 S311 Q317 H318	I310-D314 HydrophobicContact CD1-CB 4.01Å; I310-D314 HydrophobicContact CG1-CB 3.53Å; S311-D314 WeakPolarHBondContact OG-CB 3.26Å; S311-D314 PolarHBondContact OG-N 3.26Å; S311-D314 PolarHBondContact OG-OD2 2.97Å; D314-Q317 PolarHBondContact O-N 2.72Å; D314-H318 PolarHBondContact O-N 3.08Å; D314-H318 VanDerWaalsContact O-N 3.16Å
315	A	98.8	Very high	98.1	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-70.2	-36.8	176.3	0	0	0	0	0	112.4	L136 M208 L297 M301 I310 S311 V312 D313 Q317 H318 I321	L136-A315 HydrophobicContact CD1-CB 3.99Å; L136-A315 HydrophobicContact CD2-CB 4.21Å; M208-A315 HydrophobicContact CE-CB 3.38Å; L297-A315 HydrophobicContact CD1-CB 4.37Å; M301-A315 HydrophobicContact CE-CB 4.04Å; I310-A315 HydrophobicContact CD1-CB 4Å; I310-A315 HydrophobicContact CG1-CB 4.34Å; I310-A315 HydrophobicContact CG2-CB 4.46Å; S311-A315 WeakPolarHBondContact O-CB 3.44Å; S311-A315 PolarHBondContact O-N 2.75Å; S311-A315 VanDerWaalsContact O-N 3.11Å; V312-A315 PolarHBondContact O-N 2.98Å; D313-A315 VanDerWaalsContact C-N 3.26Å; D313-A315 PolarHBondContact O-N 2.7Å; A315-Q317 VanDerWaalsContact C-N 3.27Å; A315-Q317 PolarHBondContact O-N 2.76Å; A315-H318 WeakPolarHBondContact O-CB 3.44Å; A315-H318 PolarHBondContact O-N 3.11Å; A315-H318 VanDerWaalsContact O-N 3.17Å; A315-I321 WeakPolarHBondContact O-CB 3.49Å
316	L	98.6	Very high	98.2	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-65.1	-32.8	173.4	-76.6	165.3	0	0	0	112.1	Y133 L136 K140 V312 D313 H318 I321 N322 Y325 V330	Y133-L316 HydrophobicContact CD2-CD2 3.81Å; Y133-L316 HydrophobicContact CE2-CD2 3.96Å; L136-L316 HydrophobicContact CB-CD2 3.6Å; L136-L316 HydrophobicContact CB-CG 3.95Å; L136-L316 HydrophobicContact CD1-CD2 4.32Å; L136-L316 HydrophobicContact CD1-CG 4.46Å; K140-L316 HydrophobicContact CB-CD1 4.48Å; K140-L316 HydrophobicContact CD-CD1 3.71Å; V312-L316 HydrophobicContact CG1-CD1 4.16Å; V312-L316 WeakPolarHBondContact O-CG 3.4Å; V312-L316 PolarHBondContact O-N 3.42Å; D313-L316 PolarHBondContact O-N 3.05Å; L316-H318 VanDerWaalsContact C-N 3.29Å; L316-I321 HydrophobicContact CD2-CG2 4.32Å; L316-N322 WeakPolarHBondContact O-CA 3.48Å; L316-Y325 HydrophobicContact CB-CD2 4.29Å; L316-Y325 HydrophobicContact CB-CE2 4.24Å; L316-V330 HydrophobicContact CD1-CG1 3.87Å; L316-V330 HydrophobicContact CD1-CG2 4.34Å; L316-V330 HydrophobicContact CD2-CG2 4.29Å
317	Q	98.6	Very high	98.2	Very high	94 Å²	94	51 Å²	51	44%	0.439	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-4.8	174.9	-63.7	-57.9	-42	0	0	113.7	D313 D314 A315	D313-Q317 WeakPolarHBondContact O-CG 3.16Å; D313-Q317 PolarHBondContact O-N 3.01Å; D313-Q317 VanDerWaalsContact O-N 3.13Å; D314-Q317 PolarHBondContact O-N 2.72Å; A315-Q317 VanDerWaalsContact C-N 3.27Å; A315-Q317 PolarHBondContact O-N 2.76Å
318	H	98.8	Very high	98.1	Very high	7 Å²	7	50.8 Å²	50.8	3%	0.032	28%	0.276	C	S	.	.	S	Bend	trans	-65.3	138.2	-178.6	-169	-89.9	0	0	0	111.3	Q293 D296 L297 D314 A315 L316 Y320 I321 N322	Q293-H318 PolarHBondContact O-CE1 3.05Å; D296-H318 IonicContact OD2-CE1 2.65Å; D296-H318 IonicContact OD2-NE2 3.92Å; D296-H318 PolarHBondContact OD2-NE2 3.2Å; L297-H318 HydrophobicContact CD1-CB 3.94Å; D314-H318 PolarHBondContact O-N 3.08Å; D314-H318 VanDerWaalsContact O-N 3.16Å; A315-H318 WeakPolarHBondContact O-CB 3.44Å; A315-H318 PolarHBondContact O-N 3.11Å; A315-H318 VanDerWaalsContact O-N 3.17Å; L316-H318 VanDerWaalsContact C-N 3.29Å; H318-Y320 WeakPolarHBondContact ND1-CB 3.4Å; H318-Y320 PolarHBondContact ND1-N 2.67Å; H318-Y320 PolarHBondContact O-N 3.07Å; H318-I321 PolarHBondContact O-N 3.15Å; H318-N322 WeakPolarHBondContact O-CB 3.28Å; H318-N322 PolarHBondContact O-N 2.91Å
319	P	98.6	Very high	98	Very high	71 Å²	71	46.3 Å²	46.3	46%	0.461	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-26.4	-176.7	-29	35.5	0	0	0	115.8	Q293 I321	Q293-P319 HydrophobicContact CG-CB 4.38Å; P319-I321 VanDerWaalsContact C-N 3.33Å
320	Y	98.6	Very high	97.9	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-29.6	174.4	-163.9	-115.7	0	0	0	113.2	H125 S129 L132 M215 K290 Q293 A294 L297 H318	H125-Y320 HydrophobicContact CB-CE2 4.23Å; H125-Y320 AromaticContact ND1-CE2 3.49Å; H125-Y320 WeakPolarHBondContact ND1-CE2 3.36Å; H125-Y320 AromaticContact ND1-CZ 3.63Å; H125-Y320 PolarHBondContact ND1-OH 2.78Å; S129-Y320 WeakPolarHBondContact CB-O 3.49Å; L132-Y320 HydrophobicContact CD1-CD1 4.4Å; L132-Y320 HydrophobicContact CD1-CE1 3.98Å; M215-Y320 HydrophobicContact CE-CD1 4.1Å; M215-Y320 HydrophobicContact CE-CE1 3.83Å; K290-Y320 HydrophobicContact CB-CE2 4.25Å; K290-Y320 HydrophobicContact CD-CD2 4.13Å; K290-Y320 HydrophobicContact CD-CE2 4.2Å; K290-Y320 WeakPolarHBondContact O-CE2 3.36Å; Q293-Y320 HydrophobicContact CB-CD2 3.91Å; Q293-Y320 HydrophobicContact CB-CG 4.38Å; A294-Y320 HydrophobicContact CB-CD1 4.39Å; A294-Y320 HydrophobicContact CB-CD2 4.05Å; A294-Y320 HydrophobicContact CB-CE1 4.02Å; A294-Y320 HydrophobicContact CB-CE2 3.67Å; A294-Y320 HydrophobicContact CB-CG 4.4Å; L297-Y320 HydrophobicContact CD2-CD1 4.05Å; H318-Y320 WeakPolarHBondContact ND1-CB 3.4Å; H318-Y320 PolarHBondContact ND1-N 2.67Å; H318-Y320 PolarHBondContact O-N 3.07Å
321	I	98.8	Very high	97.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107	-38.8	-172.4	-57.8	-57	0	0	0	111.8	L132 Y133 L136 L297 A315 L316 H318 P319 V323 W324	L132-I321 HydrophobicContact CB-CD1 3.6Å; L132-I321 HydrophobicContact CD1-CD1 4.27Å; Y133-I321 HydrophobicContact CD2-CG2 3.93Å; Y133-I321 HydrophobicContact CG-CG2 4.45Å; L136-I321 HydrophobicContact CD1-CG1 4.24Å; L136-I321 HydrophobicContact CD1-CG2 4.04Å; L297-I321 HydrophobicContact CD2-CD1 3.84Å; L297-I321 HydrophobicContact CD2-CG1 3.63Å; A315-I321 WeakPolarHBondContact O-CB 3.49Å; L316-I321 HydrophobicContact CD2-CG2 4.32Å; H318-I321 PolarHBondContact O-N 3.15Å; P319-I321 VanDerWaalsContact C-N 3.33Å; I321-V323 PolarHBondContact O-N 3.37Å; I321-W324 PolarHBondContact O-N 3.34Å
322	N	98.1	Very high	97.2	Very high	68 Å²	68	50.7 Å²	50.7	36%	0.364	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-58.9	-17.7	-171.3	-171.3	32.1	0	0	0	114.2	L316 H318 W324 Y325	L316-N322 WeakPolarHBondContact O-CA 3.48Å; H318-N322 WeakPolarHBondContact O-CB 3.28Å; H318-N322 PolarHBondContact O-N 2.91Å; N322-W324 PolarHBondContact O-N 2.85Å; N322-W324 VanDerWaalsContact O-N 3.14Å; N322-Y325 WeakPolarHBondContact O-CB 3.38Å; N322-Y325 PolarHBondContact O-N 2.93Å; N322-Y325 VanDerWaalsContact O-N 3.1Å; N322-Y325 VanDerWaalsContact OD1-CB 3.26Å; N322-Y325 WeakPolarHBondContact OD1-CB 3.38Å
323	V	98	Very high	96.7	Very high	86 Å²	86	55.3 Å²	55.3	52%	0.521	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-59.4	-21.8	173	-59.5	0	0	0	0	113.3	I321	I321-V323 PolarHBondContact O-N 3.37Å
324	W	98.4	Very high	95.6	Very high	72 Å²	72	55 Å²	55	27%	0.273	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-101.9	-0	179	-56	114.3	0	0	0	113.7	E126 S129 Y130 Y133 I321 N322 D326	E126-W324 HydrophobicContact CB-CZ2 4.46Å; E126-W324 HydrophobicContact CG-CH2 3.58Å; E126-W324 HydrophobicContact CG-CZ2 3.42Å; E126-W324 VanDerWaalsContact CG-CZ2 3.42Å; S129-W324 PolarHBondContact OG-NE1 3.33Å; Y130-W324 HydrophobicContact CD2-CB 4.44Å; Y130-W324 AromaticContact CD2-CD2 3.69Å; Y130-W324 HydrophobicContact CD2-CD2 3.69Å; Y130-W324 AromaticContact CD2-CE3 3.84Å; Y130-W324 HydrophobicContact CD2-CE3 3.84Å; Y130-W324 AromaticContact CD2-CG 3.96Å; Y130-W324 HydrophobicContact CD2-CG 3.96Å; Y130-W324 HydrophobicContact CD2-CZ3 4.37Å; Y130-W324 HydrophobicContact CE2-CE3 4.34Å; Y130-W324 HydrophobicContact CG-CD2 4.34Å; Y130-W324 HydrophobicContact CG-CZ2 4.5Å; Y133-W324 HydrophobicContact CD1-CB 3.54Å; Y133-W324 HydrophobicContact CD1-CG 4.33Å; Y133-W324 HydrophobicContact CD2-CB 3.84Å; Y133-W324 HydrophobicContact CE1-CB 3.95Å; Y133-W324 WeakPolarHBondContact CE1-O 3.4Å; Y133-W324 HydrophobicContact CE2-CB 4.24Å; Y133-W324 WeakPolarHBondContact CE2-O 3.45Å; Y133-W324 HydrophobicContact CG-CB 3.48Å; Y133-W324 VanDerWaalsContact CG-CB 3.48Å; Y133-W324 HydrophobicContact CG-CG 4.24Å; Y133-W324 PolarHBondContact OH-O 2.8Å; I321-W324 PolarHBondContact O-N 3.34Å; N322-W324 PolarHBondContact O-N 2.85Å; N322-W324 VanDerWaalsContact O-N 3.14Å; W324-D326 PolarHBondContact O-N 2.53Å
325	Y	98.1	Very high	94.2	Very high	64 Å²	64	51 Å²	51	25%	0.251	29%	0.29	S	S	.	.			trans	-64.6	112.7	-168.1	-171.2	-84.2	0	0	0	111.9	L316 N322 P327 V330	L316-Y325 HydrophobicContact CB-CD2 4.29Å; L316-Y325 HydrophobicContact CB-CE2 4.24Å; N322-Y325 WeakPolarHBondContact O-CB 3.38Å; N322-Y325 PolarHBondContact O-N 2.93Å; N322-Y325 VanDerWaalsContact O-N 3.1Å; N322-Y325 VanDerWaalsContact OD1-CB 3.26Å; N322-Y325 WeakPolarHBondContact OD1-CB 3.38Å; Y325-P327 HydrophobicContact CD1-CG 4.43Å; Y325-P327 HydrophobicContact CE1-CG 3.97Å; Y325-V330 HydrophobicContact CD2-CG2 3.94Å; Y325-V330 HydrophobicContact CE2-CB 4.06Å; Y325-V330 HydrophobicContact CE2-CG1 3.71Å; Y325-V330 HydrophobicContact CE2-CG2 3.7Å
326	D	97.9	Very high	92.8	Very high	64 Å²	64	59.3 Å²	59.3	34%	0.342	33%	0.328	S	S	.	.			trans	-115.9	118.9	168.1	-172.8	-21.5	0	0	0	110.3	Y133 W324 A328 E329 V330	Y133-D326 PolarHBondContact OH-N 2.95Å; Y133-D326 VanDerWaalsContact OH-N 3.12Å; W324-D326 PolarHBondContact O-N 2.53Å; D326-A328 PolarHBondContact O-N 2.85Å; D326-A328 WeakPolarHBondContact OD1-CB 3.31Å; D326-A328 PolarHBondContact OD1-N 3Å; D326-E329 HydrophobicContact CB-CB 4.3Å; D326-E329 HydrophobicContact CB-CG 3.85Å; D326-E329 PolarHBondContact O-N 3.37Å; D326-E329 VanDerWaalsContact O-N 3.14Å; D326-V330 WeakPolarHBondContact O-CB 3.13Å; D326-V330 WeakPolarHBondContact O-CG2 3.4Å; D326-V330 PolarHBondContact O-N 3.07Å
327	P	96.2	Very high	91	Very high	70 Å²	70	66 Å²	66	46%	0.455	36%	0.362	S	S	.	.	H	α-helix	trans	-55.2	-35.2	174.9	-22.4	30.5	0	0	0	114	Y325 E329 V330 E331	Y325-P327 HydrophobicContact CD1-CG 4.43Å; Y325-P327 HydrophobicContact CE1-CG 3.97Å; P327-E329 PolarHBondContact O-N 2.91Å; P327-V330 PolarHBondContact O-N 2.88Å; P327-E331 WeakPolarHBondContact O-CA 3.25Å; P327-E331 VanDerWaalsContact O-CB 3.28Å; P327-E331 WeakPolarHBondContact O-CB 3.27Å; P327-E331 PolarHBondContact O-N 3.06Å
328	A	95.2	Very high	89.5	Confident	77 Å²	77	61.9 Å²	61.9	64%	0.636	34%	0.343	S	S	*	.	H	α-helix	trans	-65.2	-27.7	-179.1	0	0	0	0	0	112.2	D326	D326-A328 PolarHBondContact O-N 2.85Å; D326-A328 WeakPolarHBondContact OD1-CB 3.31Å; D326-A328 PolarHBondContact OD1-N 3Å
329	E	95.4	Very high	88	Confident	42 Å²	42	64.7 Å²	64.7	20%	0.196	36%	0.358	C	S	.	.	H	α-helix	trans	-88.6	-44.4	177.3	-53.6	-174.4	172.2	0	0	111.1	H82 K83 Y133 D326 P327	H82-E329 PolarHBondContact NE2-O 3.06Å; H82-E329 VanDerWaalsContact NE2-O 3.09Å; K83-E329 WeakPolarHBondContact CE-OE1 3.4Å; K83-E329 WeakPolarHBondContact CE-OE2 3.33Å; K83-E329 IonicContact NZ-OE1 3.58Å; K83-E329 PolarHBondContact NZ-OE1 3.05Å; K83-E329 IonicContact NZ-OE2 2.65Å; K83-E329 PolarHBondContact NZ-OE2 3.1Å; Y133-E329 VanDerWaalsContact CE1-OE2 3.3Å; Y133-E329 WeakPolarHBondContact CE1-OE2 3.34Å; Y133-E329 PolarHBondContact OH-OE2 3.33Å; D326-E329 HydrophobicContact CB-CB 4.3Å; D326-E329 HydrophobicContact CB-CG 3.85Å; D326-E329 PolarHBondContact O-N 3.37Å; D326-E329 VanDerWaalsContact O-N 3.14Å; P327-E329 PolarHBondContact O-N 2.91Å
330	V	95.6	Very high	86.4	Confident	7 Å²	7	67 Å²	67	4%	0.042	36%	0.361	C	S	.	.	H	α-helix	trans	-72.1	-38.7	-175.7	170.9	0	0	0	0	112	Y133 K140 L316 Y325 D326 P327	Y133-V330 HydrophobicContact CE2-CG2 3.96Å; K140-V330 HydrophobicContact CD-CG1 3.62Å; K140-V330 VanDerWaalsContact CD-O 3.23Å; K140-V330 WeakPolarHBondContact CD-O 3.47Å; K140-V330 WeakPolarHBondContact CE-O 3.35Å; L316-V330 HydrophobicContact CD1-CG1 3.87Å; L316-V330 HydrophobicContact CD1-CG2 4.34Å; L316-V330 HydrophobicContact CD2-CG2 4.29Å; Y325-V330 HydrophobicContact CD2-CG2 3.94Å; Y325-V330 HydrophobicContact CE2-CB 4.06Å; Y325-V330 HydrophobicContact CE2-CG1 3.71Å; Y325-V330 HydrophobicContact CE2-CG2 3.7Å; D326-V330 WeakPolarHBondContact O-CB 3.13Å; D326-V330 WeakPolarHBondContact O-CG2 3.4Å; D326-V330 PolarHBondContact O-N 3.07Å; P327-V330 PolarHBondContact O-N 2.88Å
331	E	92.8	Very high	84.7	Confident	131 Å²	131	72.2 Å²	72.2	61%	0.612	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	18.7	-175.6	-52	-173.3	171.1	0	0	112.3	P327	P327-E331 WeakPolarHBondContact O-CA 3.25Å; P327-E331 VanDerWaalsContact O-CB 3.28Å; P327-E331 WeakPolarHBondContact O-CB 3.27Å; P327-E331 PolarHBondContact O-N 3.06Å
332	A	90.8	Very high	83.2	Confident	21 Å²	21	72.8 Å²	72.8	17%	0.174	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-50.1	130.8	175	0	0	0	0	0	110.3	H141	H141-A332 PolarHBondContact ND1-O 2.97Å
333	P	86.3	Confident	81.6	Confident	108 Å²	108	70.3 Å²	70.3	70%	0.701	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-58	136.1	-169.9	22.4	-33.3	0	0	0	110.5	H141	H141-P333 PolarHBondContact CE1-O 3.29Å
334	P	75.4	Confident	80.3	Confident	74 Å²	74	73 Å²	73	48%	0.481	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-60.3	150.7	-179	25	-33.7	0	0	0	110.1	S144	S144-P334 WeakPolarHBondContact OG-CB 3.4Å
335	P	69.8	Low	79.4	Confident	15 Å²	15	74.2 Å²	74.2	10%	0.097	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-61.1	164.2	168.4	31.9	-36.7	0	0	0	110.4	C79 V80 A145 I337	C79-P335 VanDerWaalsContact C-CB 3.46Å; C79-P335 HydrophobicContact CB-CB 4.32Å; C79-P335 WeakPolarHBondContact O-CB 3.43Å; V80-P335 HydrophobicContact CG2-CG 4.17Å; A145-P335 HydrophobicContact CB-CG 3.48Å; A145-P335 VanDerWaalsContact CB-CG 3.48Å; P335-I337 PolarHBondContact O-N 3.26Å; P335-I337 VanDerWaalsContact O-N 3.12Å
336	Q	68.4	Low	78.6	Confident	174 Å²	174	77.3 Å²	77.3	81%	0.813	40%	0.403	S	S	*	.	S	Bend	trans	-49.4	127.6	169.9	-95.8	-172.2	-14.4	0	0	109.2	Y338	Q336-Y338 PolarHBondContact O-N 3.06Å
337	I	62.3	Low	78.2	Confident	140 Å²	140	76.4 Å²	76.4	72%	0.718	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-49.3	124.6	-170.9	-61.6	174	0	0	0	109	P335 D339	P335-I337 PolarHBondContact O-N 3.26Å; P335-I337 VanDerWaalsContact O-N 3.12Å; I337-D339 PolarHBondContact O-N 3.17Å
338	Y	65.8	Low	78.1	Confident	8 Å²	8	75.9 Å²	75.9	3%	0.031	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-58.3	124.3	174.1	176.9	-105	0	0	0	109	R72 V75 L76 I147 T175 Q336 K340 L342 D343	R72-Y338 WeakPolarHBondContact CD-OH 3.45Å; R72-Y338 HydrophobicContact CG-CE2 4.05Å; R72-Y338 VanDerWaalsContact CG-OH 3.24Å; R72-Y338 WeakPolarHBondContact CG-OH 3.37Å; V75-Y338 HydrophobicContact CG1-CD2 4.45Å; V75-Y338 HydrophobicContact CG1-CE2 4.34Å; L76-Y338 HydrophobicContact CD2-CD2 3.24Å; L76-Y338 HydrophobicContact CD2-CE2 3.52Å; L76-Y338 HydrophobicContact CD2-CG 3.91Å; L76-Y338 HydrophobicContact CG-CD2 4.19Å; L76-Y338 HydrophobicContact CG-CE2 3.98Å; I147-Y338 HydrophobicContact CG1-CG 4.45Å; T175-Y338 WeakPolarHBondContact OG1-CD1 3.24Å; T175-Y338 VanDerWaalsContact OG1-CE1 3.28Å; T175-Y338 WeakPolarHBondContact OG1-CE1 3.4Å; Q336-Y338 PolarHBondContact O-N 3.06Å; Y338-K340 PolarHBondContact O-N 3.05Å; Y338-L342 HydrophobicContact CE2-CB 4.42Å; Y338-L342 HydrophobicContact CE2-CD1 4.43Å; Y338-L342 HydrophobicContact CE2-CD2 4.02Å; Y338-L342 WeakPolarHBondContact OH-CD2 3.12Å; Y338-D343 PolarHBondContact OH-OD1 2.81Å
339	D	68.6	Low	78.1	Confident	67 Å²	67	74.4 Å²	74.4	36%	0.358	37%	0.373	S	S	.	.			trans	-60.7	105.2	178.2	179.5	6.5	0	0	0	108.7	I337 Q341 L342 R345	I337-D339 PolarHBondContact O-N 3.17Å; D339-Q341 PolarHBondContact O-N 2.87Å; D339-Q341 VanDerWaalsContact O-N 3.08Å; D339-Q341 WeakPolarHBondContact OD1-CB 3.45Å; D339-Q341 WeakPolarHBondContact OD1-CG 3.25Å; D339-Q341 PolarHBondContact OD1-N 3.22Å; D339-L342 HydrophobicContact CB-CB 4.39Å; D339-L342 WeakPolarHBondContact O-CB 3.45Å; D339-L342 PolarHBondContact O-N 2.88Å; D339-R345 IonicContact OD2-CZ 3.37Å; D339-R345 IonicContact OD2-NH1 2.84Å; D339-R345 IonicContact OD2-NH2 3.08Å; D339-R345 PolarHBondContact OD2-NH2 3.29Å
340	K	64.9	Low	78	Confident	119 Å²	119	78.4 Å²	78.4	52%	0.517	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-28.8	179.7	-57.1	-161.5	167.4	-174.8	0	111.8	T175 Y338 L342 D343	T175-K340 HydrophobicContact CG2-CB 3.92Å; T175-K340 HydrophobicContact CG2-CD 3.52Å; T175-K340 HydrophobicContact CG2-CG 3.45Å; T175-K340 VanDerWaalsContact CG2-CG 3.45Å; Y338-K340 PolarHBondContact O-N 3.05Å; K340-L342 PolarHBondContact O-N 2.81Å; K340-D343 PolarHBondContact O-N 3.47Å
341	Q	62.6	Low	78	Confident	109 Å²	109	82 Å²	82	51%	0.509	41%	0.408	S	S	.	.	H	α-helix	trans	-68.6	-18.8	178.2	-56.7	-177.4	-8.9	0	0	112.4	D339 D343 E344 R345	D339-Q341 PolarHBondContact O-N 2.87Å; D339-Q341 VanDerWaalsContact O-N 3.08Å; D339-Q341 WeakPolarHBondContact OD1-CB 3.45Å; D339-Q341 WeakPolarHBondContact OD1-CG 3.25Å; D339-Q341 PolarHBondContact OD1-N 3.22Å; Q341-D343 PolarHBondContact O-N 2.83Å; Q341-E344 PolarHBondContact O-N 3.07Å; Q341-E344 VanDerWaalsContact O-N 3.15Å; Q341-R345 VanDerWaalsContact O-CG 3.23Å; Q341-R345 WeakPolarHBondContact O-CG 3.49Å; Q341-R345 PolarHBondContact O-N 2.82Å
342	L	66.9	Low	78	Confident	12 Å²	12	75.9 Å²	75.9	6%	0.063	38%	0.38	C	S	.	.	H	α-helix	trans	-64.7	-29.9	178.7	-157.6	143.7	0	0	0	111.9	Y71 R72 V75 Y338 D339 K340	Y71-L342 HydrophobicContact CD1-CD1 4.45Å; Y71-L342 HydrophobicContact CD1-CD2 3.83Å; Y71-L342 HydrophobicContact CD1-CG 4.32Å; Y71-L342 HydrophobicContact CE1-CD1 3.63Å; Y71-L342 HydrophobicContact CE1-CD2 3.83Å; Y71-L342 HydrophobicContact CE1-CG 3.82Å; R72-L342 HydrophobicContact CB-CD2 4.45Å; R72-L342 HydrophobicContact CG-CD2 4.49Å; V75-L342 HydrophobicContact CG1-CD1 4.13Å; V75-L342 HydrophobicContact CG2-CD1 4.35Å; Y338-L342 HydrophobicContact CE2-CB 4.42Å; Y338-L342 HydrophobicContact CE2-CD1 4.43Å; Y338-L342 HydrophobicContact CE2-CD2 4.02Å; Y338-L342 WeakPolarHBondContact OH-CD2 3.12Å; D339-L342 HydrophobicContact CB-CB 4.39Å; D339-L342 WeakPolarHBondContact O-CB 3.45Å; D339-L342 PolarHBondContact O-N 2.88Å; K340-L342 PolarHBondContact O-N 2.81Å
343	D	64.7	Low	78.3	Confident	16 Å²	16	76.7 Å²	76.7	9%	0.086	38%	0.379	C	S	.	.	H	α-helix	trans	-79.6	-26.7	174.4	-76.8	-26.9	0	0	0	112.9	K68 R72 T175 Y338 K340 Q341	K68-D343 VanDerWaalsContact CE-O 3.28Å; K68-D343 WeakPolarHBondContact CE-O 3.34Å; K68-D343 PolarHBondContact NZ-O 3.29Å; R72-D343 IonicContact NH1-OD1 3.49Å; T175-D343 WeakPolarHBondContact CB-OD2 3.45Å; T175-D343 PolarHBondContact N-OD2 2.7Å; T175-D343 PolarHBondContact OG1-OD2 3.22Å; Y338-D343 PolarHBondContact OH-OD1 2.81Å; K340-D343 PolarHBondContact O-N 3.47Å; Q341-D343 PolarHBondContact O-N 2.83Å
344	E	71.4	Confident	78.7	Confident	142 Å²	142	76.7 Å²	76.7	66%	0.664	37%	0.37	S	S	*	.	H	α-helix	trans	-90	-23.8	-176.7	-66.5	-178.9	172.2	0	0	113.3	Q341 E346	Q341-E344 PolarHBondContact O-N 3.07Å; Q341-E344 VanDerWaalsContact O-N 3.15Å; E344-E346 PolarHBondContact O-N 3.34Å
345	R	77.9	Confident	79.6	Confident	99 Å²	99	75.7 Å²	75.7	37%	0.374	36%	0.36	S	S	.	.			trans	-66.5	128.1	176.1	-71.9	169.1	-162.9	162.5	13.8	110.4	K68 D339 Q341	K68-R345 PolarHBondContact NZ-O 2.88Å; D339-R345 IonicContact OD2-CZ 3.37Å; D339-R345 IonicContact OD2-NH1 2.84Å; D339-R345 IonicContact OD2-NH2 3.08Å; D339-R345 PolarHBondContact OD2-NH2 3.29Å; Q341-R345 VanDerWaalsContact O-CG 3.23Å; Q341-R345 WeakPolarHBondContact O-CG 3.49Å; Q341-R345 PolarHBondContact O-N 2.82Å
346	E	82.8	Confident	80.8	Confident	128 Å²	128	75.1 Å²	75.1	60%	0.598	36%	0.356	S	S	*	.			trans	-104.4	130.1	167.7	-67.8	-59	140.6	0	0	107.8	K68 E344	K68-E346 IonicContact NZ-OE1 2.81Å; K68-E346 PolarHBondContact NZ-OE1 3.42Å; E344-E346 PolarHBondContact O-N 3.34Å
347	H	88.3	Confident	82	Confident	46 Å²	46	68.7 Å²	68.7	21%	0.213	33%	0.325	C	S	.	.			trans	-131.7	153.5	-177.7	-72	-65.9	0	0	0	109.7	E351 W352	H347-E351 WeakPolarHBondContact CA-OE2 3.29Å; H347-E351 HydrophobicContact CB-CB 3.86Å; H347-E351 VanDerWaalsContact CB-OE2 3.32Å; H347-E351 WeakPolarHBondContact CB-OE2 3.46Å; H347-E351 IonicContact CG-OE2 2.66Å; H347-E351 IonicContact ND1-OE2 3.49Å; H347-E351 PolarHBondContact ND1-OE2 3.4Å; H347-W352 HydrophobicContact CB-CD2 3.92Å; H347-W352 HydrophobicContact CB-CG 4.04Å; H347-W352 HydrophobicContact CB-CZ2 4.08Å; H347-W352 AromaticContact CD2-CE2 4Å; H347-W352 AromaticContact CD2-CH2 3.57Å; H347-W352 AromaticContact CD2-CZ2 3.64Å; H347-W352 AromaticContact CD2-CZ3 3.85Å; H347-W352 PolarHBondContact O-NE1 3.02Å
348	T	94.1	Very high	83.5	Confident	58 Å²	58	68.2 Å²	68.2	36%	0.356	32%	0.318	S	S	.	.			trans	-66.3	167.3	169.1	67.3	0	0	0	0	110.6	E350 E351 W352	T348-E350 PolarHBondContact O-N 3.49Å; T348-E351 PolarHBondContact N-OE2 2.77Å; T348-E351 PolarHBondContact O-N 2.91Å; T348-E351 WeakPolarHBondContact OG1-CB 3.22Å; T348-E351 VanDerWaalsContact OG1-CG 3.25Å; T348-E351 WeakPolarHBondContact OG1-CG 3.31Å; T348-E351 PolarHBondContact OG1-N 2.91Å; T348-W352 PolarHBondContact O-N 2.83Å
349	I	94.4	Very high	84.7	Confident	46 Å²	46	70 Å²	70	24%	0.236	33%	0.327	C	S	.	.	H	α-helix	trans	-64.4	-37.9	178.6	-64.1	173.1	0	0	0	109.8	F61 Q64 W352 K353	F61-I349 HydrophobicContact CB-CG2 3.94Å; F61-I349 VanDerWaalsContact O-CG2 3.26Å; F61-I349 WeakPolarHBondContact O-CG2 3.29Å; Q64-I349 HydrophobicContact CG-CG1 3.91Å; I349-W352 PolarHBondContact O-N 3.12Å; I349-K353 VanDerWaalsContact O-CB 3.26Å; I349-K353 WeakPolarHBondContact O-CB 3.36Å; I349-K353 PolarHBondContact O-N 3.43Å
350	E	94.2	Very high	85.9	Confident	126 Å²	126	66.9 Å²	66.9	59%	0.589	31%	0.309	S	S	*	.	H	α-helix	trans	-64	-46.6	178.5	-65.7	68.8	-152.8	0	0	111.1	T348 K353 E354	T348-E350 PolarHBondContact O-N 3.49Å; E350-K353 WeakPolarHBondContact O-CB 3.38Å; E350-K353 PolarHBondContact O-N 3.16Å; E350-E354 PolarHBondContact O-N 2.98Å
351	E	94.8	Very high	87.2	Confident	83 Å²	83	63.3 Å²	63.3	39%	0.388	30%	0.295	S	S	.	.	H	α-helix	trans	-62.4	-43.8	175	-74.3	170.5	173.8	0	0	111.8	H347 T348 K353 E354 L355	H347-E351 WeakPolarHBondContact CA-OE2 3.29Å; H347-E351 HydrophobicContact CB-CB 3.86Å; H347-E351 VanDerWaalsContact CB-OE2 3.32Å; H347-E351 WeakPolarHBondContact CB-OE2 3.46Å; H347-E351 IonicContact CG-OE2 2.66Å; H347-E351 IonicContact ND1-OE2 3.49Å; H347-E351 PolarHBondContact ND1-OE2 3.4Å; T348-E351 PolarHBondContact N-OE2 2.77Å; T348-E351 PolarHBondContact O-N 2.91Å; T348-E351 WeakPolarHBondContact OG1-CB 3.22Å; T348-E351 VanDerWaalsContact OG1-CG 3.25Å; T348-E351 WeakPolarHBondContact OG1-CG 3.31Å; T348-E351 PolarHBondContact OG1-N 2.91Å; E351-K353 VanDerWaalsContact C-N 3.3Å; E351-K353 PolarHBondContact O-N 3.04Å; E351-E354 WeakPolarHBondContact O-CB 3.49Å; E351-E354 PolarHBondContact O-N 2.97Å; E351-L355 WeakPolarHBondContact O-CG 3.32Å; E351-L355 PolarHBondContact O-N 3.22Å
352	W	94.6	Very high	88.4	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.008	29%	0.285	C	S	.	.	H	α-helix	trans	-62.3	-40	174.3	-79.6	124.6	0	0	0	112.2	A67 K68 Y71 H347 T348 I349 E354 L355 I356	A67-W352 HydrophobicContact CB-CB 3.57Å; A67-W352 HydrophobicContact CB-CG 3.81Å; K68-W352 HydrophobicContact CB-CZ2 3.8Å; K68-W352 HydrophobicContact CD-CZ2 3.79Å; K68-W352 HydrophobicContact CG-CH2 4.11Å; K68-W352 HydrophobicContact CG-CZ2 3.6Å; Y71-W352 AromaticContact CD1-CE3 3.87Å; Y71-W352 HydrophobicContact CD1-CE3 3.87Å; Y71-W352 HydrophobicContact CD1-CH2 4.15Å; Y71-W352 AromaticContact CD1-CZ3 3.25Å; Y71-W352 HydrophobicContact CD1-CZ3 3.25Å; Y71-W352 AromaticContact CE1-CZ3 3.76Å; Y71-W352 HydrophobicContact CE1-CZ3 3.76Å; Y71-W352 AromaticContact CG-CE3 3.91Å; Y71-W352 HydrophobicContact CG-CE3 3.91Å; Y71-W352 AromaticContact CG-CZ3 3.79Å; Y71-W352 HydrophobicContact CG-CZ3 3.79Å; H347-W352 HydrophobicContact CB-CD2 3.92Å; H347-W352 HydrophobicContact CB-CG 4.04Å; H347-W352 HydrophobicContact CB-CZ2 4.08Å; H347-W352 AromaticContact CD2-CE2 4Å; H347-W352 AromaticContact CD2-CH2 3.57Å; H347-W352 AromaticContact CD2-CZ2 3.64Å; H347-W352 AromaticContact CD2-CZ3 3.85Å; H347-W352 PolarHBondContact O-NE1 3.02Å; T348-W352 PolarHBondContact O-N 2.83Å; I349-W352 PolarHBondContact O-N 3.12Å; W352-E354 VanDerWaalsContact C-N 3.33Å; W352-L355 HydrophobicContact CE3-CD1 3.71Å; W352-L355 HydrophobicContact CZ3-CD1 3.77Å; W352-L355 PolarHBondContact O-N 3.13Å; W352-I356 WeakPolarHBondContact O-CB 3.44Å; W352-I356 VanDerWaalsContact O-CG1 3.27Å; W352-I356 WeakPolarHBondContact O-CG1 3.4Å; W352-I356 PolarHBondContact O-N 3.21Å
353	K	95.8	Very high	89.2	Confident	39 Å²	39	60.9 Å²	60.9	17%	0.17	29%	0.287	C	S	.	.	H	α-helix	trans	-62.2	-42.6	177.8	-178	176.1	163.8	176.2	0	110.8	F61 L98 E99 F101 I349 E350 E351 Y357	F61-K353 HydrophobicContact CD1-CB 3.79Å; F61-K353 HydrophobicContact CD1-CG 4.04Å; F61-K353 HydrophobicContact CD2-CD 4.26Å; F61-K353 HydrophobicContact CD2-CG 4.31Å; F61-K353 HydrophobicContact CE1-CB 3.92Å; F61-K353 HydrophobicContact CE1-CG 3.96Å; F61-K353 HydrophobicContact CE2-CG 4.23Å; F61-K353 HydrophobicContact CG-CB 4.32Å; F61-K353 HydrophobicContact CG-CD 4.3Å; F61-K353 HydrophobicContact CG-CG 4.24Å; F61-K353 HydrophobicContact CZ-CG 4.1Å; L98-K353 HydrophobicContact CD1-CG 4.1Å; L98-K353 WeakPolarHBondContact O-CE 3.22Å; L98-K353 PolarHBondContact O-NZ 3.01Å; E99-K353 PolarHBondContact O-NZ 3.25Å; F101-K353 HydrophobicContact CD1-CD 4.42Å; F101-K353 HydrophobicContact CD1-CG 3.66Å; F101-K353 HydrophobicContact CE1-CG 4.19Å; F101-K353 WeakPolarHBondContact O-CE 3.35Å; F101-K353 PolarHBondContact O-NZ 3.24Å; I349-K353 VanDerWaalsContact O-CB 3.26Å; I349-K353 WeakPolarHBondContact O-CB 3.36Å; I349-K353 PolarHBondContact O-N 3.43Å; E350-K353 WeakPolarHBondContact O-CB 3.38Å; E350-K353 PolarHBondContact O-N 3.16Å; E351-K353 VanDerWaalsContact C-N 3.3Å; E351-K353 PolarHBondContact O-N 3.04Å; K353-Y357 WeakPolarHBondContact O-CB 3.38Å; K353-Y357 PolarHBondContact O-N 3.02Å
354	E	95.6	Very high	89.7	Confident	108 Å²	108	61.3 Å²	61.3	51%	0.505	29%	0.288	S	S	.	.	H	α-helix	trans	-60.4	-47.8	172.7	-78.2	179.3	-163.9	0	0	112.7	L98 E350 E351 W352 Y357 K358	L98-E354 HydrophobicContact CD1-CG 4.01Å; L98-E354 HydrophobicContact CD2-CG 3.48Å; L98-E354 VanDerWaalsContact CD2-CG 3.48Å; L98-E354 HydrophobicContact CG-CG 4.35Å; E350-E354 PolarHBondContact O-N 2.98Å; E351-E354 WeakPolarHBondContact O-CB 3.49Å; E351-E354 PolarHBondContact O-N 2.97Å; W352-E354 VanDerWaalsContact C-N 3.33Å; E354-Y357 PolarHBondContact O-N 2.8Å; E354-K358 WeakPolarHBondContact O-CB 3.33Å; E354-K358 PolarHBondContact O-N 3.49Å
355	L	94.1	Very high	89.9	Confident	53 Å²	53	60.2 Å²	60.2	28%	0.277	28%	0.283	S	S	.	.	H	α-helix	trans	-61.4	-46	179.5	-72.1	172.5	0	0	0	111.9	Y71 E351 W352 E359	Y71-L355 HydrophobicContact CD2-CB 4.05Å; Y71-L355 HydrophobicContact CE2-CB 3.74Å; E351-L355 WeakPolarHBondContact O-CG 3.32Å; E351-L355 PolarHBondContact O-N 3.22Å; W352-L355 HydrophobicContact CE3-CD1 3.71Å; W352-L355 HydrophobicContact CZ3-CD1 3.77Å; W352-L355 PolarHBondContact O-N 3.13Å; L355-E359 PolarHBondContact O-N 2.91Å; L355-E359 VanDerWaalsContact O-N 3.09Å
356	I	94.2	Very high	89.6	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-64.2	-47.2	176.9	-66	165.4	0	0	0	109.8	F61 A70 Y71 L74 F101 V104 W352 K358 E359 V360	F61-I356 HydrophobicContact CD1-CD1 4.43Å; F61-I356 HydrophobicContact CE1-CB 4.31Å; F61-I356 HydrophobicContact CE1-CD1 3.61Å; F61-I356 HydrophobicContact CZ-CD1 4.43Å; F61-I356 HydrophobicContact CZ-CG2 4.4Å; A70-I356 HydrophobicContact CB-CD1 4.03Å; Y71-I356 HydrophobicContact CD2-CG1 3.63Å; Y71-I356 HydrophobicContact CG-CG1 4.08Å; L74-I356 HydrophobicContact CD2-CG2 4.31Å; F101-I356 HydrophobicContact CE1-CB 4.28Å; F101-I356 HydrophobicContact CE1-CG2 4.05Å; F101-I356 HydrophobicContact CZ-CG2 3.8Å; V104-I356 HydrophobicContact CG2-CG2 3.97Å; W352-I356 WeakPolarHBondContact O-CB 3.44Å; W352-I356 VanDerWaalsContact O-CG1 3.27Å; W352-I356 WeakPolarHBondContact O-CG1 3.4Å; W352-I356 PolarHBondContact O-N 3.21Å; I356-K358 VanDerWaalsContact C-N 3.3Å; I356-K358 PolarHBondContact O-N 3.38Å; I356-E359 PolarHBondContact O-N 3.19Å; I356-E359 VanDerWaalsContact O-N 3.13Å; I356-V360 HydrophobicContact CG2-CG2 4.24Å; I356-V360 VanDerWaalsContact O-CG2 3.32Å; I356-V360 WeakPolarHBondContact O-CG2 3.35Å; I356-V360 PolarHBondContact O-N 2.92Å
357	Y	95.1	Very high	89	Confident	39 Å²	39	57.5 Å²	57.5	15%	0.153	28%	0.276	C	S	.	.	H	α-helix	trans	-56.5	-46.4	180	-174.5	-108.6	0	0	0	111.5	T93 K96 L98 F101 K353 E354 E359 V360 M361	T93-Y357 HydrophobicContact CG2-CE2 4.31Å; K96-Y357 PolarHBondContact O-OH 2.65Å; L98-Y357 HydrophobicContact CB-CD1 4.26Å; L98-Y357 HydrophobicContact CB-CE1 4.32Å; L98-Y357 HydrophobicContact CD1-CD1 4.15Å; L98-Y357 HydrophobicContact CD1-CG 3.98Å; F101-Y357 HydrophobicContact CB-CD2 3.83Å; F101-Y357 HydrophobicContact CB-CE2 4.15Å; F101-Y357 AromaticContact CD1-CD2 3.65Å; F101-Y357 HydrophobicContact CD1-CD2 3.65Å; F101-Y357 HydrophobicContact CD1-CG 4.07Å; F101-Y357 AromaticContact CD2-CD2 3.85Å; F101-Y357 HydrophobicContact CD2-CD2 3.85Å; F101-Y357 HydrophobicContact CD2-CE2 4.41Å; F101-Y357 HydrophobicContact CE1-CD2 4.07Å; F101-Y357 HydrophobicContact CE1-CG 4.37Å; F101-Y357 HydrophobicContact CE2-CD2 4.27Å; F101-Y357 AromaticContact CG-CD2 3.52Å; F101-Y357 HydrophobicContact CG-CD2 3.52Å; F101-Y357 HydrophobicContact CG-CE2 4.22Å; F101-Y357 HydrophobicContact CG-CG 4.36Å; F101-Y357 HydrophobicContact CZ-CD2 4.36Å; K353-Y357 WeakPolarHBondContact O-CB 3.38Å; K353-Y357 PolarHBondContact O-N 3.02Å; E354-Y357 PolarHBondContact O-N 2.8Å; Y357-E359 PolarHBondContact O-N 3.19Å; Y357-V360 PolarHBondContact O-N 3.23Å; Y357-M361 HydrophobicContact CD1-CG 4.16Å; Y357-M361 HydrophobicContact CD2-CE 4.38Å; Y357-M361 HydrophobicContact CD2-CG 4.47Å; Y357-M361 HydrophobicContact CE1-CG 3.82Å; Y357-M361 HydrophobicContact CE2-CE 3.81Å; Y357-M361 HydrophobicContact CE2-CG 4.17Å; Y357-M361 HydrophobicContact CE2-SD 4.28Å; Y357-M361 HydrophobicContact CG-CG 4.48Å; Y357-M361 VanDerWaalsContact O-CG 3.32Å; Y357-M361 WeakPolarHBondContact O-CG 3.36Å; Y357-M361 PolarHBondContact O-N 3.07Å
358	K	93.6	Very high	87.8	Confident	131 Å²	131	61.7 Å²	61.7	57%	0.57	29%	0.294	S	S	*	.	H	α-helix	trans	-59.8	-44	176.6	-171.9	177.3	-178.2	178.8	0	112.1	E354 I356 V360 M361 N362	E354-K358 WeakPolarHBondContact O-CB 3.33Å; E354-K358 PolarHBondContact O-N 3.49Å; I356-K358 VanDerWaalsContact C-N 3.3Å; I356-K358 PolarHBondContact O-N 3.38Å; K358-V360 PolarHBondContact O-N 2.9Å; K358-M361 PolarHBondContact O-N 3.32Å; K358-N362 VanDerWaalsContact O-CB 3.3Å; K358-N362 WeakPolarHBondContact O-CB 3.44Å; K358-N362 PolarHBondContact O-N 2.86Å; K358-N362 PolarHBondContact O-ND2 2.87Å; K358-N362 PolarHBondContact O-OD1 3.08Å
359	E	91.1	Very high	85.8	Confident	46 Å²	46	64.8 Å²	64.8	22%	0.215	31%	0.308	C	S	.	.	H	α-helix	trans	-64.9	-37.3	177.3	-78.1	-56.3	137.4	0	0	113.4	Y71 L74 K78 L355 I356 Y357 S363	Y71-E359 HydrophobicContact CE2-CG 3.73Å; L74-E359 HydrophobicContact CD2-CB 3.6Å; L74-E359 HydrophobicContact CG-CB 4.39Å; K78-E359 PolarHBondContact NZ-O 3.26Å; K78-E359 IonicContact NZ-OE2 2.74Å; K78-E359 PolarHBondContact NZ-OE2 3.47Å; L355-E359 PolarHBondContact O-N 2.91Å; L355-E359 VanDerWaalsContact O-N 3.09Å; I356-E359 PolarHBondContact O-N 3.19Å; I356-E359 VanDerWaalsContact O-N 3.13Å; Y357-E359 PolarHBondContact O-N 3.19Å; E359-S363 PolarHBondContact O-N 3.08Å; E359-S363 PolarHBondContact O-OG 2.78Å
360	V	93.6	Very high	83.5	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-65.4	-52.3	175.2	176.8	0	0	0	0	110.1	L74 V91 T93 F101 V104 I356 Y357 K358 N362 S363 E364	L74-V360 HydrophobicContact CD2-CG2 4.06Å; V91-V360 HydrophobicContact CG2-CB 4.49Å; V91-V360 HydrophobicContact CG2-CG1 4.24Å; V91-V360 HydrophobicContact CG2-CG2 3.87Å; T93-V360 HydrophobicContact CG2-CG1 3.96Å; F101-V360 HydrophobicContact CZ-CG2 4.49Å; V104-V360 HydrophobicContact CG1-CG2 4.22Å; V104-V360 HydrophobicContact CG2-CG2 4.47Å; I356-V360 HydrophobicContact CG2-CG2 4.24Å; I356-V360 VanDerWaalsContact O-CG2 3.32Å; I356-V360 WeakPolarHBondContact O-CG2 3.35Å; I356-V360 PolarHBondContact O-N 2.92Å; Y357-V360 PolarHBondContact O-N 3.23Å; K358-V360 PolarHBondContact O-N 2.9Å; V360-N362 PolarHBondContact O-N 2.85Å; V360-S363 WeakPolarHBondContact O-CB 3.49Å; V360-S363 PolarHBondContact O-N 3.27Å; V360-E364 PolarHBondContact O-N 3.46Å; V360-E364 VanDerWaalsContact O-N 3.08Å
361	M	91.6	Very high	80.8	Confident	44 Å²	44	64.3 Å²	64.3	22%	0.217	33%	0.329	C	S	.	.	H	α-helix	trans	-59.7	-44.6	-179.6	-67.1	-62.3	112.9	0	0	112.3	T93 Y357 K358 S363 E364 E365	T93-M361 HydrophobicContact CG2-CE 3.3Å; Y357-M361 HydrophobicContact CD1-CG 4.16Å; Y357-M361 HydrophobicContact CD2-CE 4.38Å; Y357-M361 HydrophobicContact CD2-CG 4.47Å; Y357-M361 HydrophobicContact CE1-CG 3.82Å; Y357-M361 HydrophobicContact CE2-CE 3.81Å; Y357-M361 HydrophobicContact CE2-CG 4.17Å; Y357-M361 HydrophobicContact CE2-SD 4.28Å; Y357-M361 HydrophobicContact CG-CG 4.48Å; Y357-M361 VanDerWaalsContact O-CG 3.32Å; Y357-M361 WeakPolarHBondContact O-CG 3.36Å; Y357-M361 PolarHBondContact O-N 3.07Å; K358-M361 PolarHBondContact O-N 3.32Å; M361-S363 PolarHBondContact O-N 3.23Å; M361-E364 PolarHBondContact O-N 3.41Å; M361-E365 PolarHBondContact O-N 3.14Å; M361-E365 VanDerWaalsContact O-N 3.08Å
362	N	88.3	Confident	78.3	Confident	57 Å²	57	65.8 Å²	65.8	31%	0.305	34%	0.344	S	S	.	.	H	α-helix	trans	-59.3	-31.1	176.6	-73.2	-12.1	0	0	0	112.8	K358 V360 K366	K358-N362 VanDerWaalsContact O-CB 3.3Å; K358-N362 WeakPolarHBondContact O-CB 3.44Å; K358-N362 PolarHBondContact O-N 2.86Å; K358-N362 PolarHBondContact O-ND2 2.87Å; K358-N362 PolarHBondContact O-OD1 3.08Å; V360-N362 PolarHBondContact O-N 2.85Å; N362-K366 WeakPolarHBondContact O-CG 2.97Å; N362-K366 PolarHBondContact O-N 3.32Å
363	S	82.9	Confident	75.5	Confident	13 Å²	13	75.7 Å²	75.7	9%	0.091	39%	0.387	C	S	.	.	H	α-helix	trans	-79.1	-38	179.7	-51.8	0	0	0	0	111.6	K78 E359 V360 M361 K366 T367	K78-S363 WeakPolarHBondContact CE-OG 3.26Å; K78-S363 PolarHBondContact NZ-OG 2.92Å; E359-S363 PolarHBondContact O-N 3.08Å; E359-S363 PolarHBondContact O-OG 2.78Å; V360-S363 WeakPolarHBondContact O-CB 3.49Å; V360-S363 PolarHBondContact O-N 3.27Å; M361-S363 PolarHBondContact O-N 3.23Å; S363-K366 PolarHBondContact O-N 2.82Å; S363-T367 PolarHBondContact O-N 3.49Å; S363-T367 VanDerWaalsContact O-N 3.1Å; S363-T367 PolarHBondContact O-OG1 3.14Å
364	E	76	Confident	72.8	Confident	26 Å²	26	76.6 Å²	76.6	12%	0.121	41%	0.407	C	S	.	.	H	α-helix	trans	-62.4	-41.8	174.2	-73.8	-166.4	-171.9	0	0	112	F92 T93 V360 M361 T367 K368	F92-E364 VanDerWaalsContact CA-OE1 3.31Å; F92-E364 WeakPolarHBondContact CA-OE1 3.41Å; F92-E364 HydrophobicContact CB-CG 4.38Å; F92-E364 WeakPolarHBondContact CB-OE1 3.31Å; T93-E364 PolarHBondContact N-OE1 2.84Å; V360-E364 PolarHBondContact O-N 3.46Å; V360-E364 VanDerWaalsContact O-N 3.08Å; M361-E364 PolarHBondContact O-N 3.41Å; E364-T367 PolarHBondContact O-N 2.78Å; E364-K368 WeakPolarHBondContact O-CG 3.48Å; E364-K368 PolarHBondContact O-N 2.98Å; E364-K368 IonicContact OE2-NZ 3.42Å; E364-K368 PolarHBondContact OE2-NZ 3.45Å
365	E	74.9	Confident	70.1	Confident	118 Å²	118	76.5 Å²	76.5	55%	0.551	41%	0.406	S	S	*	.	H	α-helix	trans	-62.7	-44.1	177.6	-73	-176.8	173.3	0	0	112.2	M361 T367 K368 N369	M361-E365 PolarHBondContact O-N 3.14Å; M361-E365 VanDerWaalsContact O-N 3.08Å; E365-T367 VanDerWaalsContact C-N 3.28Å; E365-T367 PolarHBondContact O-N 2.89Å; E365-K368 PolarHBondContact O-N 2.76Å; E365-N369 WeakPolarHBondContact O-CB 3.33Å; E365-N369 VanDerWaalsContact O-CG 3.26Å; E365-N369 PolarHBondContact O-N 3.02Å; E365-N369 PolarHBondContact O-ND2 2.97Å
366	K	72.8	Confident	67.1	Low	124 Å²	124	79.9 Å²	79.9	54%	0.539	43%	0.432	S	S	.	.	H	α-helix	trans	-60.7	-39.1	175.5	-73.5	178.6	-179.3	-175.9	0	112.2	N362 S363 N369 G370 V371	N362-K366 WeakPolarHBondContact O-CG 2.97Å; N362-K366 PolarHBondContact O-N 3.32Å; S363-K366 PolarHBondContact O-N 2.82Å; K366-N369 PolarHBondContact O-N 3.08Å; K366-G370 PolarHBondContact O-N 3.49Å; K366-V371 PolarHBondContact O-N 3.4Å; K366-V371 VanDerWaalsContact O-N 3.12Å
367	T	69.3	Low	63.9	Low	46 Å²	46	85.1 Å²	85.1	28%	0.282	47%	0.468	S	S	.	.	H	α-helix	trans	-69.4	-40.9	178.8	-51.3	0	0	0	0	111.5	S363 E364 E365 N369 G370	S363-T367 PolarHBondContact O-N 3.49Å; S363-T367 VanDerWaalsContact O-N 3.1Å; S363-T367 PolarHBondContact O-OG1 3.14Å; E364-T367 PolarHBondContact O-N 2.78Å; E365-T367 VanDerWaalsContact C-N 3.28Å; E365-T367 PolarHBondContact O-N 2.89Å; T367-N369 VanDerWaalsContact C-N 3.31Å; T367-N369 PolarHBondContact O-N 3.26Å; T367-G370 PolarHBondContact O-N 3.43Å
368	K	63.9	Low	61	Low	135 Å²	135	89.3 Å²	89.3	59%	0.587	50%	0.501	S	S	*	.	H	α-helix	trans	-65.2	-33.6	175.2	-74.8	169.8	-176.8	158.2	0	112.4	E364 E365 G370	E364-K368 WeakPolarHBondContact O-CG 3.48Å; E364-K368 PolarHBondContact O-N 2.98Å; E364-K368 IonicContact OE2-NZ 3.42Å; E364-K368 PolarHBondContact OE2-NZ 3.45Å; E365-K368 PolarHBondContact O-N 2.76Å; K368-G370 VanDerWaalsContact C-N 3.26Å; K368-G370 PolarHBondContact O-N 3.38Å
369	N	52	Low	58.1	Low	123 Å²	123	88.3 Å²	88.3	66%	0.658	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	5.8	179.1	-66.4	-19.2	0	0	0	113.8	E365 K366 T367 V371	E365-N369 WeakPolarHBondContact O-CB 3.33Å; E365-N369 VanDerWaalsContact O-CG 3.26Å; E365-N369 PolarHBondContact O-N 3.02Å; E365-N369 PolarHBondContact O-ND2 2.97Å; K366-N369 PolarHBondContact O-N 3.08Å; T367-N369 VanDerWaalsContact C-N 3.31Å; T367-N369 PolarHBondContact O-N 3.26Å; N369-V371 HydrophobicContact CB-CG2 4.29Å; N369-V371 PolarHBondContact O-N 3.15Å
370	G	45	Very low	55.6	Low	67 Å²	67	90.5 Å²	90.5	69%	0.691	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.1	14.9	177.2	0	0	0	0	0	114.8	K366 T367 K368 V372	K366-G370 PolarHBondContact O-N 3.49Å; T367-G370 PolarHBondContact O-N 3.43Å; K368-G370 VanDerWaalsContact C-N 3.26Å; K368-G370 PolarHBondContact O-N 3.38Å; G370-V372 PolarHBondContact O-N 3.26Å
371	V	37.3	Very low	52.5	Low	94 Å²	94	94.2 Å²	94.2	57%	0.57	58%	0.575	S	S	*	*			trans	-93.9	72	-177.5	-169.2	0	0	0	0	109.8	K366 N369	K366-V371 PolarHBondContact O-N 3.4Å; K366-V371 VanDerWaalsContact O-N 3.12Å; N369-V371 HydrophobicContact CB-CG2 4.29Å; N369-V371 PolarHBondContact O-N 3.15Å
372	V	43.1	Very low	49.9	Very low	115 Å²	115	97.2 Å²	97.2	70%	0.697	61%	0.607	S	S	*	*			trans	-120.1	88.3	158.2	-175.4	0	0	0	0	107.2	G370	G370-V372 PolarHBondContact O-N 3.26Å
373	K	35	Very low	47	Very low	210 Å²	210	100.5 Å²	100.5	91%	0.913	63%	0.629	S	S	*	*			trans	-80.5	125.1	166.4	-90.2	-174.3	173.9	-177.6	0	108.6
374	G	39.3	Very low	44.6	Very low	58 Å²	58	107.6 Å²	107.6	60%	0.598	67%	0.666	S	S	*	*			trans	119.2	69.9	151	0	0	0	0	0	116.7
375	Q	39.5	Very low	42.3	Very low	105 Å²	105	111 Å²	111	49%	0.491	69%	0.693	S	S	.	*			trans	-144.9	138.3	140.4	-81.3	-169.7	-22.4	0	0	108.6
376	P	30.8	Very low	40.1	Very low	125 Å²	125	111.2 Å²	111.2	81%	0.812	71%	0.708	S	S	*	*			trans	-70.3	139	178.4	27.9	-30.6	0	0	0	110.6
377	S	26.6	Very low	38.1	Very low	111 Å²	111	114 Å²	114	78%	0.776	72%	0.722	S	S	*	*			trans	-63.1	137.9	171.9	-52.7	0	0	0	0	110.4	S379	S377-S379 PolarHBondContact O-N 3.42Å
378	P	34	Very low	36.2	Very low	128 Å²	128	117.3 Å²	117.3	83%	0.831	75%	0.747	S	S	*	*			trans	-84.7	93.2	171.2	32.1	-27	0	0	0	108
379	S	32.6	Very low	34.4	Very low	109 Å²	109	118.7 Å²	118.7	76%	0.762	76%	0.76	S	S	*	*			trans	-163.9	103.4	162.1	-80.4	0	0	0	0	110.4	S377 A381	S377-S379 PolarHBondContact O-N 3.42Å; S379-A381 PolarHBondContact O-N 3.06Å
380	G	39.4	Very low	33.3	Very low	92 Å²	92	118.3 Å²	118.3	95%	0.948	77%	0.765	S	S	*	*			trans	-66.3	110.2	156.4	0	0	0	0	0	108.6
381	A	28.3	Very low	32.9	Very low	78 Å²	78	120.6 Å²	120.6	65%	0.645	77%	0.767	S	S	*	*			trans	-136.8	110.8	160.5	0	0	0	0	0	106.3	S379 V383	S379-A381 PolarHBondContact O-N 3.06Å; A381-V383 PolarHBondContact O-N 2.88Å; A381-V383 VanDerWaalsContact O-N 3.17Å
382	A	36.6	Very low	32.3	Very low	107 Å²	107	121.7 Å²	121.7	88%	0.884	78%	0.779	S	S	*	*			trans	-56.2	117.6	173.6	0	0	0	0	0	109.1
383	V	28.1	Very low	31.5	Very low	127 Å²	127	121 Å²	121	77%	0.77	78%	0.779	S	S	*	*			trans	-99.9	103.6	168.3	-176.2	0	0	0	0	107.1	A381 S385	A381-V383 PolarHBondContact O-N 2.88Å; A381-V383 VanDerWaalsContact O-N 3.17Å; V383-S385 PolarHBondContact O-N 3.23Å
384	N	31.8	Very low	31.2	Very low	162 Å²	162	116 Å²	116	87%	0.866	77%	0.771	S	S	*	*			trans	-58.2	109.4	159.9	-95	-14.5	0	0	0	108.3
385	S	28.6	Very low	30.8	Very low	98 Å²	98	118.8 Å²	118.8	69%	0.685	78%	0.776	S	S	*	*			trans	-103.4	99.8	164.1	54.4	0	0	0	0	108.9	V383 E387	V383-S385 PolarHBondContact O-N 3.23Å; S385-E387 PolarHBondContact O-N 2.85Å
386	S	28.7	Very low	30.3	Very low	122 Å²	122	120.2 Å²	120.2	85%	0.853	79%	0.787	S	S	*	*			trans	-65.7	107	159.3	50.2	0	0	0	0	108.9
387	E	29.7	Very low	30.2	Very low	181 Å²	181	119.9 Å²	119.9	85%	0.846	78%	0.778	S	S	*	*			trans	-112.3	132.5	166.1	-83.2	-170	157.4	0	0	111	S385	S385-E387 PolarHBondContact O-N 2.85Å
388	S	29.1	Very low	30.4	Very low	116 Å²	116	121.5 Å²	121.5	81%	0.811	78%	0.777	S	S	*	*			trans	-66.9	138.3	-178.6	45.5	0	0	0	0	113.7
389	L	26.5	Very low	30.2	Very low	164 Å²	164	120 Å²	120	86%	0.859	77%	0.77	S	S	*	*			trans	-53.1	156.8	170	-76.1	145.2	0	0	0	114.9
390	P	29.6	Very low	30	Very low	115 Å²	115	119.7 Å²	119.7	75%	0.747	77%	0.767	S	S	*	*				-126.7	168.1	127.6	28.1	-11.4	0	0	0	113
391	P	35.4	Very low	29.5	Very low	116 Å²	116	123.6 Å²	123.6	75%	0.753	76%	0.763	S	S	*	*			trans	-105.6	169.8	-147.7	38.9	-34	0	0	0	116.7
392	S	26.5	Very low	29.5	Very low	116 Å²	116	125 Å²	125	81%	0.811	77%	0.768	S	S	*	*			trans	82.9	139.3	161.9	82.7	0	0	0	0	115.9
393	S	26.2	Very low	29.2	Very low	100 Å²	100	125.5 Å²	125.5	70%	0.699	76%	0.76	S	S	*	*			cis	-164.5	160.3	11.3	44.4	0	0	0	0	110.3
394	S	28.2	Very low	29.3	Very low	107 Å²	107	127 Å²	127	75%	0.748	76%	0.764	S	S	*	*			trans	67.2	145	160.2	56.3	0	0	0	0	119.2
395	V	29.7	Very low	29.1	Very low	116 Å²	116	128 Å²	128	70%	0.703	76%	0.764	S	S	*	*			cis	-178.3	140.6	-8.8	144.1	0	0	0	0	103.4
396	N	29.8	Very low	29.2	Very low	135 Å²	135	130.2 Å²	130.2	72%	0.722	77%	0.773	S	S	*	*			trans	67.5	145.6	163.9	-67.1	2	0	0	0	117.8
397	D	29.2	Very low	29.3	Very low	117 Å²	117	132.5 Å²	132.5	63%	0.626	78%	0.775	S	S	*	*			cis	-165.3	149.6	11.1	-103.6	-32.4	0	0	0	109.2
398	I	29.5	Very low	29.2	Very low	146 Å²	146	128 Å²	128	75%	0.749	77%	0.768	S	S	*	*			trans	46.8	122	131.5	-50.8	163.3	0	0	0	117.5
399	S	30.7	Very low	29.3	Very low	97 Å²	97	127.9 Å²	127.9	68%	0.678	77%	0.768	S	S	*	*				178.3	125.8	56.5	38.4	0	0	0	0	107.6
400	S	28.5	Very low	29.4	Very low	102 Å²	102	127.4 Å²	127.4	71%	0.713	77%	0.766	S	S	*	*				61.7	130	90.2	76.6	0	0	0	0	119.1
401	M	29.9	Very low	29.6	Very low	174 Å²	174	128.8 Å²	128.8	86%	0.857	77%	0.773	S	S	*	*			trans	99.4	106	160.5	-54.7	-150.8	162.2	0	0	115.2
402	S	28.2	Very low	29.3	Very low	107 Å²	107	130.1 Å²	130.1	75%	0.748	77%	0.774	S	S	*	*				52.7	134.5	62.9	-55.8	0	0	0	0	111.2
403	T	29.8	Very low	29.6	Very low	118 Å²	118	130.1 Å²	130.1	72%	0.724	77%	0.774	S	S	*	*			cis	-175.1	147.8	3.2	19.1	0	0	0	0	102.4
404	D	29.4	Very low	29.7	Very low	159 Å²	159	129.9 Å²	129.9	85%	0.85	77%	0.772	S	S	*	*				-168.1	126	129.7	-97.5	-20.9	0	0	0	111.7
405	Q	28.1	Very low	29.9	Very low	182 Å²	182	132.6 Å²	132.6	85%	0.85	78%	0.777	S	S	*	*			trans	-86.5	139.8	164.8	-71.2	172.5	-22.4	0	0	107.6
406	T	30.8	Very low	30	Very low	145 Å²	145	136 Å²	136	89%	0.89	79%	0.785	S	S	*	*			trans	-139.5	123.4	144.8	6.6	0	0	0	0	111.2
407	L	29.9	Very low	30.1	Very low	169 Å²	169	134.1 Å²	134.1	89%	0.885	79%	0.789	S	S	*	*			trans	-43.3	157.7	178.9	-77.8	143.1	0	0	0	118.9
408	A	27.9	Very low	30.2	Very low	86 Å²	86	134.4 Å²	134.4	71%	0.711	80%	0.8	S	S	*	*			trans	-59.3	160.1	168	0	0	0	0	0	114.9
409	S	30.6	Very low	30.4	Very low	115 Å²	115	132.8 Å²	132.8	80%	0.804	81%	0.808	S	S	*	*			trans	-146.5	106.1	144.5	61	0	0	0	0	109.6
410	D	29.7	Very low	30.3	Very low	153 Å²	153	131.7 Å²	131.7	82%	0.818	81%	0.812	S	S	*	*			trans	-64	138.7	158.7	-70	-48	0	0	0	109.8
411	T	33.8	Very low	31.3	Very low	144 Å²	144	132.6 Å²	132.6	88%	0.883	82%	0.816	S	S	*	*			trans	-142.5	115.3	146.9	39.4	0	0	0	0	109.9
412	D	28.6	Very low	31.5	Very low	145 Å²	145	133.1 Å²	133.1	78%	0.775	82%	0.821	S	S	*	*			trans	-67.4	139.7	168.7	-162.5	2.2	0	0	0	110.9
413	S	32.2	Very low	31.6	Very low	116 Å²	116	131.6 Å²	131.6	81%	0.811	82%	0.822	S	S	*	*			trans	-159.9	110.5	152.5	64	0	0	0	0	110.5
414	S	29.4	Very low	31.5	Very low	94 Å²	94	132.1 Å²	132.1	66%	0.657	83%	0.829	S	S	*	*			trans	-84	175.1	173.2	15	0	0	0	0	111.7
415	L	31.7	Very low	31.7	Very low	165 Å²	165	130.6 Å²	130.6	86%	0.864	83%	0.829	S	S	*	*			trans	95.2	128.8	176.1	-53.6	162.6	0	0	0	112.4
416	E	32.2	Very low	32.4	Very low	187 Å²	187	136.8 Å²	136.8	87%	0.874	85%	0.845	S	S	*	*			cis	-161.2	157.4	36.3	-139.7	175.1	-152.1	0	0	111.4
417	A	31.5	Very low	32.5	Very low	96 Å²	96	136.4 Å²	136.4	79%	0.793	84%	0.843	S	S	*	*			trans	-90	146.2	-179.7	0	0	0	0	0	112.3
418	S	31.5	Very low	32.6	Very low	123 Å²	123	134.7 Å²	134.7	86%	0.86	84%	0.841	S	S	*	*			trans	-156.1	117.2	149.2	62.4	0	0	0	0	111.5
419	A	33.2	Very low	32.9	Very low	112 Å²	112	137.4 Å²	137.4	93%	0.926	85%	0.848	S	S	*	*			trans	-84.7	152.8	170.9	0	0	0	0	0	111.5
420	G	30.6	Very low	33	Very low	74 Å²	74	138.7 Å²	138.7	76%	0.763	85%	0.85	S	S	*	*			trans	169.1	113.7	165.4	0	0	0	0	0	114.1
421	P	47.7	Very low	33.2	Very low	121 Å²	121	137.8 Å²	137.8	79%	0.786	85%	0.852	S	S	*	*			trans	-107.7	139.2	-172.6	37.1	-27.8	0	0	0	113.8
422	L	34.8	Very low	33.2	Very low	185 Å²	185	137.4 Å²	137.4	97%	0.969	85%	0.85	S	S	*	*			trans	-158.3	137.6	163.4	-71.4	171.8	0	0	0	106.2
423	G	29.6	Very low	33.5	Very low	74 Å²	74	136.9 Å²	136.9	76%	0.763	86%	0.856	S	S	*	*			cis	163.8	142.7	9.8	0	0	0	0	0	106.6
424	C	28.5	Very low	33.6	Very low	130 Å²	130	138.5 Å²	138.5	88%	0.878	86%	0.859	S	S	*	*			trans	-58.6	157.9	176.2	-72	0	0	0	0	114.7
425	C	34.4	Very low	33.9	Very low	127 Å²	127	142.2 Å²	142.2	86%	0.858	88%	0.876	S	S	*	*			trans	144	132.2	146.1	-78.8	0	0	0	0	107.6
426	R	41.8	Very low	34.1	Very low	312 Å²	312	140.1 Å²	140.1	100%	1.177	88%	0.877	S	S	*	*			cis	-161.4	0	24.3	-140	-179.4	-165.5	-178	3.4	109.4

Retrieved 426 of 426 residues in 764.9 ms (Link to these results)

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